USER MOD reduce.3.24.130724 H: found=0, std=0, add=621, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 624 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 NoAdj : A 143 ASNHD21 : A 143 ASN OD1 : A 163 CACA :(metal ligand) USER MOD NoAdj : A 143 ASNHD22 : A 143 ASN OD1 : A 163 CACA :(metal ligand) USER MOD Single : A 81 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 84 CYS SG : rot 180:sc= -0.0238 USER MOD Single : A 85 MET CE :methyl -154:sc= -0.202 (180deg=-0.95) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 THR OG1 : rot 180:sc= 0.387 USER MOD Single : A 98 SER OG : rot -85:sc= 0.58 USER MOD Single : A 103 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 106 LYS NZ :NH3+ -167:sc= -0.972 (180deg=-1.59) USER MOD Single : A 107 ASN : amide:sc= -3.65 K(o=-3.7,f=-14!) USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 MET CE :methyl 151:sc= -0.606 (180deg=-1.5) USER MOD Single : A 122 GLN : amide:sc= -0.0138 X(o=-0.014,f=-0.47) USER MOD Single : A 124 THR OG1 : rot -61:sc= 1.27 USER MOD Single : A 127 THR OG1 : rot 42:sc= 0.574 USER MOD Single : A 129 THR OG1 : rot 180:sc= 0 USER MOD Single : A 137 MET CE :methyl -142:sc= -4.06! (180deg=-6.03!) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 LYS NZ :NH3+ 160:sc=-0.00897 (180deg=-0.147) USER MOD Single : A 144 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 150 TYR OH : rot 180:sc= 0 USER MOD Single : A 157 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 158 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 81 95.769 -14.595 9.321 1.00 0.00 N ATOM 2 CA MET A 81 94.659 -13.975 10.094 1.00 0.00 C ATOM 3 C MET A 81 95.057 -12.603 10.629 1.00 0.00 C ATOM 4 O MET A 81 94.481 -11.586 10.245 1.00 0.00 O ATOM 5 CB MET A 81 94.293 -14.908 11.250 1.00 0.00 C ATOM 6 CG MET A 81 93.630 -16.200 10.804 1.00 0.00 C ATOM 7 SD MET A 81 92.785 -17.049 12.152 1.00 0.00 S ATOM 8 CE MET A 81 93.064 -18.759 11.702 1.00 0.00 C ATOM 0 HA MET A 81 93.800 -13.833 9.438 1.00 0.00 H new ATOM 0 HB2 MET A 81 95.196 -15.148 11.812 1.00 0.00 H new ATOM 0 HB3 MET A 81 93.624 -14.383 11.932 1.00 0.00 H new ATOM 0 HG2 MET A 81 92.914 -15.982 10.012 1.00 0.00 H new ATOM 0 HG3 MET A 81 94.384 -16.862 10.378 1.00 0.00 H new ATOM 0 HE1 MET A 81 92.600 -19.410 12.442 1.00 0.00 H new ATOM 0 HE2 MET A 81 92.627 -18.953 10.723 1.00 0.00 H new ATOM 0 HE3 MET A 81 94.136 -18.956 11.667 1.00 0.00 H new ATOM 20 N VAL A 82 96.045 -12.585 11.518 1.00 0.00 N ATOM 21 CA VAL A 82 96.520 -11.340 12.106 1.00 0.00 C ATOM 22 C VAL A 82 97.282 -10.503 11.083 1.00 0.00 C ATOM 23 O VAL A 82 97.853 -11.037 10.131 1.00 0.00 O ATOM 24 CB VAL A 82 97.428 -11.603 13.324 1.00 0.00 C ATOM 25 CG1 VAL A 82 98.669 -12.381 12.910 1.00 0.00 C ATOM 26 CG2 VAL A 82 97.811 -10.295 14.000 1.00 0.00 C ATOM 0 H VAL A 82 96.532 -13.419 11.846 1.00 0.00 H new ATOM 0 HA VAL A 82 95.639 -10.789 12.435 1.00 0.00 H new ATOM 0 HB VAL A 82 96.872 -12.206 14.042 1.00 0.00 H new ATOM 0 HG11 VAL A 82 99.297 -12.556 13.784 1.00 0.00 H new ATOM 0 HG12 VAL A 82 98.372 -13.337 12.479 1.00 0.00 H new ATOM 0 HG13 VAL A 82 99.228 -11.807 12.171 1.00 0.00 H new ATOM 0 HG21 VAL A 82 98.452 -10.502 14.857 1.00 0.00 H new ATOM 0 HG22 VAL A 82 98.346 -9.662 13.292 1.00 0.00 H new ATOM 0 HG23 VAL A 82 96.910 -9.782 14.336 1.00 0.00 H new ATOM 36 N ARG A 83 97.288 -9.189 11.284 1.00 0.00 N ATOM 37 CA ARG A 83 97.980 -8.279 10.378 1.00 0.00 C ATOM 38 C ARG A 83 99.491 -8.389 10.552 1.00 0.00 C ATOM 39 O ARG A 83 100.087 -7.682 11.365 1.00 0.00 O ATOM 40 CB ARG A 83 97.530 -6.838 10.626 1.00 0.00 C ATOM 41 CG ARG A 83 96.107 -6.560 10.173 1.00 0.00 C ATOM 42 CD ARG A 83 95.775 -5.077 10.250 1.00 0.00 C ATOM 43 NE ARG A 83 94.859 -4.776 11.347 1.00 0.00 N ATOM 44 CZ ARG A 83 93.541 -4.954 11.283 1.00 0.00 C ATOM 45 NH1 ARG A 83 92.982 -5.435 10.179 1.00 0.00 N ATOM 46 NH2 ARG A 83 92.780 -4.653 12.326 1.00 0.00 N ATOM 0 H ARG A 83 96.821 -8.730 12.067 1.00 0.00 H new ATOM 0 HA ARG A 83 97.727 -8.559 9.356 1.00 0.00 H new ATOM 0 HB2 ARG A 83 97.613 -6.618 11.690 1.00 0.00 H new ATOM 0 HB3 ARG A 83 98.207 -6.160 10.106 1.00 0.00 H new ATOM 0 HG2 ARG A 83 95.975 -6.910 9.149 1.00 0.00 H new ATOM 0 HG3 ARG A 83 95.410 -7.122 10.794 1.00 0.00 H new ATOM 0 HD2 ARG A 83 96.695 -4.506 10.379 1.00 0.00 H new ATOM 0 HD3 ARG A 83 95.330 -4.756 9.308 1.00 0.00 H new ATOM 0 HE ARG A 83 95.252 -4.408 12.213 1.00 0.00 H new ATOM 0 HH11 ARG A 83 93.563 -5.670 9.374 1.00 0.00 H new ATOM 0 HH12 ARG A 83 91.972 -5.569 10.136 1.00 0.00 H new ATOM 0 HH21 ARG A 83 93.204 -4.285 13.178 1.00 0.00 H new ATOM 0 HH22 ARG A 83 91.770 -4.789 12.277 1.00 0.00 H new ATOM 60 N CYS A 84 100.109 -9.278 9.780 1.00 0.00 N ATOM 61 CA CYS A 84 101.551 -9.480 9.847 1.00 0.00 C ATOM 62 C CYS A 84 102.181 -9.380 8.461 1.00 0.00 C ATOM 63 O CYS A 84 103.079 -10.149 8.120 1.00 0.00 O ATOM 64 CB CYS A 84 101.868 -10.842 10.468 1.00 0.00 C ATOM 65 SG CYS A 84 101.230 -12.249 9.526 1.00 0.00 S ATOM 0 H CYS A 84 99.632 -9.870 9.100 1.00 0.00 H new ATOM 0 HA CYS A 84 101.973 -8.695 10.475 1.00 0.00 H new ATOM 0 HB2 CYS A 84 102.949 -10.943 10.564 1.00 0.00 H new ATOM 0 HB3 CYS A 84 101.454 -10.875 11.476 1.00 0.00 H new ATOM 0 HG CYS A 84 101.550 -13.356 10.129 1.00 0.00 H new ATOM 71 N MET A 85 101.703 -8.428 7.667 1.00 0.00 N ATOM 72 CA MET A 85 102.220 -8.227 6.318 1.00 0.00 C ATOM 73 C MET A 85 103.144 -7.015 6.265 1.00 0.00 C ATOM 74 O MET A 85 103.148 -6.268 5.286 1.00 0.00 O ATOM 75 CB MET A 85 101.068 -8.049 5.329 1.00 0.00 C ATOM 76 CG MET A 85 100.118 -6.921 5.700 1.00 0.00 C ATOM 77 SD MET A 85 99.007 -6.476 4.352 1.00 0.00 S ATOM 78 CE MET A 85 100.172 -5.845 3.146 1.00 0.00 C ATOM 0 H MET A 85 100.959 -7.784 7.934 1.00 0.00 H new ATOM 0 HA MET A 85 102.794 -9.111 6.040 1.00 0.00 H new ATOM 0 HB2 MET A 85 101.478 -7.857 4.337 1.00 0.00 H new ATOM 0 HB3 MET A 85 100.506 -8.981 5.267 1.00 0.00 H new ATOM 0 HG2 MET A 85 99.529 -7.218 6.568 1.00 0.00 H new ATOM 0 HG3 MET A 85 100.697 -6.045 5.992 1.00 0.00 H new ATOM 0 HE1 MET A 85 99.668 -5.134 2.491 1.00 0.00 H new ATOM 0 HE2 MET A 85 100.993 -5.346 3.660 1.00 0.00 H new ATOM 0 HE3 MET A 85 100.564 -6.671 2.552 1.00 0.00 H new ATOM 88 N LYS A 86 103.927 -6.827 7.322 1.00 0.00 N ATOM 89 CA LYS A 86 104.856 -5.705 7.396 1.00 0.00 C ATOM 90 C LYS A 86 106.247 -6.175 7.808 1.00 0.00 C ATOM 91 O LYS A 86 106.453 -7.350 8.108 1.00 0.00 O ATOM 92 CB LYS A 86 104.342 -4.656 8.385 1.00 0.00 C ATOM 93 CG LYS A 86 103.193 -3.822 7.845 1.00 0.00 C ATOM 94 CD LYS A 86 102.127 -3.588 8.903 1.00 0.00 C ATOM 95 CE LYS A 86 100.736 -3.546 8.290 1.00 0.00 C ATOM 96 NZ LYS A 86 99.765 -2.830 9.165 1.00 0.00 N ATOM 0 H LYS A 86 103.937 -7.437 8.139 1.00 0.00 H new ATOM 0 HA LYS A 86 104.925 -5.256 6.405 1.00 0.00 H new ATOM 0 HB2 LYS A 86 104.019 -5.157 9.298 1.00 0.00 H new ATOM 0 HB3 LYS A 86 105.163 -3.994 8.659 1.00 0.00 H new ATOM 0 HG2 LYS A 86 103.573 -2.863 7.492 1.00 0.00 H new ATOM 0 HG3 LYS A 86 102.750 -4.325 6.986 1.00 0.00 H new ATOM 0 HD2 LYS A 86 102.173 -4.381 9.650 1.00 0.00 H new ATOM 0 HD3 LYS A 86 102.326 -2.650 9.421 1.00 0.00 H new ATOM 0 HE2 LYS A 86 100.782 -3.053 7.319 1.00 0.00 H new ATOM 0 HE3 LYS A 86 100.385 -4.563 8.115 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 98.829 -2.823 8.712 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 99.702 -3.315 10.083 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 100.086 -1.852 9.312 1.00 0.00 H new ATOM 110 N ASP A 87 107.199 -5.248 7.818 1.00 0.00 N ATOM 111 CA ASP A 87 108.572 -5.565 8.194 1.00 0.00 C ATOM 112 C ASP A 87 108.671 -5.878 9.683 1.00 0.00 C ATOM 113 O ASP A 87 107.676 -5.832 10.405 1.00 0.00 O ATOM 114 CB ASP A 87 109.501 -4.402 7.843 1.00 0.00 C ATOM 115 CG ASP A 87 109.012 -3.081 8.402 1.00 0.00 C ATOM 116 OD1 ASP A 87 108.246 -2.387 7.700 1.00 0.00 O ATOM 117 OD2 ASP A 87 109.393 -2.741 9.542 1.00 0.00 O ATOM 0 H ASP A 87 107.045 -4.271 7.570 1.00 0.00 H new ATOM 0 HA ASP A 87 108.880 -6.448 7.635 1.00 0.00 H new ATOM 0 HB2 ASP A 87 110.499 -4.609 8.229 1.00 0.00 H new ATOM 0 HB3 ASP A 87 109.588 -4.325 6.759 1.00 0.00 H new ATOM 122 N ASP A 88 109.880 -6.197 10.137 1.00 0.00 N ATOM 123 CA ASP A 88 110.110 -6.517 11.540 1.00 0.00 C ATOM 124 C ASP A 88 110.305 -5.249 12.364 1.00 0.00 C ATOM 125 O ASP A 88 110.488 -4.162 11.815 1.00 0.00 O ATOM 126 CB ASP A 88 111.333 -7.426 11.685 1.00 0.00 C ATOM 127 CG ASP A 88 112.567 -6.843 11.025 1.00 0.00 C ATOM 128 OD1 ASP A 88 112.936 -5.699 11.364 1.00 0.00 O ATOM 129 OD2 ASP A 88 113.166 -7.531 10.171 1.00 0.00 O ATOM 0 H ASP A 88 110.715 -6.240 9.552 1.00 0.00 H new ATOM 0 HA ASP A 88 109.230 -7.040 11.915 1.00 0.00 H new ATOM 0 HB2 ASP A 88 111.535 -7.593 12.743 1.00 0.00 H new ATOM 0 HB3 ASP A 88 111.114 -8.399 11.245 1.00 0.00 H new ATOM 134 N SER A 89 110.263 -5.393 13.685 1.00 0.00 N ATOM 135 CA SER A 89 110.433 -4.257 14.585 1.00 0.00 C ATOM 136 C SER A 89 111.820 -3.640 14.429 1.00 0.00 C ATOM 137 O SER A 89 111.980 -2.422 14.516 1.00 0.00 O ATOM 138 CB SER A 89 110.213 -4.691 16.034 1.00 0.00 C ATOM 139 OG SER A 89 108.861 -4.517 16.420 1.00 0.00 O ATOM 0 H SER A 89 110.113 -6.285 14.156 1.00 0.00 H new ATOM 0 HA SER A 89 109.690 -3.503 14.323 1.00 0.00 H new ATOM 0 HB2 SER A 89 110.496 -5.737 16.150 1.00 0.00 H new ATOM 0 HB3 SER A 89 110.860 -4.111 16.693 1.00 0.00 H new ATOM 0 HG SER A 89 108.747 -4.804 17.350 1.00 0.00 H new ATOM 145 N LYS A 90 112.819 -4.488 14.202 1.00 0.00 N ATOM 146 CA LYS A 90 114.192 -4.025 14.037 1.00 0.00 C ATOM 147 C LYS A 90 114.301 -3.034 12.882 1.00 0.00 C ATOM 148 O LYS A 90 113.423 -2.970 12.022 1.00 0.00 O ATOM 149 CB LYS A 90 115.127 -5.213 13.796 1.00 0.00 C ATOM 150 CG LYS A 90 115.505 -5.959 15.065 1.00 0.00 C ATOM 151 CD LYS A 90 116.778 -6.767 14.879 1.00 0.00 C ATOM 152 CE LYS A 90 116.693 -8.111 15.582 1.00 0.00 C ATOM 153 NZ LYS A 90 117.603 -9.118 14.972 1.00 0.00 N ATOM 0 H LYS A 90 112.703 -5.499 14.128 1.00 0.00 H new ATOM 0 HA LYS A 90 114.489 -3.517 14.954 1.00 0.00 H new ATOM 0 HB2 LYS A 90 114.648 -5.907 13.106 1.00 0.00 H new ATOM 0 HB3 LYS A 90 116.035 -4.857 13.310 1.00 0.00 H new ATOM 0 HG2 LYS A 90 115.640 -5.248 15.880 1.00 0.00 H new ATOM 0 HG3 LYS A 90 114.690 -6.623 15.354 1.00 0.00 H new ATOM 0 HD2 LYS A 90 116.959 -6.923 13.815 1.00 0.00 H new ATOM 0 HD3 LYS A 90 117.627 -6.205 15.268 1.00 0.00 H new ATOM 0 HE2 LYS A 90 116.945 -7.986 16.635 1.00 0.00 H new ATOM 0 HE3 LYS A 90 115.667 -8.477 15.541 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 117.514 -10.020 15.481 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 117.347 -9.257 13.974 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 118.585 -8.781 15.034 1.00 0.00 H new ATOM 167 N GLY A 91 115.383 -2.262 12.871 1.00 0.00 N ATOM 168 CA GLY A 91 115.587 -1.283 11.819 1.00 0.00 C ATOM 169 C GLY A 91 116.275 -1.870 10.603 1.00 0.00 C ATOM 170 O GLY A 91 116.355 -3.090 10.454 1.00 0.00 O ATOM 0 H GLY A 91 116.123 -2.297 13.572 1.00 0.00 H new ATOM 0 HA2 GLY A 91 114.624 -0.868 11.522 1.00 0.00 H new ATOM 0 HA3 GLY A 91 116.184 -0.457 12.207 1.00 0.00 H new ATOM 174 N LYS A 92 116.772 -0.999 9.729 1.00 0.00 N ATOM 175 CA LYS A 92 117.456 -1.435 8.515 1.00 0.00 C ATOM 176 C LYS A 92 118.611 -2.378 8.843 1.00 0.00 C ATOM 177 O LYS A 92 119.549 -2.006 9.548 1.00 0.00 O ATOM 178 CB LYS A 92 117.976 -0.227 7.735 1.00 0.00 C ATOM 179 CG LYS A 92 116.874 0.691 7.229 1.00 0.00 C ATOM 180 CD LYS A 92 116.853 2.014 7.980 1.00 0.00 C ATOM 181 CE LYS A 92 116.669 3.191 7.036 1.00 0.00 C ATOM 182 NZ LYS A 92 117.356 4.416 7.533 1.00 0.00 N ATOM 0 H LYS A 92 116.714 0.013 9.839 1.00 0.00 H new ATOM 0 HA LYS A 92 116.736 -1.975 7.900 1.00 0.00 H new ATOM 0 HB2 LYS A 92 118.649 0.345 8.374 1.00 0.00 H new ATOM 0 HB3 LYS A 92 118.563 -0.578 6.886 1.00 0.00 H new ATOM 0 HG2 LYS A 92 117.017 0.879 6.165 1.00 0.00 H new ATOM 0 HG3 LYS A 92 115.909 0.196 7.338 1.00 0.00 H new ATOM 0 HD2 LYS A 92 116.046 2.005 8.712 1.00 0.00 H new ATOM 0 HD3 LYS A 92 117.784 2.133 8.534 1.00 0.00 H new ATOM 0 HE2 LYS A 92 117.058 2.931 6.052 1.00 0.00 H new ATOM 0 HE3 LYS A 92 115.605 3.396 6.914 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 117.206 5.195 6.861 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 116.967 4.680 8.461 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 118.375 4.229 7.625 1.00 0.00 H new ATOM 196 N THR A 93 118.534 -3.599 8.323 1.00 0.00 N ATOM 197 CA THR A 93 119.570 -4.597 8.555 1.00 0.00 C ATOM 198 C THR A 93 120.503 -4.694 7.348 1.00 0.00 C ATOM 199 O THR A 93 120.563 -3.780 6.528 1.00 0.00 O ATOM 200 CB THR A 93 118.932 -5.959 8.839 1.00 0.00 C ATOM 201 OG1 THR A 93 119.919 -6.918 9.172 1.00 0.00 O ATOM 202 CG2 THR A 93 118.137 -6.503 7.671 1.00 0.00 C ATOM 0 H THR A 93 117.763 -3.921 7.737 1.00 0.00 H new ATOM 0 HA THR A 93 120.157 -4.292 9.421 1.00 0.00 H new ATOM 0 HB THR A 93 118.251 -5.789 9.673 1.00 0.00 H new ATOM 0 HG1 THR A 93 119.490 -7.781 9.351 1.00 0.00 H new ATOM 0 HG21 THR A 93 117.712 -7.470 7.939 1.00 0.00 H new ATOM 0 HG22 THR A 93 117.333 -5.810 7.423 1.00 0.00 H new ATOM 0 HG23 THR A 93 118.793 -6.621 6.808 1.00 0.00 H new ATOM 210 N GLU A 94 121.229 -5.805 7.242 1.00 0.00 N ATOM 211 CA GLU A 94 122.151 -6.012 6.130 1.00 0.00 C ATOM 212 C GLU A 94 121.443 -5.842 4.788 1.00 0.00 C ATOM 213 O GLU A 94 122.078 -5.553 3.773 1.00 0.00 O ATOM 214 CB GLU A 94 122.778 -7.404 6.215 1.00 0.00 C ATOM 215 CG GLU A 94 124.006 -7.465 7.110 1.00 0.00 C ATOM 216 CD GLU A 94 124.415 -8.887 7.444 1.00 0.00 C ATOM 217 OE1 GLU A 94 123.679 -9.553 8.202 1.00 0.00 O ATOM 218 OE2 GLU A 94 125.470 -9.333 6.948 1.00 0.00 O ATOM 0 H GLU A 94 121.196 -6.574 7.912 1.00 0.00 H new ATOM 0 HA GLU A 94 122.936 -5.259 6.200 1.00 0.00 H new ATOM 0 HB2 GLU A 94 122.033 -8.107 6.587 1.00 0.00 H new ATOM 0 HB3 GLU A 94 123.053 -7.731 5.212 1.00 0.00 H new ATOM 0 HG2 GLU A 94 124.836 -6.959 6.617 1.00 0.00 H new ATOM 0 HG3 GLU A 94 123.805 -6.922 8.034 1.00 0.00 H new ATOM 225 N GLU A 95 120.126 -6.023 4.787 1.00 0.00 N ATOM 226 CA GLU A 95 119.335 -5.887 3.569 1.00 0.00 C ATOM 227 C GLU A 95 119.470 -4.484 2.984 1.00 0.00 C ATOM 228 O GLU A 95 119.366 -4.297 1.770 1.00 0.00 O ATOM 229 CB GLU A 95 117.864 -6.198 3.854 1.00 0.00 C ATOM 230 CG GLU A 95 117.454 -7.608 3.458 1.00 0.00 C ATOM 231 CD GLU A 95 116.639 -8.302 4.533 1.00 0.00 C ATOM 232 OE1 GLU A 95 115.522 -7.827 4.830 1.00 0.00 O ATOM 233 OE2 GLU A 95 117.118 -9.319 5.077 1.00 0.00 O ATOM 0 H GLU A 95 119.584 -6.264 5.617 1.00 0.00 H new ATOM 0 HA GLU A 95 119.714 -6.601 2.838 1.00 0.00 H new ATOM 0 HB2 GLU A 95 117.671 -6.057 4.917 1.00 0.00 H new ATOM 0 HB3 GLU A 95 117.239 -5.483 3.319 1.00 0.00 H new ATOM 0 HG2 GLU A 95 116.874 -7.568 2.536 1.00 0.00 H new ATOM 0 HG3 GLU A 95 118.347 -8.197 3.247 1.00 0.00 H new ATOM 240 N GLU A 96 119.703 -3.502 3.849 1.00 0.00 N ATOM 241 CA GLU A 96 119.852 -2.119 3.411 1.00 0.00 C ATOM 242 C GLU A 96 121.236 -1.879 2.809 1.00 0.00 C ATOM 243 O GLU A 96 121.418 -0.980 1.989 1.00 0.00 O ATOM 244 CB GLU A 96 119.616 -1.158 4.580 1.00 0.00 C ATOM 245 CG GLU A 96 120.700 -1.210 5.645 1.00 0.00 C ATOM 246 CD GLU A 96 121.347 0.140 5.887 1.00 0.00 C ATOM 247 OE1 GLU A 96 120.667 1.168 5.692 1.00 0.00 O ATOM 248 OE2 GLU A 96 122.536 0.168 6.270 1.00 0.00 O ATOM 0 H GLU A 96 119.793 -3.638 4.856 1.00 0.00 H new ATOM 0 HA GLU A 96 119.105 -1.930 2.640 1.00 0.00 H new ATOM 0 HB2 GLU A 96 119.547 -0.141 4.194 1.00 0.00 H new ATOM 0 HB3 GLU A 96 118.656 -1.390 5.041 1.00 0.00 H new ATOM 0 HG2 GLU A 96 120.270 -1.575 6.578 1.00 0.00 H new ATOM 0 HG3 GLU A 96 121.465 -1.926 5.345 1.00 0.00 H new ATOM 255 N LEU A 97 122.207 -2.690 3.221 1.00 0.00 N ATOM 256 CA LEU A 97 123.573 -2.564 2.720 1.00 0.00 C ATOM 257 C LEU A 97 123.610 -2.626 1.195 1.00 0.00 C ATOM 258 O LEU A 97 124.543 -2.127 0.568 1.00 0.00 O ATOM 259 CB LEU A 97 124.459 -3.666 3.308 1.00 0.00 C ATOM 260 CG LEU A 97 124.712 -3.560 4.812 1.00 0.00 C ATOM 261 CD1 LEU A 97 125.632 -4.679 5.277 1.00 0.00 C ATOM 262 CD2 LEU A 97 125.305 -2.204 5.159 1.00 0.00 C ATOM 0 H LEU A 97 122.074 -3.440 3.899 1.00 0.00 H new ATOM 0 HA LEU A 97 123.955 -1.592 3.032 1.00 0.00 H new ATOM 0 HB2 LEU A 97 123.998 -4.631 3.100 1.00 0.00 H new ATOM 0 HB3 LEU A 97 125.419 -3.653 2.792 1.00 0.00 H new ATOM 0 HG LEU A 97 123.758 -3.660 5.330 1.00 0.00 H new ATOM 0 HD11 LEU A 97 125.802 -4.588 6.350 1.00 0.00 H new ATOM 0 HD12 LEU A 97 125.170 -5.643 5.063 1.00 0.00 H new ATOM 0 HD13 LEU A 97 126.585 -4.609 4.752 1.00 0.00 H new ATOM 0 HD21 LEU A 97 125.478 -2.147 6.234 1.00 0.00 H new ATOM 0 HD22 LEU A 97 126.250 -2.074 4.632 1.00 0.00 H new ATOM 0 HD23 LEU A 97 124.612 -1.417 4.861 1.00 0.00 H new ATOM 274 N SER A 98 122.590 -3.244 0.604 1.00 0.00 N ATOM 275 CA SER A 98 122.511 -3.370 -0.846 1.00 0.00 C ATOM 276 C SER A 98 122.237 -2.018 -1.497 1.00 0.00 C ATOM 277 O SER A 98 122.921 -1.622 -2.441 1.00 0.00 O ATOM 278 CB SER A 98 121.415 -4.365 -1.232 1.00 0.00 C ATOM 279 OG SER A 98 120.127 -3.834 -0.970 1.00 0.00 O ATOM 0 H SER A 98 121.809 -3.664 1.107 1.00 0.00 H new ATOM 0 HA SER A 98 123.472 -3.738 -1.206 1.00 0.00 H new ATOM 0 HB2 SER A 98 121.501 -4.613 -2.290 1.00 0.00 H new ATOM 0 HB3 SER A 98 121.549 -5.292 -0.675 1.00 0.00 H new ATOM 0 HG SER A 98 119.887 -4.003 -0.035 1.00 0.00 H new ATOM 285 N ASP A 99 121.232 -1.313 -0.988 1.00 0.00 N ATOM 286 CA ASP A 99 120.867 -0.006 -1.521 1.00 0.00 C ATOM 287 C ASP A 99 122.002 0.995 -1.334 1.00 0.00 C ATOM 288 O ASP A 99 122.309 1.778 -2.234 1.00 0.00 O ATOM 289 CB ASP A 99 119.598 0.511 -0.840 1.00 0.00 C ATOM 290 CG ASP A 99 118.706 1.285 -1.791 1.00 0.00 C ATOM 291 OD1 ASP A 99 119.240 1.901 -2.737 1.00 0.00 O ATOM 292 OD2 ASP A 99 117.474 1.274 -1.591 1.00 0.00 O ATOM 0 H ASP A 99 120.656 -1.625 -0.207 1.00 0.00 H new ATOM 0 HA ASP A 99 120.678 -0.118 -2.589 1.00 0.00 H new ATOM 0 HB2 ASP A 99 119.041 -0.331 -0.428 1.00 0.00 H new ATOM 0 HB3 ASP A 99 119.874 1.152 -0.002 1.00 0.00 H new ATOM 297 N LEU A 100 122.624 0.965 -0.159 1.00 0.00 N ATOM 298 CA LEU A 100 123.726 1.870 0.147 1.00 0.00 C ATOM 299 C LEU A 100 124.874 1.685 -0.842 1.00 0.00 C ATOM 300 O LEU A 100 125.628 2.619 -1.115 1.00 0.00 O ATOM 301 CB LEU A 100 124.224 1.635 1.574 1.00 0.00 C ATOM 302 CG LEU A 100 123.331 2.212 2.673 1.00 0.00 C ATOM 303 CD1 LEU A 100 123.331 1.303 3.893 1.00 0.00 C ATOM 304 CD2 LEU A 100 123.789 3.613 3.050 1.00 0.00 C ATOM 0 H LEU A 100 122.383 0.324 0.597 1.00 0.00 H new ATOM 0 HA LEU A 100 123.358 2.892 0.061 1.00 0.00 H new ATOM 0 HB2 LEU A 100 124.326 0.562 1.735 1.00 0.00 H new ATOM 0 HB3 LEU A 100 125.220 2.068 1.671 1.00 0.00 H new ATOM 0 HG LEU A 100 122.312 2.274 2.292 1.00 0.00 H new ATOM 0 HD11 LEU A 100 122.690 1.730 4.665 1.00 0.00 H new ATOM 0 HD12 LEU A 100 122.956 0.319 3.613 1.00 0.00 H new ATOM 0 HD13 LEU A 100 124.347 1.209 4.276 1.00 0.00 H new ATOM 0 HD21 LEU A 100 123.143 4.009 3.833 1.00 0.00 H new ATOM 0 HD22 LEU A 100 124.816 3.575 3.412 1.00 0.00 H new ATOM 0 HD23 LEU A 100 123.737 4.261 2.175 1.00 0.00 H new ATOM 316 N PHE A 101 125.004 0.473 -1.372 1.00 0.00 N ATOM 317 CA PHE A 101 126.059 0.165 -2.329 1.00 0.00 C ATOM 318 C PHE A 101 125.931 1.023 -3.584 1.00 0.00 C ATOM 319 O PHE A 101 126.923 1.540 -4.097 1.00 0.00 O ATOM 320 CB PHE A 101 126.019 -1.317 -2.704 1.00 0.00 C ATOM 321 CG PHE A 101 127.118 -1.729 -3.643 1.00 0.00 C ATOM 322 CD1 PHE A 101 128.405 -1.941 -3.173 1.00 0.00 C ATOM 323 CD2 PHE A 101 126.864 -1.905 -4.993 1.00 0.00 C ATOM 324 CE1 PHE A 101 129.418 -2.320 -4.034 1.00 0.00 C ATOM 325 CE2 PHE A 101 127.874 -2.282 -5.859 1.00 0.00 C ATOM 326 CZ PHE A 101 129.151 -2.490 -5.378 1.00 0.00 C ATOM 0 H PHE A 101 124.391 -0.312 -1.154 1.00 0.00 H new ATOM 0 HA PHE A 101 127.016 0.389 -1.857 1.00 0.00 H new ATOM 0 HB2 PHE A 101 126.085 -1.915 -1.795 1.00 0.00 H new ATOM 0 HB3 PHE A 101 125.056 -1.541 -3.164 1.00 0.00 H new ATOM 0 HD1 PHE A 101 128.619 -1.809 -2.123 1.00 0.00 H new ATOM 0 HD2 PHE A 101 125.866 -1.746 -5.374 1.00 0.00 H new ATOM 0 HE1 PHE A 101 130.417 -2.483 -3.656 1.00 0.00 H new ATOM 0 HE2 PHE A 101 127.664 -2.414 -6.910 1.00 0.00 H new ATOM 0 HZ PHE A 101 129.941 -2.786 -6.053 1.00 0.00 H new ATOM 336 N ARG A 102 124.703 1.170 -4.073 1.00 0.00 N ATOM 337 CA ARG A 102 124.445 1.964 -5.270 1.00 0.00 C ATOM 338 C ARG A 102 124.937 3.397 -5.091 1.00 0.00 C ATOM 339 O ARG A 102 125.583 3.957 -5.978 1.00 0.00 O ATOM 340 CB ARG A 102 122.950 1.963 -5.595 1.00 0.00 C ATOM 341 CG ARG A 102 122.633 2.440 -7.001 1.00 0.00 C ATOM 342 CD ARG A 102 122.148 3.881 -7.005 1.00 0.00 C ATOM 343 NE ARG A 102 121.948 4.387 -8.361 1.00 0.00 N ATOM 344 CZ ARG A 102 121.472 5.599 -8.637 1.00 0.00 C ATOM 345 NH1 ARG A 102 121.148 6.432 -7.655 1.00 0.00 N ATOM 346 NH2 ARG A 102 121.321 5.981 -9.897 1.00 0.00 N ATOM 0 H ARG A 102 123.871 0.750 -3.659 1.00 0.00 H new ATOM 0 HA ARG A 102 124.991 1.513 -6.099 1.00 0.00 H new ATOM 0 HB2 ARG A 102 122.559 0.954 -5.466 1.00 0.00 H new ATOM 0 HB3 ARG A 102 122.431 2.600 -4.879 1.00 0.00 H new ATOM 0 HG2 ARG A 102 123.522 2.353 -7.625 1.00 0.00 H new ATOM 0 HG3 ARG A 102 121.871 1.797 -7.441 1.00 0.00 H new ATOM 0 HD2 ARG A 102 121.212 3.950 -6.450 1.00 0.00 H new ATOM 0 HD3 ARG A 102 122.873 4.509 -6.487 1.00 0.00 H new ATOM 0 HE ARG A 102 122.187 3.776 -9.142 1.00 0.00 H new ATOM 0 HH11 ARG A 102 121.263 6.144 -6.683 1.00 0.00 H new ATOM 0 HH12 ARG A 102 120.784 7.360 -7.872 1.00 0.00 H new ATOM 0 HH21 ARG A 102 121.570 5.346 -10.656 1.00 0.00 H new ATOM 0 HH22 ARG A 102 120.956 6.910 -10.108 1.00 0.00 H new ATOM 360 N MET A 103 124.626 3.987 -3.941 1.00 0.00 N ATOM 361 CA MET A 103 125.034 5.357 -3.648 1.00 0.00 C ATOM 362 C MET A 103 126.539 5.527 -3.828 1.00 0.00 C ATOM 363 O MET A 103 126.998 6.513 -4.406 1.00 0.00 O ATOM 364 CB MET A 103 124.635 5.735 -2.221 1.00 0.00 C ATOM 365 CG MET A 103 123.251 6.356 -2.120 1.00 0.00 C ATOM 366 SD MET A 103 123.302 8.155 -2.019 1.00 0.00 S ATOM 367 CE MET A 103 123.472 8.390 -0.251 1.00 0.00 C ATOM 0 H MET A 103 124.093 3.538 -3.197 1.00 0.00 H new ATOM 0 HA MET A 103 124.525 6.019 -4.349 1.00 0.00 H new ATOM 0 HB2 MET A 103 124.671 4.844 -1.595 1.00 0.00 H new ATOM 0 HB3 MET A 103 125.368 6.435 -1.821 1.00 0.00 H new ATOM 0 HG2 MET A 103 122.661 6.061 -2.988 1.00 0.00 H new ATOM 0 HG3 MET A 103 122.743 5.961 -1.240 1.00 0.00 H new ATOM 0 HE1 MET A 103 123.517 9.456 -0.028 1.00 0.00 H new ATOM 0 HE2 MET A 103 122.615 7.949 0.259 1.00 0.00 H new ATOM 0 HE3 MET A 103 124.387 7.908 0.094 1.00 0.00 H new ATOM 377 N PHE A 104 127.302 4.561 -3.329 1.00 0.00 N ATOM 378 CA PHE A 104 128.756 4.604 -3.436 1.00 0.00 C ATOM 379 C PHE A 104 129.201 4.443 -4.887 1.00 0.00 C ATOM 380 O PHE A 104 130.258 4.937 -5.279 1.00 0.00 O ATOM 381 CB PHE A 104 129.384 3.507 -2.574 1.00 0.00 C ATOM 382 CG PHE A 104 129.473 3.866 -1.117 1.00 0.00 C ATOM 383 CD1 PHE A 104 128.330 4.175 -0.397 1.00 0.00 C ATOM 384 CD2 PHE A 104 130.698 3.893 -0.472 1.00 0.00 C ATOM 385 CE1 PHE A 104 128.409 4.505 0.943 1.00 0.00 C ATOM 386 CE2 PHE A 104 130.782 4.222 0.868 1.00 0.00 C ATOM 387 CZ PHE A 104 129.636 4.528 1.576 1.00 0.00 C ATOM 0 H PHE A 104 126.938 3.739 -2.847 1.00 0.00 H new ATOM 0 HA PHE A 104 129.093 5.577 -3.078 1.00 0.00 H new ATOM 0 HB2 PHE A 104 128.799 2.593 -2.680 1.00 0.00 H new ATOM 0 HB3 PHE A 104 130.384 3.290 -2.948 1.00 0.00 H new ATOM 0 HD1 PHE A 104 127.368 4.158 -0.888 1.00 0.00 H new ATOM 0 HD2 PHE A 104 131.597 3.655 -1.021 1.00 0.00 H new ATOM 0 HE1 PHE A 104 127.512 4.745 1.494 1.00 0.00 H new ATOM 0 HE2 PHE A 104 131.743 4.240 1.361 1.00 0.00 H new ATOM 0 HZ PHE A 104 129.700 4.785 2.623 1.00 0.00 H new ATOM 397 N ASP A 105 128.390 3.750 -5.679 1.00 0.00 N ATOM 398 CA ASP A 105 128.703 3.526 -7.085 1.00 0.00 C ATOM 399 C ASP A 105 128.254 4.711 -7.937 1.00 0.00 C ATOM 400 O ASP A 105 127.121 4.747 -8.419 1.00 0.00 O ATOM 401 CB ASP A 105 128.033 2.242 -7.581 1.00 0.00 C ATOM 402 CG ASP A 105 128.971 1.379 -8.401 1.00 0.00 C ATOM 403 OD1 ASP A 105 129.182 1.695 -9.591 1.00 0.00 O ATOM 404 OD2 ASP A 105 129.495 0.386 -7.854 1.00 0.00 O ATOM 0 H ASP A 105 127.511 3.334 -5.371 1.00 0.00 H new ATOM 0 HA ASP A 105 129.784 3.422 -7.179 1.00 0.00 H new ATOM 0 HB2 ASP A 105 127.672 1.670 -6.726 1.00 0.00 H new ATOM 0 HB3 ASP A 105 127.161 2.500 -8.183 1.00 0.00 H new ATOM 409 N LYS A 106 129.148 5.678 -8.115 1.00 0.00 N ATOM 410 CA LYS A 106 128.843 6.866 -8.905 1.00 0.00 C ATOM 411 C LYS A 106 128.399 6.485 -10.313 1.00 0.00 C ATOM 412 O LYS A 106 127.366 6.949 -10.794 1.00 0.00 O ATOM 413 CB LYS A 106 130.067 7.785 -8.971 1.00 0.00 C ATOM 414 CG LYS A 106 129.805 9.186 -8.444 1.00 0.00 C ATOM 415 CD LYS A 106 129.141 10.063 -9.497 1.00 0.00 C ATOM 416 CE LYS A 106 127.822 10.632 -8.997 1.00 0.00 C ATOM 417 NZ LYS A 106 126.879 9.559 -8.572 1.00 0.00 N ATOM 0 H LYS A 106 130.090 5.663 -7.723 1.00 0.00 H new ATOM 0 HA LYS A 106 128.024 7.397 -8.419 1.00 0.00 H new ATOM 0 HB2 LYS A 106 130.879 7.336 -8.399 1.00 0.00 H new ATOM 0 HB3 LYS A 106 130.405 7.852 -10.005 1.00 0.00 H new ATOM 0 HG2 LYS A 106 129.168 9.131 -7.561 1.00 0.00 H new ATOM 0 HG3 LYS A 106 130.745 9.640 -8.131 1.00 0.00 H new ATOM 0 HD2 LYS A 106 129.811 10.879 -9.768 1.00 0.00 H new ATOM 0 HD3 LYS A 106 128.967 9.480 -10.401 1.00 0.00 H new ATOM 0 HE2 LYS A 106 128.011 11.303 -8.159 1.00 0.00 H new ATOM 0 HE3 LYS A 106 127.362 11.228 -9.785 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 125.928 9.961 -8.449 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 126.849 8.815 -9.299 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 127.201 9.150 -7.672 1.00 0.00 H new ATOM 431 N ASN A 107 129.186 5.639 -10.967 1.00 0.00 N ATOM 432 CA ASN A 107 128.874 5.196 -12.321 1.00 0.00 C ATOM 433 C ASN A 107 127.804 4.106 -12.309 1.00 0.00 C ATOM 434 O ASN A 107 127.052 3.952 -13.271 1.00 0.00 O ATOM 435 CB ASN A 107 130.135 4.680 -13.015 1.00 0.00 C ATOM 436 CG ASN A 107 130.824 3.583 -12.225 1.00 0.00 C ATOM 437 OD1 ASN A 107 130.397 3.234 -11.124 1.00 0.00 O ATOM 438 ND2 ASN A 107 131.895 3.035 -12.784 1.00 0.00 N ATOM 0 H ASN A 107 130.045 5.246 -10.582 1.00 0.00 H new ATOM 0 HA ASN A 107 128.487 6.052 -12.874 1.00 0.00 H new ATOM 0 HB2 ASN A 107 129.873 4.302 -14.003 1.00 0.00 H new ATOM 0 HB3 ASN A 107 130.829 5.507 -13.163 1.00 0.00 H new ATOM 0 HD21 ASN A 107 132.400 2.293 -12.299 1.00 0.00 H new ATOM 0 HD22 ASN A 107 132.213 3.356 -13.698 1.00 0.00 H new ATOM 445 N ALA A 108 127.744 3.352 -11.215 1.00 0.00 N ATOM 446 CA ALA A 108 126.768 2.276 -11.078 1.00 0.00 C ATOM 447 C ALA A 108 127.032 1.162 -12.088 1.00 0.00 C ATOM 448 O ALA A 108 126.210 0.895 -12.963 1.00 0.00 O ATOM 449 CB ALA A 108 125.355 2.820 -11.243 1.00 0.00 C ATOM 0 H ALA A 108 128.360 3.467 -10.410 1.00 0.00 H new ATOM 0 HA ALA A 108 126.867 1.854 -10.078 1.00 0.00 H new ATOM 0 HB1 ALA A 108 124.637 2.006 -11.138 1.00 0.00 H new ATOM 0 HB2 ALA A 108 125.164 3.573 -10.479 1.00 0.00 H new ATOM 0 HB3 ALA A 108 125.251 3.270 -12.230 1.00 0.00 H new ATOM 455 N ASP A 109 128.186 0.515 -11.956 1.00 0.00 N ATOM 456 CA ASP A 109 128.560 -0.570 -12.855 1.00 0.00 C ATOM 457 C ASP A 109 128.569 -1.913 -12.124 1.00 0.00 C ATOM 458 O ASP A 109 128.479 -2.970 -12.749 1.00 0.00 O ATOM 459 CB ASP A 109 129.938 -0.303 -13.463 1.00 0.00 C ATOM 460 CG ASP A 109 131.021 -0.169 -12.411 1.00 0.00 C ATOM 461 OD1 ASP A 109 130.684 0.147 -11.250 1.00 0.00 O ATOM 462 OD2 ASP A 109 132.205 -0.383 -12.746 1.00 0.00 O ATOM 0 H ASP A 109 128.877 0.723 -11.236 1.00 0.00 H new ATOM 0 HA ASP A 109 127.817 -0.616 -13.651 1.00 0.00 H new ATOM 0 HB2 ASP A 109 130.195 -1.115 -14.143 1.00 0.00 H new ATOM 0 HB3 ASP A 109 129.899 0.610 -14.057 1.00 0.00 H new ATOM 467 N GLY A 110 128.678 -1.864 -10.799 1.00 0.00 N ATOM 468 CA GLY A 110 128.696 -3.082 -10.010 1.00 0.00 C ATOM 469 C GLY A 110 129.922 -3.189 -9.119 1.00 0.00 C ATOM 470 O GLY A 110 130.085 -4.172 -8.395 1.00 0.00 O ATOM 0 H GLY A 110 128.754 -1.002 -10.258 1.00 0.00 H new ATOM 0 HA2 GLY A 110 127.799 -3.122 -9.392 1.00 0.00 H new ATOM 0 HA3 GLY A 110 128.662 -3.943 -10.678 1.00 0.00 H new ATOM 474 N TYR A 111 130.783 -2.177 -9.168 1.00 0.00 N ATOM 475 CA TYR A 111 131.995 -2.165 -8.357 1.00 0.00 C ATOM 476 C TYR A 111 132.457 -0.735 -8.099 1.00 0.00 C ATOM 477 O TYR A 111 132.074 0.190 -8.815 1.00 0.00 O ATOM 478 CB TYR A 111 133.106 -2.955 -9.051 1.00 0.00 C ATOM 479 CG TYR A 111 132.779 -4.419 -9.245 1.00 0.00 C ATOM 480 CD1 TYR A 111 132.083 -4.852 -10.367 1.00 0.00 C ATOM 481 CD2 TYR A 111 133.165 -5.367 -8.306 1.00 0.00 C ATOM 482 CE1 TYR A 111 131.782 -6.188 -10.548 1.00 0.00 C ATOM 483 CE2 TYR A 111 132.869 -6.706 -8.481 1.00 0.00 C ATOM 484 CZ TYR A 111 132.177 -7.110 -9.602 1.00 0.00 C ATOM 485 OH TYR A 111 131.880 -8.443 -9.779 1.00 0.00 O ATOM 0 H TYR A 111 130.664 -1.355 -9.760 1.00 0.00 H new ATOM 0 HA TYR A 111 131.769 -2.635 -7.400 1.00 0.00 H new ATOM 0 HB2 TYR A 111 133.308 -2.505 -10.023 1.00 0.00 H new ATOM 0 HB3 TYR A 111 134.021 -2.870 -8.465 1.00 0.00 H new ATOM 0 HD1 TYR A 111 131.772 -4.132 -11.110 1.00 0.00 H new ATOM 0 HD2 TYR A 111 133.705 -5.053 -7.425 1.00 0.00 H new ATOM 0 HE1 TYR A 111 131.240 -6.509 -11.426 1.00 0.00 H new ATOM 0 HE2 TYR A 111 133.178 -7.431 -7.743 1.00 0.00 H new ATOM 0 HH TYR A 111 132.230 -8.959 -9.023 1.00 0.00 H new ATOM 495 N ILE A 112 133.283 -0.559 -7.072 1.00 0.00 N ATOM 496 CA ILE A 112 133.795 0.760 -6.723 1.00 0.00 C ATOM 497 C ILE A 112 135.316 0.747 -6.604 1.00 0.00 C ATOM 498 O ILE A 112 135.916 -0.277 -6.281 1.00 0.00 O ATOM 499 CB ILE A 112 133.190 1.273 -5.400 1.00 0.00 C ATOM 500 CG1 ILE A 112 131.686 0.993 -5.353 1.00 0.00 C ATOM 501 CG2 ILE A 112 133.459 2.761 -5.233 1.00 0.00 C ATOM 502 CD1 ILE A 112 131.083 1.162 -3.976 1.00 0.00 C ATOM 0 H ILE A 112 133.611 -1.313 -6.468 1.00 0.00 H new ATOM 0 HA ILE A 112 133.502 1.433 -7.529 1.00 0.00 H new ATOM 0 HB ILE A 112 133.665 0.741 -4.576 1.00 0.00 H new ATOM 0 HG12 ILE A 112 131.178 1.662 -6.048 1.00 0.00 H new ATOM 0 HG13 ILE A 112 131.503 -0.024 -5.699 1.00 0.00 H new ATOM 0 HG21 ILE A 112 133.025 3.106 -4.294 1.00 0.00 H new ATOM 0 HG22 ILE A 112 134.535 2.937 -5.222 1.00 0.00 H new ATOM 0 HG23 ILE A 112 133.010 3.307 -6.063 1.00 0.00 H new ATOM 0 HD11 ILE A 112 130.015 0.948 -4.018 1.00 0.00 H new ATOM 0 HD12 ILE A 112 131.564 0.474 -3.281 1.00 0.00 H new ATOM 0 HD13 ILE A 112 131.234 2.186 -3.636 1.00 0.00 H new ATOM 514 N ASP A 113 135.931 1.895 -6.871 1.00 0.00 N ATOM 515 CA ASP A 113 137.382 2.024 -6.795 1.00 0.00 C ATOM 516 C ASP A 113 137.775 3.278 -6.023 1.00 0.00 C ATOM 517 O ASP A 113 136.923 4.091 -5.663 1.00 0.00 O ATOM 518 CB ASP A 113 137.984 2.066 -8.202 1.00 0.00 C ATOM 519 CG ASP A 113 139.411 1.553 -8.236 1.00 0.00 C ATOM 520 OD1 ASP A 113 140.329 2.331 -7.899 1.00 0.00 O ATOM 521 OD2 ASP A 113 139.610 0.376 -8.601 1.00 0.00 O ATOM 0 H ASP A 113 135.446 2.750 -7.142 1.00 0.00 H new ATOM 0 HA ASP A 113 137.774 1.156 -6.265 1.00 0.00 H new ATOM 0 HB2 ASP A 113 137.370 1.468 -8.875 1.00 0.00 H new ATOM 0 HB3 ASP A 113 137.960 3.090 -8.574 1.00 0.00 H new ATOM 526 N LEU A 114 139.072 3.431 -5.770 1.00 0.00 N ATOM 527 CA LEU A 114 139.578 4.587 -5.038 1.00 0.00 C ATOM 528 C LEU A 114 139.173 5.890 -5.722 1.00 0.00 C ATOM 529 O LEU A 114 139.005 6.918 -5.066 1.00 0.00 O ATOM 530 CB LEU A 114 141.103 4.513 -4.922 1.00 0.00 C ATOM 531 CG LEU A 114 141.630 3.345 -4.080 1.00 0.00 C ATOM 532 CD1 LEU A 114 142.552 2.462 -4.908 1.00 0.00 C ATOM 533 CD2 LEU A 114 142.352 3.860 -2.844 1.00 0.00 C ATOM 0 H LEU A 114 139.791 2.769 -6.061 1.00 0.00 H new ATOM 0 HA LEU A 114 139.140 4.572 -4.040 1.00 0.00 H new ATOM 0 HB2 LEU A 114 141.526 4.440 -5.924 1.00 0.00 H new ATOM 0 HB3 LEU A 114 141.466 5.446 -4.490 1.00 0.00 H new ATOM 0 HG LEU A 114 140.780 2.745 -3.756 1.00 0.00 H new ATOM 0 HD11 LEU A 114 142.916 1.639 -4.293 1.00 0.00 H new ATOM 0 HD12 LEU A 114 142.004 2.063 -5.761 1.00 0.00 H new ATOM 0 HD13 LEU A 114 143.398 3.051 -5.263 1.00 0.00 H new ATOM 0 HD21 LEU A 114 142.719 3.017 -2.259 1.00 0.00 H new ATOM 0 HD22 LEU A 114 143.193 4.484 -3.147 1.00 0.00 H new ATOM 0 HD23 LEU A 114 141.663 4.449 -2.239 1.00 0.00 H new ATOM 545 N GLU A 115 139.018 5.840 -7.041 1.00 0.00 N ATOM 546 CA GLU A 115 138.632 7.019 -7.809 1.00 0.00 C ATOM 547 C GLU A 115 137.175 7.389 -7.545 1.00 0.00 C ATOM 548 O GLU A 115 136.845 8.558 -7.365 1.00 0.00 O ATOM 549 CB GLU A 115 138.844 6.771 -9.304 1.00 0.00 C ATOM 550 CG GLU A 115 138.739 8.031 -10.149 1.00 0.00 C ATOM 551 CD GLU A 115 139.978 8.278 -10.989 1.00 0.00 C ATOM 552 OE1 GLU A 115 140.257 7.460 -11.891 1.00 0.00 O ATOM 553 OE2 GLU A 115 140.669 9.290 -10.743 1.00 0.00 O ATOM 0 H GLU A 115 139.153 4.998 -7.600 1.00 0.00 H new ATOM 0 HA GLU A 115 139.262 7.850 -7.492 1.00 0.00 H new ATOM 0 HB2 GLU A 115 139.826 6.323 -9.454 1.00 0.00 H new ATOM 0 HB3 GLU A 115 138.107 6.047 -9.652 1.00 0.00 H new ATOM 0 HG2 GLU A 115 137.871 7.953 -10.804 1.00 0.00 H new ATOM 0 HG3 GLU A 115 138.571 8.888 -9.497 1.00 0.00 H new ATOM 560 N GLU A 116 136.307 6.384 -7.538 1.00 0.00 N ATOM 561 CA GLU A 116 134.883 6.605 -7.306 1.00 0.00 C ATOM 562 C GLU A 116 134.603 6.913 -5.836 1.00 0.00 C ATOM 563 O GLU A 116 134.056 7.964 -5.503 1.00 0.00 O ATOM 564 CB GLU A 116 134.089 5.369 -7.734 1.00 0.00 C ATOM 565 CG GLU A 116 132.696 5.690 -8.250 1.00 0.00 C ATOM 566 CD GLU A 116 132.163 4.623 -9.186 1.00 0.00 C ATOM 567 OE1 GLU A 116 132.559 4.620 -10.371 1.00 0.00 O ATOM 568 OE2 GLU A 116 131.348 3.792 -8.735 1.00 0.00 O ATOM 0 H GLU A 116 136.563 5.409 -7.690 1.00 0.00 H new ATOM 0 HA GLU A 116 134.573 7.465 -7.900 1.00 0.00 H new ATOM 0 HB2 GLU A 116 134.643 4.843 -8.511 1.00 0.00 H new ATOM 0 HB3 GLU A 116 134.006 4.689 -6.886 1.00 0.00 H new ATOM 0 HG2 GLU A 116 132.016 5.800 -7.405 1.00 0.00 H new ATOM 0 HG3 GLU A 116 132.717 6.648 -8.770 1.00 0.00 H new ATOM 575 N LEU A 117 134.968 5.977 -4.967 1.00 0.00 N ATOM 576 CA LEU A 117 134.750 6.119 -3.529 1.00 0.00 C ATOM 577 C LEU A 117 135.232 7.474 -3.014 1.00 0.00 C ATOM 578 O LEU A 117 134.683 8.009 -2.051 1.00 0.00 O ATOM 579 CB LEU A 117 135.462 4.996 -2.773 1.00 0.00 C ATOM 580 CG LEU A 117 135.308 5.041 -1.253 1.00 0.00 C ATOM 581 CD1 LEU A 117 133.866 4.773 -0.852 1.00 0.00 C ATOM 582 CD2 LEU A 117 136.242 4.038 -0.593 1.00 0.00 C ATOM 0 H LEU A 117 135.421 5.103 -5.235 1.00 0.00 H new ATOM 0 HA LEU A 117 133.676 6.055 -3.353 1.00 0.00 H new ATOM 0 HB2 LEU A 117 135.084 4.039 -3.133 1.00 0.00 H new ATOM 0 HB3 LEU A 117 136.524 5.031 -3.017 1.00 0.00 H new ATOM 0 HG LEU A 117 135.578 6.040 -0.910 1.00 0.00 H new ATOM 0 HD11 LEU A 117 133.778 4.809 0.234 1.00 0.00 H new ATOM 0 HD12 LEU A 117 133.219 5.530 -1.294 1.00 0.00 H new ATOM 0 HD13 LEU A 117 133.567 3.787 -1.208 1.00 0.00 H new ATOM 0 HD21 LEU A 117 136.119 4.084 0.489 1.00 0.00 H new ATOM 0 HD22 LEU A 117 136.004 3.034 -0.943 1.00 0.00 H new ATOM 0 HD23 LEU A 117 137.274 4.277 -0.851 1.00 0.00 H new ATOM 594 N LYS A 118 136.259 8.021 -3.652 1.00 0.00 N ATOM 595 CA LYS A 118 136.806 9.310 -3.238 1.00 0.00 C ATOM 596 C LYS A 118 135.854 10.453 -3.590 1.00 0.00 C ATOM 597 O LYS A 118 135.891 11.515 -2.966 1.00 0.00 O ATOM 598 CB LYS A 118 138.178 9.546 -3.878 1.00 0.00 C ATOM 599 CG LYS A 118 138.127 9.809 -5.376 1.00 0.00 C ATOM 600 CD LYS A 118 138.974 11.010 -5.763 1.00 0.00 C ATOM 601 CE LYS A 118 139.039 11.186 -7.272 1.00 0.00 C ATOM 602 NZ LYS A 118 138.381 12.448 -7.714 1.00 0.00 N ATOM 0 H LYS A 118 136.728 7.597 -4.452 1.00 0.00 H new ATOM 0 HA LYS A 118 136.925 9.288 -2.155 1.00 0.00 H new ATOM 0 HB2 LYS A 118 138.655 10.394 -3.387 1.00 0.00 H new ATOM 0 HB3 LYS A 118 138.808 8.676 -3.694 1.00 0.00 H new ATOM 0 HG2 LYS A 118 138.478 8.928 -5.913 1.00 0.00 H new ATOM 0 HG3 LYS A 118 137.094 9.978 -5.681 1.00 0.00 H new ATOM 0 HD2 LYS A 118 138.559 11.910 -5.309 1.00 0.00 H new ATOM 0 HD3 LYS A 118 139.982 10.888 -5.367 1.00 0.00 H new ATOM 0 HE2 LYS A 118 140.081 11.188 -7.592 1.00 0.00 H new ATOM 0 HE3 LYS A 118 138.558 10.337 -7.757 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 138.447 12.530 -8.749 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 137.380 12.435 -7.431 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 138.856 13.261 -7.271 1.00 0.00 H new ATOM 616 N ILE A 119 135.002 10.232 -4.588 1.00 0.00 N ATOM 617 CA ILE A 119 134.045 11.248 -5.010 1.00 0.00 C ATOM 618 C ILE A 119 132.898 11.373 -4.012 1.00 0.00 C ATOM 619 O ILE A 119 132.504 12.478 -3.639 1.00 0.00 O ATOM 620 CB ILE A 119 133.466 10.933 -6.405 1.00 0.00 C ATOM 621 CG1 ILE A 119 134.595 10.718 -7.413 1.00 0.00 C ATOM 622 CG2 ILE A 119 132.545 12.054 -6.866 1.00 0.00 C ATOM 623 CD1 ILE A 119 134.157 9.985 -8.662 1.00 0.00 C ATOM 0 H ILE A 119 134.956 9.361 -5.117 1.00 0.00 H new ATOM 0 HA ILE A 119 134.588 12.192 -5.055 1.00 0.00 H new ATOM 0 HB ILE A 119 132.882 10.015 -6.338 1.00 0.00 H new ATOM 0 HG12 ILE A 119 135.008 11.686 -7.696 1.00 0.00 H new ATOM 0 HG13 ILE A 119 135.397 10.156 -6.934 1.00 0.00 H new ATOM 0 HG21 ILE A 119 132.146 11.815 -7.852 1.00 0.00 H new ATOM 0 HG22 ILE A 119 131.723 12.164 -6.159 1.00 0.00 H new ATOM 0 HG23 ILE A 119 133.106 12.987 -6.918 1.00 0.00 H new ATOM 0 HD11 ILE A 119 135.008 9.868 -9.332 1.00 0.00 H new ATOM 0 HD12 ILE A 119 133.771 9.003 -8.391 1.00 0.00 H new ATOM 0 HD13 ILE A 119 133.376 10.556 -9.164 1.00 0.00 H new ATOM 635 N MET A 120 132.367 10.234 -3.581 1.00 0.00 N ATOM 636 CA MET A 120 131.264 10.216 -2.626 1.00 0.00 C ATOM 637 C MET A 120 131.649 10.930 -1.333 1.00 0.00 C ATOM 638 O MET A 120 130.809 11.548 -0.680 1.00 0.00 O ATOM 639 CB MET A 120 130.849 8.776 -2.320 1.00 0.00 C ATOM 640 CG MET A 120 129.534 8.670 -1.563 1.00 0.00 C ATOM 641 SD MET A 120 129.586 7.435 -0.249 1.00 0.00 S ATOM 642 CE MET A 120 130.897 8.089 0.779 1.00 0.00 C ATOM 0 H MET A 120 132.682 9.311 -3.878 1.00 0.00 H new ATOM 0 HA MET A 120 130.422 10.743 -3.075 1.00 0.00 H new ATOM 0 HB2 MET A 120 130.765 8.224 -3.256 1.00 0.00 H new ATOM 0 HB3 MET A 120 131.635 8.296 -1.736 1.00 0.00 H new ATOM 0 HG2 MET A 120 129.287 9.641 -1.134 1.00 0.00 H new ATOM 0 HG3 MET A 120 128.736 8.418 -2.262 1.00 0.00 H new ATOM 0 HE1 MET A 120 130.728 7.794 1.815 1.00 0.00 H new ATOM 0 HE2 MET A 120 131.855 7.695 0.441 1.00 0.00 H new ATOM 0 HE3 MET A 120 130.907 9.177 0.708 1.00 0.00 H new ATOM 652 N LEU A 121 132.925 10.841 -0.973 1.00 0.00 N ATOM 653 CA LEU A 121 133.422 11.479 0.242 1.00 0.00 C ATOM 654 C LEU A 121 133.438 12.998 0.101 1.00 0.00 C ATOM 655 O LEU A 121 133.469 13.721 1.097 1.00 0.00 O ATOM 656 CB LEU A 121 134.828 10.968 0.572 1.00 0.00 C ATOM 657 CG LEU A 121 134.915 10.072 1.810 1.00 0.00 C ATOM 658 CD1 LEU A 121 134.769 8.609 1.422 1.00 0.00 C ATOM 659 CD2 LEU A 121 136.228 10.302 2.543 1.00 0.00 C ATOM 0 H LEU A 121 133.633 10.334 -1.504 1.00 0.00 H new ATOM 0 HA LEU A 121 132.746 11.220 1.057 1.00 0.00 H new ATOM 0 HB2 LEU A 121 135.208 10.414 -0.287 1.00 0.00 H new ATOM 0 HB3 LEU A 121 135.486 11.825 0.715 1.00 0.00 H new ATOM 0 HG LEU A 121 134.096 10.332 2.481 1.00 0.00 H new ATOM 0 HD11 LEU A 121 134.833 7.988 2.315 1.00 0.00 H new ATOM 0 HD12 LEU A 121 133.803 8.455 0.942 1.00 0.00 H new ATOM 0 HD13 LEU A 121 135.566 8.335 0.731 1.00 0.00 H new ATOM 0 HD21 LEU A 121 136.273 9.657 3.420 1.00 0.00 H new ATOM 0 HD22 LEU A 121 137.061 10.070 1.879 1.00 0.00 H new ATOM 0 HD23 LEU A 121 136.293 11.344 2.855 1.00 0.00 H new ATOM 671 N GLN A 122 133.408 13.482 -1.138 1.00 0.00 N ATOM 672 CA GLN A 122 133.414 14.916 -1.394 1.00 0.00 C ATOM 673 C GLN A 122 132.142 15.568 -0.860 1.00 0.00 C ATOM 674 O GLN A 122 132.128 16.758 -0.550 1.00 0.00 O ATOM 675 CB GLN A 122 133.551 15.187 -2.894 1.00 0.00 C ATOM 676 CG GLN A 122 134.861 14.692 -3.485 1.00 0.00 C ATOM 677 CD GLN A 122 135.241 15.425 -4.756 1.00 0.00 C ATOM 678 OE1 GLN A 122 135.206 14.856 -5.848 1.00 0.00 O ATOM 679 NE2 GLN A 122 135.606 16.694 -4.621 1.00 0.00 N ATOM 0 H GLN A 122 133.379 12.903 -1.977 1.00 0.00 H new ATOM 0 HA GLN A 122 134.269 15.350 -0.875 1.00 0.00 H new ATOM 0 HB2 GLN A 122 132.723 14.710 -3.418 1.00 0.00 H new ATOM 0 HB3 GLN A 122 133.465 16.259 -3.070 1.00 0.00 H new ATOM 0 HG2 GLN A 122 135.656 14.813 -2.749 1.00 0.00 H new ATOM 0 HG3 GLN A 122 134.780 13.626 -3.695 1.00 0.00 H new ATOM 0 HE21 GLN A 122 135.620 17.125 -3.697 1.00 0.00 H new ATOM 0 HE22 GLN A 122 135.872 17.238 -5.442 1.00 0.00 H new ATOM 688 N ALA A 123 131.077 14.779 -0.754 1.00 0.00 N ATOM 689 CA ALA A 123 129.801 15.278 -0.254 1.00 0.00 C ATOM 690 C ALA A 123 129.964 15.904 1.126 1.00 0.00 C ATOM 691 O ALA A 123 129.465 16.999 1.386 1.00 0.00 O ATOM 692 CB ALA A 123 128.775 14.155 -0.210 1.00 0.00 C ATOM 0 H ALA A 123 131.073 13.791 -1.008 1.00 0.00 H new ATOM 0 HA ALA A 123 129.446 16.050 -0.936 1.00 0.00 H new ATOM 0 HB1 ALA A 123 127.828 14.542 0.165 1.00 0.00 H new ATOM 0 HB2 ALA A 123 128.631 13.754 -1.213 1.00 0.00 H new ATOM 0 HB3 ALA A 123 129.130 13.363 0.450 1.00 0.00 H new ATOM 698 N THR A 124 130.670 15.204 2.009 1.00 0.00 N ATOM 699 CA THR A 124 130.903 15.694 3.363 1.00 0.00 C ATOM 700 C THR A 124 131.570 17.066 3.332 1.00 0.00 C ATOM 701 O THR A 124 131.917 17.572 2.264 1.00 0.00 O ATOM 702 CB THR A 124 131.773 14.707 4.142 1.00 0.00 C ATOM 703 OG1 THR A 124 133.044 14.569 3.534 1.00 0.00 O ATOM 704 CG2 THR A 124 131.160 13.326 4.248 1.00 0.00 C ATOM 0 H THR A 124 131.090 14.296 1.811 1.00 0.00 H new ATOM 0 HA THR A 124 129.939 15.788 3.863 1.00 0.00 H new ATOM 0 HB THR A 124 131.861 15.127 5.144 1.00 0.00 H new ATOM 0 HG1 THR A 124 132.936 14.218 2.626 1.00 0.00 H new ATOM 0 HG21 THR A 124 131.827 12.674 4.812 1.00 0.00 H new ATOM 0 HG22 THR A 124 130.200 13.392 4.759 1.00 0.00 H new ATOM 0 HG23 THR A 124 131.012 12.916 3.249 1.00 0.00 H new ATOM 712 N GLY A 125 131.749 17.665 4.505 1.00 0.00 N ATOM 713 CA GLY A 125 132.375 18.972 4.579 1.00 0.00 C ATOM 714 C GLY A 125 133.717 18.935 5.286 1.00 0.00 C ATOM 715 O GLY A 125 134.187 19.953 5.793 1.00 0.00 O ATOM 0 H GLY A 125 131.472 17.270 5.404 1.00 0.00 H new ATOM 0 HA2 GLY A 125 132.510 19.364 3.571 1.00 0.00 H new ATOM 0 HA3 GLY A 125 131.711 19.660 5.102 1.00 0.00 H new ATOM 719 N GLU A 126 134.334 17.758 5.322 1.00 0.00 N ATOM 720 CA GLU A 126 135.627 17.591 5.973 1.00 0.00 C ATOM 721 C GLU A 126 136.734 17.404 4.941 1.00 0.00 C ATOM 722 O GLU A 126 136.637 16.544 4.066 1.00 0.00 O ATOM 723 CB GLU A 126 135.595 16.395 6.924 1.00 0.00 C ATOM 724 CG GLU A 126 134.905 15.173 6.340 1.00 0.00 C ATOM 725 CD GLU A 126 134.971 13.971 7.261 1.00 0.00 C ATOM 726 OE1 GLU A 126 134.674 14.127 8.465 1.00 0.00 O ATOM 727 OE2 GLU A 126 135.318 12.872 6.779 1.00 0.00 O ATOM 0 H GLU A 126 133.958 16.905 4.907 1.00 0.00 H new ATOM 0 HA GLU A 126 135.835 18.495 6.546 1.00 0.00 H new ATOM 0 HB2 GLU A 126 136.617 16.130 7.196 1.00 0.00 H new ATOM 0 HB3 GLU A 126 135.086 16.685 7.843 1.00 0.00 H new ATOM 0 HG2 GLU A 126 133.862 15.413 6.135 1.00 0.00 H new ATOM 0 HG3 GLU A 126 135.367 14.921 5.386 1.00 0.00 H new ATOM 734 N THR A 127 137.780 18.214 5.044 1.00 0.00 N ATOM 735 CA THR A 127 138.901 18.134 4.114 1.00 0.00 C ATOM 736 C THR A 127 139.635 16.804 4.253 1.00 0.00 C ATOM 737 O THR A 127 140.455 16.627 5.153 1.00 0.00 O ATOM 738 CB THR A 127 139.872 19.292 4.355 1.00 0.00 C ATOM 739 OG1 THR A 127 140.298 19.318 5.706 1.00 0.00 O ATOM 740 CG2 THR A 127 139.277 20.648 4.035 1.00 0.00 C ATOM 0 H THR A 127 137.876 18.933 5.761 1.00 0.00 H new ATOM 0 HA THR A 127 138.504 18.203 3.101 1.00 0.00 H new ATOM 0 HB THR A 127 140.709 19.111 3.681 1.00 0.00 H new ATOM 0 HG1 THR A 127 140.488 18.405 6.007 1.00 0.00 H new ATOM 0 HG21 THR A 127 140.017 21.425 4.228 1.00 0.00 H new ATOM 0 HG22 THR A 127 138.984 20.678 2.986 1.00 0.00 H new ATOM 0 HG23 THR A 127 138.401 20.818 4.661 1.00 0.00 H new ATOM 748 N ILE A 128 139.341 15.874 3.348 1.00 0.00 N ATOM 749 CA ILE A 128 139.980 14.561 3.366 1.00 0.00 C ATOM 750 C ILE A 128 141.085 14.482 2.318 1.00 0.00 C ATOM 751 O ILE A 128 141.110 15.265 1.368 1.00 0.00 O ATOM 752 CB ILE A 128 138.959 13.432 3.107 1.00 0.00 C ATOM 753 CG1 ILE A 128 137.769 13.554 4.061 1.00 0.00 C ATOM 754 CG2 ILE A 128 139.622 12.071 3.256 1.00 0.00 C ATOM 755 CD1 ILE A 128 138.164 13.610 5.520 1.00 0.00 C ATOM 0 H ILE A 128 138.666 16.005 2.595 1.00 0.00 H new ATOM 0 HA ILE A 128 140.409 14.428 4.359 1.00 0.00 H new ATOM 0 HB ILE A 128 138.592 13.528 2.085 1.00 0.00 H new ATOM 0 HG12 ILE A 128 137.205 14.453 3.811 1.00 0.00 H new ATOM 0 HG13 ILE A 128 137.102 12.706 3.906 1.00 0.00 H new ATOM 0 HG21 ILE A 128 138.888 11.287 3.070 1.00 0.00 H new ATOM 0 HG22 ILE A 128 140.437 11.983 2.538 1.00 0.00 H new ATOM 0 HG23 ILE A 128 140.016 11.967 4.267 1.00 0.00 H new ATOM 0 HD11 ILE A 128 137.269 13.696 6.136 1.00 0.00 H new ATOM 0 HD12 ILE A 128 138.702 12.700 5.787 1.00 0.00 H new ATOM 0 HD13 ILE A 128 138.806 14.474 5.690 1.00 0.00 H new ATOM 767 N THR A 129 141.997 13.531 2.493 1.00 0.00 N ATOM 768 CA THR A 129 143.103 13.352 1.560 1.00 0.00 C ATOM 769 C THR A 129 142.901 12.096 0.718 1.00 0.00 C ATOM 770 O THR A 129 142.134 11.206 1.086 1.00 0.00 O ATOM 771 CB THR A 129 144.428 13.266 2.317 1.00 0.00 C ATOM 772 OG1 THR A 129 144.423 14.136 3.436 1.00 0.00 O ATOM 773 CG2 THR A 129 145.628 13.618 1.467 1.00 0.00 C ATOM 0 H THR A 129 141.992 12.873 3.272 1.00 0.00 H new ATOM 0 HA THR A 129 143.130 14.215 0.895 1.00 0.00 H new ATOM 0 HB THR A 129 144.517 12.225 2.626 1.00 0.00 H new ATOM 0 HG1 THR A 129 145.279 14.066 3.909 1.00 0.00 H new ATOM 0 HG21 THR A 129 146.535 13.536 2.066 1.00 0.00 H new ATOM 0 HG22 THR A 129 145.689 12.933 0.622 1.00 0.00 H new ATOM 0 HG23 THR A 129 145.527 14.639 1.099 1.00 0.00 H new ATOM 781 N GLU A 130 143.596 12.029 -0.413 1.00 0.00 N ATOM 782 CA GLU A 130 143.493 10.880 -1.306 1.00 0.00 C ATOM 783 C GLU A 130 144.093 9.633 -0.664 1.00 0.00 C ATOM 784 O GLU A 130 143.669 8.513 -0.945 1.00 0.00 O ATOM 785 CB GLU A 130 144.197 11.174 -2.633 1.00 0.00 C ATOM 786 CG GLU A 130 145.679 11.472 -2.482 1.00 0.00 C ATOM 787 CD GLU A 130 146.554 10.308 -2.903 1.00 0.00 C ATOM 788 OE1 GLU A 130 146.515 9.936 -4.095 1.00 0.00 O ATOM 789 OE2 GLU A 130 147.279 9.767 -2.040 1.00 0.00 O ATOM 0 H GLU A 130 144.236 12.756 -0.733 1.00 0.00 H new ATOM 0 HA GLU A 130 142.436 10.694 -1.496 1.00 0.00 H new ATOM 0 HB2 GLU A 130 144.073 10.319 -3.298 1.00 0.00 H new ATOM 0 HB3 GLU A 130 143.711 12.024 -3.112 1.00 0.00 H new ATOM 0 HG2 GLU A 130 145.933 12.347 -3.080 1.00 0.00 H new ATOM 0 HG3 GLU A 130 145.891 11.724 -1.443 1.00 0.00 H new ATOM 796 N ASP A 131 145.083 9.836 0.200 1.00 0.00 N ATOM 797 CA ASP A 131 145.742 8.727 0.881 1.00 0.00 C ATOM 798 C ASP A 131 144.886 8.204 2.030 1.00 0.00 C ATOM 799 O ASP A 131 144.948 7.025 2.378 1.00 0.00 O ATOM 800 CB ASP A 131 147.108 9.167 1.407 1.00 0.00 C ATOM 801 CG ASP A 131 148.135 8.052 1.352 1.00 0.00 C ATOM 802 OD1 ASP A 131 148.224 7.277 2.327 1.00 0.00 O ATOM 803 OD2 ASP A 131 148.850 7.955 0.333 1.00 0.00 O ATOM 0 H ASP A 131 145.446 10.757 0.445 1.00 0.00 H new ATOM 0 HA ASP A 131 145.878 7.921 0.160 1.00 0.00 H new ATOM 0 HB2 ASP A 131 147.464 10.015 0.821 1.00 0.00 H new ATOM 0 HB3 ASP A 131 147.004 9.512 2.436 1.00 0.00 H new ATOM 808 N ASP A 132 144.086 9.089 2.619 1.00 0.00 N ATOM 809 CA ASP A 132 143.219 8.715 3.731 1.00 0.00 C ATOM 810 C ASP A 132 142.091 7.803 3.261 1.00 0.00 C ATOM 811 O ASP A 132 141.713 6.859 3.954 1.00 0.00 O ATOM 812 CB ASP A 132 142.639 9.966 4.394 1.00 0.00 C ATOM 813 CG ASP A 132 143.481 10.446 5.559 1.00 0.00 C ATOM 814 OD1 ASP A 132 143.643 9.680 6.533 1.00 0.00 O ATOM 815 OD2 ASP A 132 143.981 11.589 5.497 1.00 0.00 O ATOM 0 H ASP A 132 144.021 10.069 2.345 1.00 0.00 H new ATOM 0 HA ASP A 132 143.819 8.171 4.460 1.00 0.00 H new ATOM 0 HB2 ASP A 132 142.560 10.762 3.654 1.00 0.00 H new ATOM 0 HB3 ASP A 132 141.628 9.754 4.743 1.00 0.00 H new ATOM 820 N ILE A 133 141.554 8.093 2.080 1.00 0.00 N ATOM 821 CA ILE A 133 140.466 7.300 1.519 1.00 0.00 C ATOM 822 C ILE A 133 140.957 5.943 1.020 1.00 0.00 C ATOM 823 O ILE A 133 140.156 5.080 0.659 1.00 0.00 O ATOM 824 CB ILE A 133 139.774 8.042 0.359 1.00 0.00 C ATOM 825 CG1 ILE A 133 139.409 9.466 0.779 1.00 0.00 C ATOM 826 CG2 ILE A 133 138.533 7.284 -0.091 1.00 0.00 C ATOM 827 CD1 ILE A 133 138.914 10.326 -0.364 1.00 0.00 C ATOM 0 H ILE A 133 141.855 8.871 1.493 1.00 0.00 H new ATOM 0 HA ILE A 133 139.749 7.142 2.325 1.00 0.00 H new ATOM 0 HB ILE A 133 140.468 8.097 -0.480 1.00 0.00 H new ATOM 0 HG12 ILE A 133 138.640 9.423 1.550 1.00 0.00 H new ATOM 0 HG13 ILE A 133 140.283 9.939 1.227 1.00 0.00 H new ATOM 0 HG21 ILE A 133 138.056 7.821 -0.911 1.00 0.00 H new ATOM 0 HG22 ILE A 133 138.818 6.287 -0.427 1.00 0.00 H new ATOM 0 HG23 ILE A 133 137.836 7.200 0.743 1.00 0.00 H new ATOM 0 HD11 ILE A 133 138.674 11.322 0.008 1.00 0.00 H new ATOM 0 HD12 ILE A 133 139.690 10.400 -1.126 1.00 0.00 H new ATOM 0 HD13 ILE A 133 138.021 9.876 -0.798 1.00 0.00 H new ATOM 839 N GLU A 134 142.275 5.755 0.998 1.00 0.00 N ATOM 840 CA GLU A 134 142.858 4.498 0.538 1.00 0.00 C ATOM 841 C GLU A 134 142.672 3.395 1.575 1.00 0.00 C ATOM 842 O GLU A 134 142.578 2.217 1.230 1.00 0.00 O ATOM 843 CB GLU A 134 144.346 4.684 0.236 1.00 0.00 C ATOM 844 CG GLU A 134 144.615 5.445 -1.053 1.00 0.00 C ATOM 845 CD GLU A 134 145.602 4.732 -1.957 1.00 0.00 C ATOM 846 OE1 GLU A 134 145.361 3.552 -2.287 1.00 0.00 O ATOM 847 OE2 GLU A 134 146.616 5.354 -2.336 1.00 0.00 O ATOM 0 H GLU A 134 142.956 6.455 1.292 1.00 0.00 H new ATOM 0 HA GLU A 134 142.341 4.201 -0.375 1.00 0.00 H new ATOM 0 HB2 GLU A 134 144.813 5.215 1.066 1.00 0.00 H new ATOM 0 HB3 GLU A 134 144.821 3.705 0.176 1.00 0.00 H new ATOM 0 HG2 GLU A 134 143.676 5.589 -1.588 1.00 0.00 H new ATOM 0 HG3 GLU A 134 144.999 6.436 -0.812 1.00 0.00 H new ATOM 854 N GLU A 135 142.622 3.781 2.846 1.00 0.00 N ATOM 855 CA GLU A 135 142.452 2.820 3.931 1.00 0.00 C ATOM 856 C GLU A 135 141.106 2.106 3.823 1.00 0.00 C ATOM 857 O GLU A 135 141.001 0.913 4.106 1.00 0.00 O ATOM 858 CB GLU A 135 142.568 3.520 5.288 1.00 0.00 C ATOM 859 CG GLU A 135 141.413 4.463 5.592 1.00 0.00 C ATOM 860 CD GLU A 135 141.823 5.619 6.484 1.00 0.00 C ATOM 861 OE1 GLU A 135 142.794 6.323 6.133 1.00 0.00 O ATOM 862 OE2 GLU A 135 141.174 5.818 7.532 1.00 0.00 O ATOM 0 H GLU A 135 142.697 4.752 3.150 1.00 0.00 H new ATOM 0 HA GLU A 135 143.244 2.075 3.848 1.00 0.00 H new ATOM 0 HB2 GLU A 135 142.625 2.765 6.072 1.00 0.00 H new ATOM 0 HB3 GLU A 135 143.501 4.082 5.318 1.00 0.00 H new ATOM 0 HG2 GLU A 135 141.013 4.855 4.657 1.00 0.00 H new ATOM 0 HG3 GLU A 135 140.610 3.905 6.073 1.00 0.00 H new ATOM 869 N LEU A 136 140.080 2.846 3.414 1.00 0.00 N ATOM 870 CA LEU A 136 138.741 2.283 3.271 1.00 0.00 C ATOM 871 C LEU A 136 138.734 1.149 2.252 1.00 0.00 C ATOM 872 O LEU A 136 138.157 0.088 2.493 1.00 0.00 O ATOM 873 CB LEU A 136 137.751 3.372 2.849 1.00 0.00 C ATOM 874 CG LEU A 136 137.007 4.050 4.003 1.00 0.00 C ATOM 875 CD1 LEU A 136 137.667 5.374 4.358 1.00 0.00 C ATOM 876 CD2 LEU A 136 135.544 4.263 3.643 1.00 0.00 C ATOM 0 H LEU A 136 140.150 3.835 3.176 1.00 0.00 H new ATOM 0 HA LEU A 136 138.437 1.880 4.237 1.00 0.00 H new ATOM 0 HB2 LEU A 136 138.290 4.134 2.286 1.00 0.00 H new ATOM 0 HB3 LEU A 136 137.018 2.934 2.171 1.00 0.00 H new ATOM 0 HG LEU A 136 137.055 3.397 4.874 1.00 0.00 H new ATOM 0 HD11 LEU A 136 137.125 5.842 5.180 1.00 0.00 H new ATOM 0 HD12 LEU A 136 138.700 5.197 4.659 1.00 0.00 H new ATOM 0 HD13 LEU A 136 137.650 6.033 3.490 1.00 0.00 H new ATOM 0 HD21 LEU A 136 135.031 4.746 4.475 1.00 0.00 H new ATOM 0 HD22 LEU A 136 135.475 4.896 2.758 1.00 0.00 H new ATOM 0 HD23 LEU A 136 135.076 3.300 3.438 1.00 0.00 H new ATOM 888 N MET A 137 139.378 1.378 1.112 1.00 0.00 N ATOM 889 CA MET A 137 139.445 0.376 0.056 1.00 0.00 C ATOM 890 C MET A 137 140.338 -0.791 0.468 1.00 0.00 C ATOM 891 O MET A 137 140.116 -1.931 0.058 1.00 0.00 O ATOM 892 CB MET A 137 139.964 1.003 -1.239 1.00 0.00 C ATOM 893 CG MET A 137 139.076 0.738 -2.443 1.00 0.00 C ATOM 894 SD MET A 137 138.004 2.133 -2.837 1.00 0.00 S ATOM 895 CE MET A 137 136.568 1.284 -3.488 1.00 0.00 C ATOM 0 H MET A 137 139.861 2.250 0.896 1.00 0.00 H new ATOM 0 HA MET A 137 138.438 -0.005 -0.114 1.00 0.00 H new ATOM 0 HB2 MET A 137 140.059 2.080 -1.099 1.00 0.00 H new ATOM 0 HB3 MET A 137 140.963 0.619 -1.444 1.00 0.00 H new ATOM 0 HG2 MET A 137 139.700 0.510 -3.307 1.00 0.00 H new ATOM 0 HG3 MET A 137 138.463 -0.143 -2.251 1.00 0.00 H new ATOM 0 HE1 MET A 137 136.159 1.850 -4.325 1.00 0.00 H new ATOM 0 HE2 MET A 137 136.857 0.290 -3.829 1.00 0.00 H new ATOM 0 HE3 MET A 137 135.813 1.195 -2.707 1.00 0.00 H new ATOM 905 N LYS A 138 141.350 -0.497 1.279 1.00 0.00 N ATOM 906 CA LYS A 138 142.278 -1.518 1.746 1.00 0.00 C ATOM 907 C LYS A 138 141.546 -2.619 2.509 1.00 0.00 C ATOM 908 O LYS A 138 141.340 -3.715 1.990 1.00 0.00 O ATOM 909 CB LYS A 138 143.353 -0.891 2.636 1.00 0.00 C ATOM 910 CG LYS A 138 144.611 -0.491 1.883 1.00 0.00 C ATOM 911 CD LYS A 138 145.509 -1.690 1.623 1.00 0.00 C ATOM 912 CE LYS A 138 146.632 -1.776 2.644 1.00 0.00 C ATOM 913 NZ LYS A 138 147.772 -2.596 2.148 1.00 0.00 N ATOM 0 H LYS A 138 141.547 0.442 1.626 1.00 0.00 H new ATOM 0 HA LYS A 138 142.753 -1.965 0.873 1.00 0.00 H new ATOM 0 HB2 LYS A 138 142.938 -0.010 3.127 1.00 0.00 H new ATOM 0 HB3 LYS A 138 143.620 -1.598 3.422 1.00 0.00 H new ATOM 0 HG2 LYS A 138 144.337 -0.028 0.935 1.00 0.00 H new ATOM 0 HG3 LYS A 138 145.158 0.257 2.457 1.00 0.00 H new ATOM 0 HD2 LYS A 138 144.916 -2.604 1.655 1.00 0.00 H new ATOM 0 HD3 LYS A 138 145.932 -1.619 0.621 1.00 0.00 H new ATOM 0 HE2 LYS A 138 146.984 -0.772 2.882 1.00 0.00 H new ATOM 0 HE3 LYS A 138 146.250 -2.208 3.569 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 148.517 -2.630 2.873 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 147.443 -3.561 1.944 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 148.154 -2.170 1.279 1.00 0.00 H new ATOM 927 N ASP A 139 141.158 -2.318 3.743 1.00 0.00 N ATOM 928 CA ASP A 139 140.451 -3.284 4.578 1.00 0.00 C ATOM 929 C ASP A 139 139.134 -3.721 3.937 1.00 0.00 C ATOM 930 O ASP A 139 138.588 -4.770 4.279 1.00 0.00 O ATOM 931 CB ASP A 139 140.202 -2.697 5.973 1.00 0.00 C ATOM 932 CG ASP A 139 139.128 -1.625 5.984 1.00 0.00 C ATOM 933 OD1 ASP A 139 138.715 -1.185 4.892 1.00 0.00 O ATOM 934 OD2 ASP A 139 138.704 -1.225 7.089 1.00 0.00 O ATOM 0 H ASP A 139 141.320 -1.414 4.188 1.00 0.00 H new ATOM 0 HA ASP A 139 141.080 -4.169 4.674 1.00 0.00 H new ATOM 0 HB2 ASP A 139 139.913 -3.499 6.652 1.00 0.00 H new ATOM 0 HB3 ASP A 139 141.132 -2.275 6.355 1.00 0.00 H new ATOM 939 N GLY A 140 138.630 -2.917 3.006 1.00 0.00 N ATOM 940 CA GLY A 140 137.384 -3.251 2.337 1.00 0.00 C ATOM 941 C GLY A 140 137.574 -4.284 1.244 1.00 0.00 C ATOM 942 O GLY A 140 136.796 -5.231 1.134 1.00 0.00 O ATOM 0 H GLY A 140 139.060 -2.043 2.703 1.00 0.00 H new ATOM 0 HA2 GLY A 140 136.671 -3.628 3.070 1.00 0.00 H new ATOM 0 HA3 GLY A 140 136.952 -2.347 1.908 1.00 0.00 H new ATOM 946 N ASP A 141 138.611 -4.100 0.436 1.00 0.00 N ATOM 947 CA ASP A 141 138.905 -5.022 -0.655 1.00 0.00 C ATOM 948 C ASP A 141 139.291 -6.396 -0.120 1.00 0.00 C ATOM 949 O ASP A 141 140.401 -6.589 0.379 1.00 0.00 O ATOM 950 CB ASP A 141 140.029 -4.467 -1.532 1.00 0.00 C ATOM 951 CG ASP A 141 140.127 -5.183 -2.865 1.00 0.00 C ATOM 952 OD1 ASP A 141 139.108 -5.750 -3.312 1.00 0.00 O ATOM 953 OD2 ASP A 141 141.224 -5.177 -3.462 1.00 0.00 O ATOM 0 H ASP A 141 139.263 -3.320 0.516 1.00 0.00 H new ATOM 0 HA ASP A 141 138.003 -5.129 -1.258 1.00 0.00 H new ATOM 0 HB2 ASP A 141 139.861 -3.404 -1.705 1.00 0.00 H new ATOM 0 HB3 ASP A 141 140.978 -4.558 -1.003 1.00 0.00 H new ATOM 958 N LYS A 142 138.370 -7.349 -0.227 1.00 0.00 N ATOM 959 CA LYS A 142 138.615 -8.707 0.245 1.00 0.00 C ATOM 960 C LYS A 142 139.022 -9.622 -0.906 1.00 0.00 C ATOM 961 O LYS A 142 139.665 -10.651 -0.696 1.00 0.00 O ATOM 962 CB LYS A 142 137.368 -9.263 0.935 1.00 0.00 C ATOM 963 CG LYS A 142 137.086 -8.629 2.287 1.00 0.00 C ATOM 964 CD LYS A 142 138.253 -8.814 3.244 1.00 0.00 C ATOM 965 CE LYS A 142 137.778 -9.225 4.629 1.00 0.00 C ATOM 966 NZ LYS A 142 137.206 -10.600 4.635 1.00 0.00 N ATOM 0 H LYS A 142 137.447 -7.205 -0.637 1.00 0.00 H new ATOM 0 HA LYS A 142 139.435 -8.670 0.962 1.00 0.00 H new ATOM 0 HB2 LYS A 142 136.506 -9.112 0.285 1.00 0.00 H new ATOM 0 HB3 LYS A 142 137.484 -10.339 1.065 1.00 0.00 H new ATOM 0 HG2 LYS A 142 136.886 -7.565 2.157 1.00 0.00 H new ATOM 0 HG3 LYS A 142 136.188 -9.072 2.717 1.00 0.00 H new ATOM 0 HD2 LYS A 142 138.931 -9.572 2.851 1.00 0.00 H new ATOM 0 HD3 LYS A 142 138.819 -7.885 3.313 1.00 0.00 H new ATOM 0 HE2 LYS A 142 138.613 -9.176 5.328 1.00 0.00 H new ATOM 0 HE3 LYS A 142 137.026 -8.518 4.980 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 137.208 -10.973 5.606 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 136.230 -10.571 4.277 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 137.780 -11.217 4.026 1.00 0.00 H new ATOM 980 N ASN A 143 138.647 -9.241 -2.124 1.00 0.00 N ATOM 981 CA ASN A 143 138.976 -10.028 -3.307 1.00 0.00 C ATOM 982 C ASN A 143 140.360 -9.664 -3.843 1.00 0.00 C ATOM 983 O ASN A 143 140.917 -10.377 -4.676 1.00 0.00 O ATOM 984 CB ASN A 143 137.923 -9.814 -4.395 1.00 0.00 C ATOM 985 CG ASN A 143 136.578 -10.407 -4.022 1.00 0.00 C ATOM 986 OD1 ASN A 143 135.651 -9.688 -3.649 1.00 0.00 O ATOM 987 ND2 ASN A 143 136.465 -11.727 -4.123 1.00 0.00 N ATOM 0 H ASN A 143 138.115 -8.392 -2.317 1.00 0.00 H new ATOM 0 HA ASN A 143 138.986 -11.079 -3.019 1.00 0.00 H new ATOM 0 HB2 ASN A 143 137.807 -8.746 -4.580 1.00 0.00 H new ATOM 0 HB3 ASN A 143 138.270 -10.263 -5.326 1.00 0.00 H new ATOM 0 HD21 ASN A 143 135.584 -12.183 -3.887 1.00 0.00 H new ATOM 0 HD22 ASN A 143 137.260 -12.284 -4.437 1.00 0.00 H new ATOM 994 N ASN A 144 140.909 -8.551 -3.361 1.00 0.00 N ATOM 995 CA ASN A 144 142.227 -8.097 -3.795 1.00 0.00 C ATOM 996 C ASN A 144 142.195 -7.651 -5.253 1.00 0.00 C ATOM 997 O ASN A 144 143.142 -7.882 -6.005 1.00 0.00 O ATOM 998 CB ASN A 144 143.265 -9.206 -3.605 1.00 0.00 C ATOM 999 CG ASN A 144 144.482 -8.734 -2.836 1.00 0.00 C ATOM 1000 OD1 ASN A 144 145.559 -8.552 -3.403 1.00 0.00 O ATOM 1001 ND2 ASN A 144 144.317 -8.532 -1.533 1.00 0.00 N ATOM 0 H ASN A 144 140.462 -7.948 -2.671 1.00 0.00 H new ATOM 0 HA ASN A 144 142.510 -7.243 -3.180 1.00 0.00 H new ATOM 0 HB2 ASN A 144 142.807 -10.042 -3.077 1.00 0.00 H new ATOM 0 HB3 ASN A 144 143.577 -9.578 -4.581 1.00 0.00 H new ATOM 0 HD21 ASN A 144 145.101 -8.214 -0.963 1.00 0.00 H new ATOM 0 HD22 ASN A 144 143.407 -8.695 -1.103 1.00 0.00 H new ATOM 1008 N ASP A 145 141.100 -7.008 -5.647 1.00 0.00 N ATOM 1009 CA ASP A 145 140.947 -6.528 -7.017 1.00 0.00 C ATOM 1010 C ASP A 145 140.942 -5.001 -7.070 1.00 0.00 C ATOM 1011 O ASP A 145 140.547 -4.410 -8.076 1.00 0.00 O ATOM 1012 CB ASP A 145 139.653 -7.074 -7.626 1.00 0.00 C ATOM 1013 CG ASP A 145 138.421 -6.624 -6.865 1.00 0.00 C ATOM 1014 OD1 ASP A 145 138.413 -6.746 -5.622 1.00 0.00 O ATOM 1015 OD2 ASP A 145 137.464 -6.149 -7.513 1.00 0.00 O ATOM 0 H ASP A 145 140.306 -6.807 -5.038 1.00 0.00 H new ATOM 0 HA ASP A 145 141.798 -6.887 -7.596 1.00 0.00 H new ATOM 0 HB2 ASP A 145 139.576 -6.746 -8.663 1.00 0.00 H new ATOM 0 HB3 ASP A 145 139.692 -8.163 -7.638 1.00 0.00 H new ATOM 1020 N GLY A 146 141.384 -4.366 -5.988 1.00 0.00 N ATOM 1021 CA GLY A 146 141.419 -2.917 -5.941 1.00 0.00 C ATOM 1022 C GLY A 146 140.042 -2.296 -6.088 1.00 0.00 C ATOM 1023 O GLY A 146 139.904 -1.193 -6.615 1.00 0.00 O ATOM 0 H GLY A 146 141.718 -4.830 -5.144 1.00 0.00 H new ATOM 0 HA2 GLY A 146 141.859 -2.598 -4.996 1.00 0.00 H new ATOM 0 HA3 GLY A 146 142.067 -2.547 -6.735 1.00 0.00 H new ATOM 1027 N ARG A 147 139.021 -3.007 -5.618 1.00 0.00 N ATOM 1028 CA ARG A 147 137.649 -2.519 -5.701 1.00 0.00 C ATOM 1029 C ARG A 147 136.769 -3.186 -4.648 1.00 0.00 C ATOM 1030 O ARG A 147 137.228 -4.042 -3.891 1.00 0.00 O ATOM 1031 CB ARG A 147 137.076 -2.777 -7.095 1.00 0.00 C ATOM 1032 CG ARG A 147 137.912 -2.184 -8.217 1.00 0.00 C ATOM 1033 CD ARG A 147 137.222 -2.332 -9.563 1.00 0.00 C ATOM 1034 NE ARG A 147 138.142 -2.117 -10.677 1.00 0.00 N ATOM 1035 CZ ARG A 147 137.752 -1.947 -11.939 1.00 0.00 C ATOM 1036 NH1 ARG A 147 136.463 -1.964 -12.250 1.00 0.00 N ATOM 1037 NH2 ARG A 147 138.655 -1.758 -12.891 1.00 0.00 N ATOM 0 H ARG A 147 139.118 -3.921 -5.177 1.00 0.00 H new ATOM 0 HA ARG A 147 137.661 -1.445 -5.513 1.00 0.00 H new ATOM 0 HB2 ARG A 147 136.988 -3.852 -7.249 1.00 0.00 H new ATOM 0 HB3 ARG A 147 136.069 -2.364 -7.147 1.00 0.00 H new ATOM 0 HG2 ARG A 147 138.097 -1.129 -8.016 1.00 0.00 H new ATOM 0 HG3 ARG A 147 138.883 -2.678 -8.249 1.00 0.00 H new ATOM 0 HD2 ARG A 147 136.787 -3.328 -9.640 1.00 0.00 H new ATOM 0 HD3 ARG A 147 136.400 -1.619 -9.629 1.00 0.00 H new ATOM 0 HE ARG A 147 139.142 -2.096 -10.477 1.00 0.00 H new ATOM 0 HH11 ARG A 147 135.764 -2.108 -11.521 1.00 0.00 H new ATOM 0 HH12 ARG A 147 136.170 -1.833 -13.218 1.00 0.00 H new ATOM 0 HH21 ARG A 147 139.648 -1.743 -12.657 1.00 0.00 H new ATOM 0 HH22 ARG A 147 138.357 -1.628 -13.858 1.00 0.00 H new ATOM 1051 N ILE A 148 135.501 -2.788 -4.607 1.00 0.00 N ATOM 1052 CA ILE A 148 134.552 -3.347 -3.652 1.00 0.00 C ATOM 1053 C ILE A 148 133.255 -3.751 -4.345 1.00 0.00 C ATOM 1054 O ILE A 148 132.937 -3.256 -5.427 1.00 0.00 O ATOM 1055 CB ILE A 148 134.232 -2.346 -2.524 1.00 0.00 C ATOM 1056 CG1 ILE A 148 135.522 -1.831 -1.886 1.00 0.00 C ATOM 1057 CG2 ILE A 148 133.338 -2.994 -1.475 1.00 0.00 C ATOM 1058 CD1 ILE A 148 135.318 -0.618 -1.004 1.00 0.00 C ATOM 0 H ILE A 148 135.107 -2.079 -5.226 1.00 0.00 H new ATOM 0 HA ILE A 148 135.020 -4.230 -3.217 1.00 0.00 H new ATOM 0 HB ILE A 148 133.698 -1.498 -2.954 1.00 0.00 H new ATOM 0 HG12 ILE A 148 135.969 -2.630 -1.294 1.00 0.00 H new ATOM 0 HG13 ILE A 148 136.233 -1.582 -2.674 1.00 0.00 H new ATOM 0 HG21 ILE A 148 133.122 -2.274 -0.686 1.00 0.00 H new ATOM 0 HG22 ILE A 148 132.405 -3.314 -1.939 1.00 0.00 H new ATOM 0 HG23 ILE A 148 133.846 -3.858 -1.048 1.00 0.00 H new ATOM 0 HD11 ILE A 148 136.275 -0.308 -0.585 1.00 0.00 H new ATOM 0 HD12 ILE A 148 134.900 0.196 -1.596 1.00 0.00 H new ATOM 0 HD13 ILE A 148 134.632 -0.868 -0.195 1.00 0.00 H new ATOM 1070 N ASP A 149 132.507 -4.652 -3.714 1.00 0.00 N ATOM 1071 CA ASP A 149 131.244 -5.121 -4.270 1.00 0.00 C ATOM 1072 C ASP A 149 130.314 -5.623 -3.168 1.00 0.00 C ATOM 1073 O ASP A 149 130.736 -5.814 -2.027 1.00 0.00 O ATOM 1074 CB ASP A 149 131.494 -6.233 -5.291 1.00 0.00 C ATOM 1075 CG ASP A 149 132.296 -7.380 -4.712 1.00 0.00 C ATOM 1076 OD1 ASP A 149 131.795 -8.044 -3.781 1.00 0.00 O ATOM 1077 OD2 ASP A 149 133.427 -7.612 -5.189 1.00 0.00 O ATOM 0 H ASP A 149 132.755 -5.071 -2.818 1.00 0.00 H new ATOM 0 HA ASP A 149 130.762 -4.281 -4.769 1.00 0.00 H new ATOM 0 HB2 ASP A 149 130.538 -6.609 -5.655 1.00 0.00 H new ATOM 0 HB3 ASP A 149 132.023 -5.821 -6.150 1.00 0.00 H new ATOM 1082 N TYR A 150 129.049 -5.830 -3.517 1.00 0.00 N ATOM 1083 CA TYR A 150 128.055 -6.305 -2.559 1.00 0.00 C ATOM 1084 C TYR A 150 128.490 -7.619 -1.916 1.00 0.00 C ATOM 1085 O TYR A 150 128.103 -7.924 -0.788 1.00 0.00 O ATOM 1086 CB TYR A 150 126.701 -6.485 -3.248 1.00 0.00 C ATOM 1087 CG TYR A 150 125.590 -6.887 -2.304 1.00 0.00 C ATOM 1088 CD1 TYR A 150 124.938 -5.939 -1.524 1.00 0.00 C ATOM 1089 CD2 TYR A 150 125.193 -8.213 -2.194 1.00 0.00 C ATOM 1090 CE1 TYR A 150 123.922 -6.304 -0.662 1.00 0.00 C ATOM 1091 CE2 TYR A 150 124.177 -8.584 -1.333 1.00 0.00 C ATOM 1092 CZ TYR A 150 123.545 -7.627 -0.570 1.00 0.00 C ATOM 1093 OH TYR A 150 122.533 -7.994 0.288 1.00 0.00 O ATOM 0 H TYR A 150 128.686 -5.676 -4.458 1.00 0.00 H new ATOM 0 HA TYR A 150 127.962 -5.556 -1.773 1.00 0.00 H new ATOM 0 HB2 TYR A 150 126.427 -5.553 -3.742 1.00 0.00 H new ATOM 0 HB3 TYR A 150 126.797 -7.242 -4.026 1.00 0.00 H new ATOM 0 HD1 TYR A 150 125.230 -4.902 -1.593 1.00 0.00 H new ATOM 0 HD2 TYR A 150 125.686 -8.966 -2.791 1.00 0.00 H new ATOM 0 HE1 TYR A 150 123.425 -5.556 -0.062 1.00 0.00 H new ATOM 0 HE2 TYR A 150 123.880 -9.620 -1.259 1.00 0.00 H new ATOM 0 HH TYR A 150 122.391 -8.962 0.231 1.00 0.00 H new ATOM 1103 N ASP A 151 129.291 -8.395 -2.640 1.00 0.00 N ATOM 1104 CA ASP A 151 129.770 -9.676 -2.134 1.00 0.00 C ATOM 1105 C ASP A 151 130.770 -9.478 -1.000 1.00 0.00 C ATOM 1106 O ASP A 151 130.578 -9.986 0.105 1.00 0.00 O ATOM 1107 CB ASP A 151 130.409 -10.487 -3.265 1.00 0.00 C ATOM 1108 CG ASP A 151 129.566 -11.679 -3.670 1.00 0.00 C ATOM 1109 OD1 ASP A 151 129.690 -12.741 -3.026 1.00 0.00 O ATOM 1110 OD2 ASP A 151 128.778 -11.550 -4.631 1.00 0.00 O ATOM 0 H ASP A 151 129.621 -8.160 -3.576 1.00 0.00 H new ATOM 0 HA ASP A 151 128.915 -10.226 -1.741 1.00 0.00 H new ATOM 0 HB2 ASP A 151 130.560 -9.842 -4.130 1.00 0.00 H new ATOM 0 HB3 ASP A 151 131.393 -10.832 -2.949 1.00 0.00 H new ATOM 1115 N GLU A 152 131.839 -8.742 -1.281 1.00 0.00 N ATOM 1116 CA GLU A 152 132.871 -8.480 -0.283 1.00 0.00 C ATOM 1117 C GLU A 152 132.458 -7.360 0.672 1.00 0.00 C ATOM 1118 O GLU A 152 133.128 -7.114 1.675 1.00 0.00 O ATOM 1119 CB GLU A 152 134.190 -8.120 -0.969 1.00 0.00 C ATOM 1120 CG GLU A 152 134.116 -6.848 -1.792 1.00 0.00 C ATOM 1121 CD GLU A 152 135.366 -6.614 -2.617 1.00 0.00 C ATOM 1122 OE1 GLU A 152 136.473 -6.639 -2.039 1.00 0.00 O ATOM 1123 OE2 GLU A 152 135.239 -6.404 -3.842 1.00 0.00 O ATOM 0 H GLU A 152 132.014 -8.316 -2.191 1.00 0.00 H new ATOM 0 HA GLU A 152 133.004 -9.390 0.303 1.00 0.00 H new ATOM 0 HB2 GLU A 152 134.966 -8.009 -0.212 1.00 0.00 H new ATOM 0 HB3 GLU A 152 134.491 -8.945 -1.615 1.00 0.00 H new ATOM 0 HG2 GLU A 152 133.252 -6.898 -2.455 1.00 0.00 H new ATOM 0 HG3 GLU A 152 133.959 -5.998 -1.128 1.00 0.00 H new ATOM 1130 N PHE A 153 131.356 -6.682 0.358 1.00 0.00 N ATOM 1131 CA PHE A 153 130.868 -5.593 1.197 1.00 0.00 C ATOM 1132 C PHE A 153 130.160 -6.140 2.434 1.00 0.00 C ATOM 1133 O PHE A 153 130.275 -5.581 3.524 1.00 0.00 O ATOM 1134 CB PHE A 153 129.916 -4.696 0.402 1.00 0.00 C ATOM 1135 CG PHE A 153 129.353 -3.556 1.202 1.00 0.00 C ATOM 1136 CD1 PHE A 153 130.178 -2.773 1.992 1.00 0.00 C ATOM 1137 CD2 PHE A 153 127.998 -3.268 1.162 1.00 0.00 C ATOM 1138 CE1 PHE A 153 129.663 -1.724 2.729 1.00 0.00 C ATOM 1139 CE2 PHE A 153 127.476 -2.221 1.898 1.00 0.00 C ATOM 1140 CZ PHE A 153 128.310 -1.448 2.681 1.00 0.00 C ATOM 0 H PHE A 153 130.787 -6.867 -0.468 1.00 0.00 H new ATOM 0 HA PHE A 153 131.724 -5.002 1.521 1.00 0.00 H new ATOM 0 HB2 PHE A 153 130.445 -4.295 -0.463 1.00 0.00 H new ATOM 0 HB3 PHE A 153 129.094 -5.301 0.020 1.00 0.00 H new ATOM 0 HD1 PHE A 153 131.236 -2.985 2.032 1.00 0.00 H new ATOM 0 HD2 PHE A 153 127.342 -3.868 0.549 1.00 0.00 H new ATOM 0 HE1 PHE A 153 130.317 -1.121 3.342 1.00 0.00 H new ATOM 0 HE2 PHE A 153 126.418 -2.008 1.861 1.00 0.00 H new ATOM 0 HZ PHE A 153 127.905 -0.628 3.256 1.00 0.00 H new ATOM 1150 N LEU A 154 129.428 -7.234 2.254 1.00 0.00 N ATOM 1151 CA LEU A 154 128.702 -7.858 3.354 1.00 0.00 C ATOM 1152 C LEU A 154 129.665 -8.460 4.374 1.00 0.00 C ATOM 1153 O LEU A 154 129.325 -8.605 5.548 1.00 0.00 O ATOM 1154 CB LEU A 154 127.758 -8.938 2.820 1.00 0.00 C ATOM 1155 CG LEU A 154 126.309 -8.493 2.628 1.00 0.00 C ATOM 1156 CD1 LEU A 154 125.655 -8.208 3.971 1.00 0.00 C ATOM 1157 CD2 LEU A 154 126.244 -7.266 1.731 1.00 0.00 C ATOM 0 H LEU A 154 129.322 -7.707 1.357 1.00 0.00 H new ATOM 0 HA LEU A 154 128.115 -7.087 3.853 1.00 0.00 H new ATOM 0 HB2 LEU A 154 128.142 -9.295 1.864 1.00 0.00 H new ATOM 0 HB3 LEU A 154 127.774 -9.785 3.506 1.00 0.00 H new ATOM 0 HG LEU A 154 125.761 -9.302 2.145 1.00 0.00 H new ATOM 0 HD11 LEU A 154 124.624 -7.892 3.814 1.00 0.00 H new ATOM 0 HD12 LEU A 154 125.669 -9.111 4.581 1.00 0.00 H new ATOM 0 HD13 LEU A 154 126.203 -7.416 4.482 1.00 0.00 H new ATOM 0 HD21 LEU A 154 125.205 -6.962 1.605 1.00 0.00 H new ATOM 0 HD22 LEU A 154 126.807 -6.452 2.187 1.00 0.00 H new ATOM 0 HD23 LEU A 154 126.673 -7.504 0.758 1.00 0.00 H new ATOM 1169 N GLU A 155 130.864 -8.808 3.919 1.00 0.00 N ATOM 1170 CA GLU A 155 131.873 -9.393 4.797 1.00 0.00 C ATOM 1171 C GLU A 155 132.628 -8.307 5.556 1.00 0.00 C ATOM 1172 O GLU A 155 133.033 -8.504 6.702 1.00 0.00 O ATOM 1173 CB GLU A 155 132.855 -10.240 3.985 1.00 0.00 C ATOM 1174 CG GLU A 155 132.360 -11.649 3.708 1.00 0.00 C ATOM 1175 CD GLU A 155 133.475 -12.678 3.752 1.00 0.00 C ATOM 1176 OE1 GLU A 155 134.160 -12.765 4.792 1.00 0.00 O ATOM 1177 OE2 GLU A 155 133.660 -13.395 2.746 1.00 0.00 O ATOM 0 H GLU A 155 131.161 -8.696 2.950 1.00 0.00 H new ATOM 0 HA GLU A 155 131.365 -10.031 5.520 1.00 0.00 H new ATOM 0 HB2 GLU A 155 133.054 -9.741 3.037 1.00 0.00 H new ATOM 0 HB3 GLU A 155 133.803 -10.296 4.521 1.00 0.00 H new ATOM 0 HG2 GLU A 155 131.598 -11.913 4.441 1.00 0.00 H new ATOM 0 HG3 GLU A 155 131.883 -11.677 2.728 1.00 0.00 H new ATOM 1184 N PHE A 156 132.808 -7.160 4.911 1.00 0.00 N ATOM 1185 CA PHE A 156 133.511 -6.038 5.523 1.00 0.00 C ATOM 1186 C PHE A 156 132.621 -5.328 6.538 1.00 0.00 C ATOM 1187 O PHE A 156 133.110 -4.735 7.500 1.00 0.00 O ATOM 1188 CB PHE A 156 133.969 -5.051 4.446 1.00 0.00 C ATOM 1189 CG PHE A 156 134.724 -3.873 4.990 1.00 0.00 C ATOM 1190 CD1 PHE A 156 135.789 -4.054 5.857 1.00 0.00 C ATOM 1191 CD2 PHE A 156 134.369 -2.582 4.634 1.00 0.00 C ATOM 1192 CE1 PHE A 156 136.486 -2.970 6.359 1.00 0.00 C ATOM 1193 CE2 PHE A 156 135.060 -1.495 5.132 1.00 0.00 C ATOM 1194 CZ PHE A 156 136.121 -1.689 5.996 1.00 0.00 C ATOM 0 H PHE A 156 132.476 -6.982 3.963 1.00 0.00 H new ATOM 0 HA PHE A 156 134.385 -6.427 6.045 1.00 0.00 H new ATOM 0 HB2 PHE A 156 134.600 -5.576 3.729 1.00 0.00 H new ATOM 0 HB3 PHE A 156 133.097 -4.692 3.900 1.00 0.00 H new ATOM 0 HD1 PHE A 156 136.079 -5.054 6.145 1.00 0.00 H new ATOM 0 HD2 PHE A 156 133.541 -2.424 3.958 1.00 0.00 H new ATOM 0 HE1 PHE A 156 137.315 -3.125 7.034 1.00 0.00 H new ATOM 0 HE2 PHE A 156 134.771 -0.494 4.847 1.00 0.00 H new ATOM 0 HZ PHE A 156 136.663 -0.841 6.386 1.00 0.00 H new ATOM 1204 N MET A 157 131.311 -5.391 6.317 1.00 0.00 N ATOM 1205 CA MET A 157 130.354 -4.755 7.214 1.00 0.00 C ATOM 1206 C MET A 157 129.919 -5.706 8.331 1.00 0.00 C ATOM 1207 O MET A 157 129.150 -5.324 9.214 1.00 0.00 O ATOM 1208 CB MET A 157 129.131 -4.276 6.428 1.00 0.00 C ATOM 1209 CG MET A 157 128.867 -2.785 6.559 1.00 0.00 C ATOM 1210 SD MET A 157 130.230 -1.782 5.938 1.00 0.00 S ATOM 1211 CE MET A 157 130.302 -0.498 7.185 1.00 0.00 C ATOM 0 H MET A 157 130.889 -5.876 5.525 1.00 0.00 H new ATOM 0 HA MET A 157 130.845 -3.897 7.673 1.00 0.00 H new ATOM 0 HB2 MET A 157 129.268 -4.521 5.375 1.00 0.00 H new ATOM 0 HB3 MET A 157 128.253 -4.823 6.771 1.00 0.00 H new ATOM 0 HG2 MET A 157 127.957 -2.532 6.015 1.00 0.00 H new ATOM 0 HG3 MET A 157 128.690 -2.542 7.607 1.00 0.00 H new ATOM 0 HE1 MET A 157 131.100 0.203 6.940 1.00 0.00 H new ATOM 0 HE2 MET A 157 129.350 0.032 7.217 1.00 0.00 H new ATOM 0 HE3 MET A 157 130.500 -0.947 8.158 1.00 0.00 H new ATOM 1221 N LYS A 158 130.413 -6.941 8.291 1.00 0.00 N ATOM 1222 CA LYS A 158 130.069 -7.935 9.302 1.00 0.00 C ATOM 1223 C LYS A 158 131.060 -7.896 10.462 1.00 0.00 C ATOM 1224 O LYS A 158 131.592 -8.928 10.873 1.00 0.00 O ATOM 1225 CB LYS A 158 130.042 -9.333 8.683 1.00 0.00 C ATOM 1226 CG LYS A 158 129.109 -10.298 9.399 1.00 0.00 C ATOM 1227 CD LYS A 158 127.820 -10.506 8.622 1.00 0.00 C ATOM 1228 CE LYS A 158 126.747 -11.147 9.488 1.00 0.00 C ATOM 1229 NZ LYS A 158 127.095 -12.546 9.861 1.00 0.00 N ATOM 0 H LYS A 158 131.052 -7.276 7.570 1.00 0.00 H new ATOM 0 HA LYS A 158 129.078 -7.698 9.688 1.00 0.00 H new ATOM 0 HB2 LYS A 158 129.738 -9.253 7.639 1.00 0.00 H new ATOM 0 HB3 LYS A 158 131.052 -9.744 8.690 1.00 0.00 H new ATOM 0 HG2 LYS A 158 129.611 -11.256 9.537 1.00 0.00 H new ATOM 0 HG3 LYS A 158 128.878 -9.913 10.392 1.00 0.00 H new ATOM 0 HD2 LYS A 158 127.462 -9.548 8.246 1.00 0.00 H new ATOM 0 HD3 LYS A 158 128.014 -11.137 7.754 1.00 0.00 H new ATOM 0 HE2 LYS A 158 126.609 -10.554 10.392 1.00 0.00 H new ATOM 0 HE3 LYS A 158 125.797 -11.140 8.953 1.00 0.00 H new ATOM 0 HZ1 LYS A 158 126.338 -12.947 10.451 1.00 0.00 H new ATOM 0 HZ2 LYS A 158 127.202 -13.119 8.999 1.00 0.00 H new ATOM 0 HZ3 LYS A 158 127.988 -12.551 10.394 1.00 0.00 H new ATOM 1243 N GLY A 159 131.305 -6.700 10.986 1.00 0.00 N ATOM 1244 CA GLY A 159 132.232 -6.549 12.092 1.00 0.00 C ATOM 1245 C GLY A 159 133.569 -5.988 11.651 1.00 0.00 C ATOM 1246 O GLY A 159 134.580 -6.694 11.660 1.00 0.00 O ATOM 0 H GLY A 159 130.878 -5.832 10.664 1.00 0.00 H new ATOM 0 HA2 GLY A 159 131.794 -5.891 12.842 1.00 0.00 H new ATOM 0 HA3 GLY A 159 132.386 -7.517 12.568 1.00 0.00 H new ATOM 1250 N VAL A 160 133.577 -4.718 11.263 1.00 0.00 N ATOM 1251 CA VAL A 160 134.799 -4.063 10.813 1.00 0.00 C ATOM 1252 C VAL A 160 135.838 -4.019 11.927 1.00 0.00 C ATOM 1253 O VAL A 160 136.926 -4.583 11.799 1.00 0.00 O ATOM 1254 CB VAL A 160 134.528 -2.626 10.324 1.00 0.00 C ATOM 1255 CG1 VAL A 160 135.725 -2.089 9.557 1.00 0.00 C ATOM 1256 CG2 VAL A 160 133.267 -2.574 9.468 1.00 0.00 C ATOM 0 H VAL A 160 132.750 -4.121 11.251 1.00 0.00 H new ATOM 0 HA VAL A 160 135.182 -4.653 9.980 1.00 0.00 H new ATOM 0 HB VAL A 160 134.369 -1.992 11.196 1.00 0.00 H new ATOM 0 HG11 VAL A 160 135.515 -1.074 9.220 1.00 0.00 H new ATOM 0 HG12 VAL A 160 136.600 -2.082 10.207 1.00 0.00 H new ATOM 0 HG13 VAL A 160 135.919 -2.725 8.694 1.00 0.00 H new ATOM 0 HG21 VAL A 160 133.096 -1.551 9.134 1.00 0.00 H new ATOM 0 HG22 VAL A 160 133.389 -3.223 8.601 1.00 0.00 H new ATOM 0 HG23 VAL A 160 132.414 -2.911 10.056 1.00 0.00 H new ATOM 1266 N GLU A 161 135.498 -3.345 13.021 1.00 0.00 N ATOM 1267 CA GLU A 161 136.404 -3.227 14.158 1.00 0.00 C ATOM 1268 C GLU A 161 136.041 -4.229 15.250 1.00 0.00 C ATOM 1269 O GLU A 161 136.829 -4.484 16.160 1.00 0.00 O ATOM 1270 CB GLU A 161 136.366 -1.807 14.724 1.00 0.00 C ATOM 1271 CG GLU A 161 135.010 -1.409 15.281 1.00 0.00 C ATOM 1272 CD GLU A 161 134.215 -0.546 14.320 1.00 0.00 C ATOM 1273 OE1 GLU A 161 133.862 -1.043 13.230 1.00 0.00 O ATOM 1274 OE2 GLU A 161 133.945 0.625 14.659 1.00 0.00 O ATOM 0 H GLU A 161 134.602 -2.873 13.144 1.00 0.00 H new ATOM 0 HA GLU A 161 137.413 -3.445 13.808 1.00 0.00 H new ATOM 0 HB2 GLU A 161 137.113 -1.719 15.513 1.00 0.00 H new ATOM 0 HB3 GLU A 161 136.647 -1.105 13.939 1.00 0.00 H new ATOM 0 HG2 GLU A 161 134.439 -2.308 15.514 1.00 0.00 H new ATOM 0 HG3 GLU A 161 135.150 -0.869 16.217 1.00 0.00 H new TER 1281 GLU A 161 HETATM 1282 CA CA A 162 131.949 1.950 -9.403 1.00 0.00 CA HETATM 1283 CA CA A 163 136.937 -7.613 -3.693 1.00 0.00 CA