USER MOD reduce.3.24.130724 H: found=0, std=0, add=621, rem=0, adj=16 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 Single : A 81 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 84 CYS SG : rot 180:sc= 0 USER MOD Single : A 85 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 SER OG : rot 158:sc= 0.0144 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 LYS NZ :NH3+ -162:sc= -0.0141 (180deg=-0.22) USER MOD Single : A 93 THR OG1 : rot 180:sc= 0.00354 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 103 MET CE :methyl -169:sc= -3.39 (180deg=-3.83!) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ -138:sc=-0.00411 (180deg=-0.374) USER MOD Single : A 120 MET CE :methyl -135:sc= -2.67 (180deg=-6.96!) USER MOD Single : A 122 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 124 THR OG1 : rot -61:sc= 0.767 USER MOD Single : A 127 THR OG1 : rot 41:sc= 0.373 USER MOD Single : A 129 THR OG1 : rot -137:sc= -0.706 USER MOD Single : A 137 MET CE :methyl 166:sc= -2.59 (180deg=-3.32) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 LYS NZ :NH3+ 140:sc= 0.471 (180deg=-0.12) USER MOD Single : A 143 ASN : amide:sc= -2.28 K(o=-2.3,f=-9.2!) USER MOD Single : A 144 ASN : amide:sc= -0.193 K(o=-0.19,f=-1.8!) 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+ -175:sc= 0 (180deg=-0.011) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 81 97.890 -5.033 14.267 1.00 0.00 N ATOM 2 CA MET A 81 96.600 -4.306 14.150 1.00 0.00 C ATOM 3 C MET A 81 95.434 -5.275 13.987 1.00 0.00 C ATOM 4 O MET A 81 94.573 -5.380 14.862 1.00 0.00 O ATOM 5 CB MET A 81 96.676 -3.367 12.944 1.00 0.00 C ATOM 6 CG MET A 81 97.630 -2.200 13.142 1.00 0.00 C ATOM 7 SD MET A 81 97.102 -1.087 14.458 1.00 0.00 S ATOM 8 CE MET A 81 98.033 0.387 14.047 1.00 0.00 C ATOM 0 HA MET A 81 96.428 -3.735 15.062 1.00 0.00 H new ATOM 0 HB2 MET A 81 96.989 -3.937 12.069 1.00 0.00 H new ATOM 0 HB3 MET A 81 95.680 -2.979 12.732 1.00 0.00 H new ATOM 0 HG2 MET A 81 98.624 -2.583 13.373 1.00 0.00 H new ATOM 0 HG3 MET A 81 97.712 -1.641 12.210 1.00 0.00 H new ATOM 0 HE1 MET A 81 97.813 1.170 14.773 1.00 0.00 H new ATOM 0 HE2 MET A 81 99.099 0.162 14.068 1.00 0.00 H new ATOM 0 HE3 MET A 81 97.754 0.727 13.050 1.00 0.00 H new ATOM 20 N VAL A 82 95.411 -5.984 12.863 1.00 0.00 N ATOM 21 CA VAL A 82 94.352 -6.945 12.586 1.00 0.00 C ATOM 22 C VAL A 82 94.902 -8.367 12.521 1.00 0.00 C ATOM 23 O VAL A 82 94.263 -9.313 12.981 1.00 0.00 O ATOM 24 CB VAL A 82 93.629 -6.619 11.263 1.00 0.00 C ATOM 25 CG1 VAL A 82 94.598 -6.687 10.092 1.00 0.00 C ATOM 26 CG2 VAL A 82 92.453 -7.559 11.048 1.00 0.00 C ATOM 0 H VAL A 82 96.115 -5.910 12.129 1.00 0.00 H new ATOM 0 HA VAL A 82 93.637 -6.875 13.406 1.00 0.00 H new ATOM 0 HB VAL A 82 93.242 -5.602 11.325 1.00 0.00 H new ATOM 0 HG11 VAL A 82 94.069 -6.454 9.168 1.00 0.00 H new ATOM 0 HG12 VAL A 82 95.401 -5.966 10.242 1.00 0.00 H new ATOM 0 HG13 VAL A 82 95.019 -7.690 10.026 1.00 0.00 H new ATOM 0 HG21 VAL A 82 91.957 -7.312 10.109 1.00 0.00 H new ATOM 0 HG22 VAL A 82 92.812 -8.588 11.009 1.00 0.00 H new ATOM 0 HG23 VAL A 82 91.746 -7.452 11.871 1.00 0.00 H new ATOM 36 N ARG A 83 96.092 -8.510 11.946 1.00 0.00 N ATOM 37 CA ARG A 83 96.727 -9.816 11.820 1.00 0.00 C ATOM 38 C ARG A 83 98.241 -9.676 11.699 1.00 0.00 C ATOM 39 O ARG A 83 98.742 -9.023 10.786 1.00 0.00 O ATOM 40 CB ARG A 83 96.171 -10.562 10.605 1.00 0.00 C ATOM 41 CG ARG A 83 96.034 -12.059 10.823 1.00 0.00 C ATOM 42 CD ARG A 83 94.872 -12.633 10.026 1.00 0.00 C ATOM 43 NE ARG A 83 95.287 -13.084 8.700 1.00 0.00 N ATOM 44 CZ ARG A 83 94.550 -13.875 7.922 1.00 0.00 C ATOM 45 NH1 ARG A 83 93.364 -14.305 8.335 1.00 0.00 N ATOM 46 NH2 ARG A 83 95.003 -14.238 6.730 1.00 0.00 N ATOM 0 H ARG A 83 96.635 -7.738 11.560 1.00 0.00 H new ATOM 0 HA ARG A 83 96.505 -10.389 12.721 1.00 0.00 H new ATOM 0 HB2 ARG A 83 95.195 -10.149 10.351 1.00 0.00 H new ATOM 0 HB3 ARG A 83 96.824 -10.386 9.750 1.00 0.00 H new ATOM 0 HG2 ARG A 83 96.959 -12.557 10.531 1.00 0.00 H new ATOM 0 HG3 ARG A 83 95.885 -12.261 11.884 1.00 0.00 H new ATOM 0 HD2 ARG A 83 94.435 -13.469 10.573 1.00 0.00 H new ATOM 0 HD3 ARG A 83 94.094 -11.877 9.924 1.00 0.00 H new ATOM 0 HE ARG A 83 96.194 -12.775 8.350 1.00 0.00 H new ATOM 0 HH11 ARG A 83 93.013 -14.030 9.252 1.00 0.00 H new ATOM 0 HH12 ARG A 83 92.804 -14.911 7.735 1.00 0.00 H new ATOM 0 HH21 ARG A 83 95.915 -13.912 6.410 1.00 0.00 H new ATOM 0 HH22 ARG A 83 94.440 -14.844 6.133 1.00 0.00 H new ATOM 60 N CYS A 84 98.964 -10.297 12.626 1.00 0.00 N ATOM 61 CA CYS A 84 100.421 -10.243 12.622 1.00 0.00 C ATOM 62 C CYS A 84 100.913 -8.806 12.757 1.00 0.00 C ATOM 63 O CYS A 84 100.133 -7.860 12.657 1.00 0.00 O ATOM 64 CB CYS A 84 100.972 -10.865 11.338 1.00 0.00 C ATOM 65 SG CYS A 84 101.300 -12.638 11.459 1.00 0.00 S ATOM 0 H CYS A 84 98.564 -10.843 13.389 1.00 0.00 H new ATOM 0 HA CYS A 84 100.783 -10.813 13.478 1.00 0.00 H new ATOM 0 HB2 CYS A 84 100.262 -10.692 10.529 1.00 0.00 H new ATOM 0 HB3 CYS A 84 101.895 -10.353 11.066 1.00 0.00 H new ATOM 0 HG CYS A 84 101.761 -13.073 10.324 1.00 0.00 H new ATOM 71 N MET A 85 102.213 -8.651 12.987 1.00 0.00 N ATOM 72 CA MET A 85 102.811 -7.328 13.136 1.00 0.00 C ATOM 73 C MET A 85 103.724 -7.009 11.956 1.00 0.00 C ATOM 74 O MET A 85 104.872 -7.451 11.909 1.00 0.00 O ATOM 75 CB MET A 85 103.600 -7.246 14.443 1.00 0.00 C ATOM 76 CG MET A 85 103.682 -5.841 15.017 1.00 0.00 C ATOM 77 SD MET A 85 104.786 -5.735 16.439 1.00 0.00 S ATOM 78 CE MET A 85 103.997 -4.433 17.384 1.00 0.00 C ATOM 0 H MET A 85 102.872 -9.424 13.074 1.00 0.00 H new ATOM 0 HA MET A 85 102.006 -6.593 13.160 1.00 0.00 H new ATOM 0 HB2 MET A 85 103.137 -7.904 15.179 1.00 0.00 H new ATOM 0 HB3 MET A 85 104.610 -7.619 14.272 1.00 0.00 H new ATOM 0 HG2 MET A 85 104.027 -5.156 14.242 1.00 0.00 H new ATOM 0 HG3 MET A 85 102.685 -5.514 15.311 1.00 0.00 H new ATOM 0 HE1 MET A 85 104.564 -4.251 18.297 1.00 0.00 H new ATOM 0 HE2 MET A 85 103.964 -3.520 16.789 1.00 0.00 H new ATOM 0 HE3 MET A 85 102.982 -4.735 17.642 1.00 0.00 H new ATOM 88 N LYS A 86 103.207 -6.236 11.007 1.00 0.00 N ATOM 89 CA LYS A 86 103.977 -5.857 9.828 1.00 0.00 C ATOM 90 C LYS A 86 104.127 -4.341 9.742 1.00 0.00 C ATOM 91 O LYS A 86 104.185 -3.773 8.651 1.00 0.00 O ATOM 92 CB LYS A 86 103.303 -6.386 8.560 1.00 0.00 C ATOM 93 CG LYS A 86 103.323 -7.901 8.452 1.00 0.00 C ATOM 94 CD LYS A 86 102.548 -8.385 7.235 1.00 0.00 C ATOM 95 CE LYS A 86 102.535 -9.901 7.151 1.00 0.00 C ATOM 96 NZ LYS A 86 101.479 -10.398 6.224 1.00 0.00 N ATOM 0 H LYS A 86 102.259 -5.860 11.031 1.00 0.00 H new ATOM 0 HA LYS A 86 104.969 -6.299 9.915 1.00 0.00 H new ATOM 0 HB2 LYS A 86 102.269 -6.041 8.536 1.00 0.00 H new ATOM 0 HB3 LYS A 86 103.801 -5.961 7.689 1.00 0.00 H new ATOM 0 HG2 LYS A 86 104.354 -8.249 8.389 1.00 0.00 H new ATOM 0 HG3 LYS A 86 102.894 -8.337 9.354 1.00 0.00 H new ATOM 0 HD2 LYS A 86 101.524 -8.013 7.283 1.00 0.00 H new ATOM 0 HD3 LYS A 86 102.995 -7.973 6.330 1.00 0.00 H new ATOM 0 HE2 LYS A 86 103.509 -10.254 6.814 1.00 0.00 H new ATOM 0 HE3 LYS A 86 102.371 -10.318 8.145 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 101.504 -11.437 6.195 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 100.546 -10.083 6.559 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 101.649 -10.021 5.270 1.00 0.00 H new ATOM 110 N ASP A 87 104.189 -3.692 10.900 1.00 0.00 N ATOM 111 CA ASP A 87 104.333 -2.240 10.959 1.00 0.00 C ATOM 112 C ASP A 87 105.713 -1.847 11.478 1.00 0.00 C ATOM 113 O ASP A 87 106.588 -1.458 10.705 1.00 0.00 O ATOM 114 CB ASP A 87 103.244 -1.619 11.845 1.00 0.00 C ATOM 115 CG ASP A 87 102.754 -2.560 12.932 1.00 0.00 C ATOM 116 OD1 ASP A 87 102.075 -3.552 12.597 1.00 0.00 O ATOM 117 OD2 ASP A 87 103.054 -2.303 14.117 1.00 0.00 O ATOM 0 H ASP A 87 104.142 -4.148 11.811 1.00 0.00 H new ATOM 0 HA ASP A 87 104.222 -1.856 9.945 1.00 0.00 H new ATOM 0 HB2 ASP A 87 103.633 -0.711 12.306 1.00 0.00 H new ATOM 0 HB3 ASP A 87 102.401 -1.323 11.221 1.00 0.00 H new ATOM 122 N ASP A 88 105.902 -1.951 12.790 1.00 0.00 N ATOM 123 CA ASP A 88 107.178 -1.606 13.407 1.00 0.00 C ATOM 124 C ASP A 88 107.866 -2.845 13.970 1.00 0.00 C ATOM 125 O ASP A 88 108.590 -2.769 14.963 1.00 0.00 O ATOM 126 CB ASP A 88 106.967 -0.579 14.521 1.00 0.00 C ATOM 127 CG ASP A 88 105.947 -1.034 15.544 1.00 0.00 C ATOM 128 OD1 ASP A 88 106.034 -2.197 15.993 1.00 0.00 O ATOM 129 OD2 ASP A 88 105.059 -0.230 15.897 1.00 0.00 O ATOM 0 H ASP A 88 105.189 -2.271 13.445 1.00 0.00 H new ATOM 0 HA ASP A 88 107.819 -1.175 12.638 1.00 0.00 H new ATOM 0 HB2 ASP A 88 107.917 -0.389 15.020 1.00 0.00 H new ATOM 0 HB3 ASP A 88 106.642 0.365 14.084 1.00 0.00 H new ATOM 134 N SER A 89 107.637 -3.986 13.329 1.00 0.00 N ATOM 135 CA SER A 89 108.236 -5.241 13.764 1.00 0.00 C ATOM 136 C SER A 89 109.754 -5.205 13.610 1.00 0.00 C ATOM 137 O SER A 89 110.486 -5.118 14.596 1.00 0.00 O ATOM 138 CB SER A 89 107.654 -6.412 12.968 1.00 0.00 C ATOM 139 OG SER A 89 106.748 -7.166 13.755 1.00 0.00 O ATOM 0 H SER A 89 107.040 -4.067 12.506 1.00 0.00 H new ATOM 0 HA SER A 89 108.003 -5.379 14.820 1.00 0.00 H new ATOM 0 HB2 SER A 89 107.144 -6.035 12.082 1.00 0.00 H new ATOM 0 HB3 SER A 89 108.462 -7.056 12.621 1.00 0.00 H new ATOM 0 HG SER A 89 106.144 -7.668 13.168 1.00 0.00 H new ATOM 145 N LYS A 90 110.218 -5.271 12.367 1.00 0.00 N ATOM 146 CA LYS A 90 111.649 -5.244 12.083 1.00 0.00 C ATOM 147 C LYS A 90 112.013 -4.033 11.232 1.00 0.00 C ATOM 148 O LYS A 90 111.392 -3.777 10.201 1.00 0.00 O ATOM 149 CB LYS A 90 112.073 -6.529 11.370 1.00 0.00 C ATOM 150 CG LYS A 90 111.358 -6.756 10.048 1.00 0.00 C ATOM 151 CD LYS A 90 111.167 -8.238 9.763 1.00 0.00 C ATOM 152 CE LYS A 90 109.761 -8.534 9.267 1.00 0.00 C ATOM 153 NZ LYS A 90 109.748 -9.614 8.243 1.00 0.00 N ATOM 0 H LYS A 90 109.625 -5.344 11.540 1.00 0.00 H new ATOM 0 HA LYS A 90 112.180 -5.171 13.032 1.00 0.00 H new ATOM 0 HB2 LYS A 90 113.148 -6.498 11.191 1.00 0.00 H new ATOM 0 HB3 LYS A 90 111.884 -7.378 12.026 1.00 0.00 H new ATOM 0 HG2 LYS A 90 110.387 -6.261 10.069 1.00 0.00 H new ATOM 0 HG3 LYS A 90 111.931 -6.300 9.241 1.00 0.00 H new ATOM 0 HD2 LYS A 90 111.893 -8.562 9.017 1.00 0.00 H new ATOM 0 HD3 LYS A 90 111.363 -8.812 10.669 1.00 0.00 H new ATOM 0 HE2 LYS A 90 109.133 -8.825 10.109 1.00 0.00 H new ATOM 0 HE3 LYS A 90 109.327 -7.628 8.844 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 108.771 -9.785 7.931 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 110.326 -9.326 7.428 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 110.138 -10.486 8.654 1.00 0.00 H new ATOM 167 N GLY A 91 113.023 -3.288 11.672 1.00 0.00 N ATOM 168 CA GLY A 91 113.452 -2.111 10.940 1.00 0.00 C ATOM 169 C GLY A 91 114.484 -2.431 9.876 1.00 0.00 C ATOM 170 O GLY A 91 114.832 -3.593 9.668 1.00 0.00 O ATOM 0 H GLY A 91 113.552 -3.479 12.523 1.00 0.00 H new ATOM 0 HA2 GLY A 91 112.586 -1.643 10.472 1.00 0.00 H new ATOM 0 HA3 GLY A 91 113.868 -1.385 11.638 1.00 0.00 H new ATOM 174 N LYS A 92 114.971 -1.394 9.198 1.00 0.00 N ATOM 175 CA LYS A 92 115.967 -1.565 8.145 1.00 0.00 C ATOM 176 C LYS A 92 117.188 -2.324 8.661 1.00 0.00 C ATOM 177 O LYS A 92 118.009 -1.775 9.393 1.00 0.00 O ATOM 178 CB LYS A 92 116.397 -0.203 7.596 1.00 0.00 C ATOM 179 CG LYS A 92 115.266 0.572 6.940 1.00 0.00 C ATOM 180 CD LYS A 92 115.740 1.924 6.432 1.00 0.00 C ATOM 181 CE LYS A 92 115.862 2.934 7.562 1.00 0.00 C ATOM 182 NZ LYS A 92 114.531 3.332 8.098 1.00 0.00 N ATOM 0 H LYS A 92 114.691 -0.427 9.360 1.00 0.00 H new ATOM 0 HA LYS A 92 115.512 -2.148 7.344 1.00 0.00 H new ATOM 0 HB2 LYS A 92 116.811 0.393 8.409 1.00 0.00 H new ATOM 0 HB3 LYS A 92 117.196 -0.349 6.869 1.00 0.00 H new ATOM 0 HG2 LYS A 92 114.859 -0.007 6.111 1.00 0.00 H new ATOM 0 HG3 LYS A 92 114.457 0.714 7.657 1.00 0.00 H new ATOM 0 HD2 LYS A 92 116.705 1.810 5.939 1.00 0.00 H new ATOM 0 HD3 LYS A 92 115.042 2.297 5.683 1.00 0.00 H new ATOM 0 HE2 LYS A 92 116.464 2.509 8.365 1.00 0.00 H new ATOM 0 HE3 LYS A 92 116.388 3.819 7.203 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 114.624 4.219 8.634 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 113.867 3.471 7.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 114.172 2.584 8.725 1.00 0.00 H new ATOM 196 N THR A 93 117.295 -3.591 8.273 1.00 0.00 N ATOM 197 CA THR A 93 118.414 -4.427 8.698 1.00 0.00 C ATOM 198 C THR A 93 119.488 -4.493 7.616 1.00 0.00 C ATOM 199 O THR A 93 119.428 -3.767 6.624 1.00 0.00 O ATOM 200 CB THR A 93 117.926 -5.839 9.038 1.00 0.00 C ATOM 201 OG1 THR A 93 116.514 -5.872 9.141 1.00 0.00 O ATOM 202 CG2 THR A 93 118.492 -6.369 10.337 1.00 0.00 C ATOM 0 H THR A 93 116.623 -4.061 7.667 1.00 0.00 H new ATOM 0 HA THR A 93 118.851 -3.978 9.590 1.00 0.00 H new ATOM 0 HB THR A 93 118.277 -6.470 8.221 1.00 0.00 H new ATOM 0 HG1 THR A 93 116.223 -6.783 9.357 1.00 0.00 H new ATOM 0 HG21 THR A 93 118.107 -7.372 10.519 1.00 0.00 H new ATOM 0 HG22 THR A 93 119.580 -6.404 10.273 1.00 0.00 H new ATOM 0 HG23 THR A 93 118.198 -5.713 11.156 1.00 0.00 H new ATOM 210 N GLU A 94 120.466 -5.370 7.814 1.00 0.00 N ATOM 211 CA GLU A 94 121.555 -5.534 6.857 1.00 0.00 C ATOM 212 C GLU A 94 121.015 -5.871 5.469 1.00 0.00 C ATOM 213 O GLU A 94 121.678 -5.630 4.460 1.00 0.00 O ATOM 214 CB GLU A 94 122.511 -6.631 7.326 1.00 0.00 C ATOM 215 CG GLU A 94 123.101 -6.375 8.701 1.00 0.00 C ATOM 216 CD GLU A 94 124.541 -5.902 8.640 1.00 0.00 C ATOM 217 OE1 GLU A 94 125.364 -6.590 8.003 1.00 0.00 O ATOM 218 OE2 GLU A 94 124.842 -4.842 9.228 1.00 0.00 O ATOM 0 H GLU A 94 120.527 -5.979 8.630 1.00 0.00 H new ATOM 0 HA GLU A 94 122.097 -4.591 6.796 1.00 0.00 H new ATOM 0 HB2 GLU A 94 121.980 -7.583 7.339 1.00 0.00 H new ATOM 0 HB3 GLU A 94 123.322 -6.728 6.604 1.00 0.00 H new ATOM 0 HG2 GLU A 94 122.499 -5.627 9.217 1.00 0.00 H new ATOM 0 HG3 GLU A 94 123.048 -7.290 9.291 1.00 0.00 H new ATOM 225 N GLU A 95 119.810 -6.432 5.424 1.00 0.00 N ATOM 226 CA GLU A 95 119.185 -6.802 4.160 1.00 0.00 C ATOM 227 C GLU A 95 119.034 -5.588 3.246 1.00 0.00 C ATOM 228 O GLU A 95 119.019 -5.721 2.022 1.00 0.00 O ATOM 229 CB GLU A 95 117.816 -7.438 4.413 1.00 0.00 C ATOM 230 CG GLU A 95 116.842 -6.521 5.135 1.00 0.00 C ATOM 231 CD GLU A 95 115.498 -7.178 5.380 1.00 0.00 C ATOM 232 OE1 GLU A 95 115.472 -8.399 5.639 1.00 0.00 O ATOM 233 OE2 GLU A 95 114.470 -6.470 5.312 1.00 0.00 O ATOM 0 H GLU A 95 119.247 -6.640 6.249 1.00 0.00 H new ATOM 0 HA GLU A 95 119.831 -7.526 3.664 1.00 0.00 H new ATOM 0 HB2 GLU A 95 117.382 -7.736 3.459 1.00 0.00 H new ATOM 0 HB3 GLU A 95 117.950 -8.346 5.000 1.00 0.00 H new ATOM 0 HG2 GLU A 95 117.273 -6.217 6.089 1.00 0.00 H new ATOM 0 HG3 GLU A 95 116.698 -5.615 4.547 1.00 0.00 H new ATOM 240 N GLU A 96 118.920 -4.407 3.846 1.00 0.00 N ATOM 241 CA GLU A 96 118.766 -3.172 3.082 1.00 0.00 C ATOM 242 C GLU A 96 120.121 -2.570 2.703 1.00 0.00 C ATOM 243 O GLU A 96 120.180 -1.531 2.044 1.00 0.00 O ATOM 244 CB GLU A 96 117.951 -2.154 3.884 1.00 0.00 C ATOM 245 CG GLU A 96 118.679 -1.615 5.105 1.00 0.00 C ATOM 246 CD GLU A 96 118.878 -0.110 5.053 1.00 0.00 C ATOM 247 OE1 GLU A 96 118.811 0.459 3.944 1.00 0.00 O ATOM 248 OE2 GLU A 96 119.102 0.495 6.122 1.00 0.00 O ATOM 0 H GLU A 96 118.931 -4.278 4.858 1.00 0.00 H new ATOM 0 HA GLU A 96 118.238 -3.417 2.161 1.00 0.00 H new ATOM 0 HB2 GLU A 96 117.685 -1.321 3.233 1.00 0.00 H new ATOM 0 HB3 GLU A 96 117.018 -2.619 4.204 1.00 0.00 H new ATOM 0 HG2 GLU A 96 118.115 -1.872 6.002 1.00 0.00 H new ATOM 0 HG3 GLU A 96 119.650 -2.103 5.189 1.00 0.00 H new ATOM 255 N LEU A 97 121.205 -3.220 3.120 1.00 0.00 N ATOM 256 CA LEU A 97 122.548 -2.731 2.817 1.00 0.00 C ATOM 257 C LEU A 97 122.764 -2.607 1.311 1.00 0.00 C ATOM 258 O LEU A 97 123.581 -1.807 0.857 1.00 0.00 O ATOM 259 CB LEU A 97 123.603 -3.663 3.416 1.00 0.00 C ATOM 260 CG LEU A 97 123.878 -3.456 4.907 1.00 0.00 C ATOM 261 CD1 LEU A 97 124.650 -4.637 5.475 1.00 0.00 C ATOM 262 CD2 LEU A 97 124.643 -2.159 5.131 1.00 0.00 C ATOM 0 H LEU A 97 121.181 -4.082 3.665 1.00 0.00 H new ATOM 0 HA LEU A 97 122.649 -1.741 3.262 1.00 0.00 H new ATOM 0 HB2 LEU A 97 123.285 -4.694 3.260 1.00 0.00 H new ATOM 0 HB3 LEU A 97 124.536 -3.531 2.868 1.00 0.00 H new ATOM 0 HG LEU A 97 122.923 -3.387 5.429 1.00 0.00 H new ATOM 0 HD11 LEU A 97 124.837 -4.473 6.536 1.00 0.00 H new ATOM 0 HD12 LEU A 97 124.067 -5.549 5.346 1.00 0.00 H new ATOM 0 HD13 LEU A 97 125.600 -4.737 4.950 1.00 0.00 H new ATOM 0 HD21 LEU A 97 124.831 -2.027 6.197 1.00 0.00 H new ATOM 0 HD22 LEU A 97 125.593 -2.200 4.598 1.00 0.00 H new ATOM 0 HD23 LEU A 97 124.054 -1.320 4.759 1.00 0.00 H new ATOM 274 N SER A 98 122.029 -3.403 0.540 1.00 0.00 N ATOM 275 CA SER A 98 122.145 -3.380 -0.913 1.00 0.00 C ATOM 276 C SER A 98 121.876 -1.983 -1.465 1.00 0.00 C ATOM 277 O SER A 98 122.420 -1.598 -2.499 1.00 0.00 O ATOM 278 CB SER A 98 121.174 -4.383 -1.540 1.00 0.00 C ATOM 279 OG SER A 98 119.861 -3.854 -1.600 1.00 0.00 O ATOM 0 H SER A 98 121.347 -4.072 0.898 1.00 0.00 H new ATOM 0 HA SER A 98 123.166 -3.660 -1.171 1.00 0.00 H new ATOM 0 HB2 SER A 98 121.511 -4.641 -2.544 1.00 0.00 H new ATOM 0 HB3 SER A 98 121.172 -5.304 -0.957 1.00 0.00 H new ATOM 0 HG SER A 98 119.261 -4.514 -2.006 1.00 0.00 H new ATOM 285 N ASP A 99 121.032 -1.228 -0.768 1.00 0.00 N ATOM 286 CA ASP A 99 120.693 0.127 -1.189 1.00 0.00 C ATOM 287 C ASP A 99 121.855 1.083 -0.943 1.00 0.00 C ATOM 288 O ASP A 99 122.078 2.017 -1.713 1.00 0.00 O ATOM 289 CB ASP A 99 119.447 0.618 -0.450 1.00 0.00 C ATOM 290 CG ASP A 99 118.535 1.443 -1.335 1.00 0.00 C ATOM 291 OD1 ASP A 99 118.487 1.172 -2.554 1.00 0.00 O ATOM 292 OD2 ASP A 99 117.871 2.362 -0.812 1.00 0.00 O ATOM 0 H ASP A 99 120.571 -1.531 0.090 1.00 0.00 H new ATOM 0 HA ASP A 99 120.487 0.105 -2.259 1.00 0.00 H new ATOM 0 HB2 ASP A 99 118.896 -0.240 -0.065 1.00 0.00 H new ATOM 0 HB3 ASP A 99 119.750 1.215 0.410 1.00 0.00 H new ATOM 297 N LEU A 100 122.591 0.844 0.136 1.00 0.00 N ATOM 298 CA LEU A 100 123.731 1.684 0.487 1.00 0.00 C ATOM 299 C LEU A 100 124.878 1.498 -0.504 1.00 0.00 C ATOM 300 O LEU A 100 125.740 2.366 -0.638 1.00 0.00 O ATOM 301 CB LEU A 100 124.208 1.365 1.905 1.00 0.00 C ATOM 302 CG LEU A 100 123.402 2.027 3.022 1.00 0.00 C ATOM 303 CD1 LEU A 100 123.478 1.201 4.297 1.00 0.00 C ATOM 304 CD2 LEU A 100 123.901 3.443 3.273 1.00 0.00 C ATOM 0 H LEU A 100 122.419 0.075 0.784 1.00 0.00 H new ATOM 0 HA LEU A 100 123.408 2.724 0.444 1.00 0.00 H new ATOM 0 HB2 LEU A 100 124.179 0.285 2.048 1.00 0.00 H new ATOM 0 HB3 LEU A 100 125.250 1.671 1.999 1.00 0.00 H new ATOM 0 HG LEU A 100 122.359 2.080 2.708 1.00 0.00 H new ATOM 0 HD11 LEU A 100 122.898 1.688 5.081 1.00 0.00 H new ATOM 0 HD12 LEU A 100 123.073 0.206 4.111 1.00 0.00 H new ATOM 0 HD13 LEU A 100 124.517 1.116 4.614 1.00 0.00 H new ATOM 0 HD21 LEU A 100 123.316 3.899 4.071 1.00 0.00 H new ATOM 0 HD22 LEU A 100 124.951 3.412 3.565 1.00 0.00 H new ATOM 0 HD23 LEU A 100 123.794 4.033 2.363 1.00 0.00 H new ATOM 316 N PHE A 101 124.891 0.357 -1.185 1.00 0.00 N ATOM 317 CA PHE A 101 125.941 0.058 -2.150 1.00 0.00 C ATOM 318 C PHE A 101 125.771 0.874 -3.429 1.00 0.00 C ATOM 319 O PHE A 101 126.745 1.385 -3.982 1.00 0.00 O ATOM 320 CB PHE A 101 125.941 -1.435 -2.485 1.00 0.00 C ATOM 321 CG PHE A 101 127.022 -1.834 -3.448 1.00 0.00 C ATOM 322 CD1 PHE A 101 128.343 -1.912 -3.035 1.00 0.00 C ATOM 323 CD2 PHE A 101 126.718 -2.129 -4.768 1.00 0.00 C ATOM 324 CE1 PHE A 101 129.339 -2.276 -3.919 1.00 0.00 C ATOM 325 CE2 PHE A 101 127.710 -2.494 -5.657 1.00 0.00 C ATOM 326 CZ PHE A 101 129.023 -2.568 -5.232 1.00 0.00 C ATOM 0 H PHE A 101 124.187 -0.375 -1.086 1.00 0.00 H new ATOM 0 HA PHE A 101 126.895 0.329 -1.698 1.00 0.00 H new ATOM 0 HB2 PHE A 101 126.058 -2.006 -1.564 1.00 0.00 H new ATOM 0 HB3 PHE A 101 124.973 -1.704 -2.906 1.00 0.00 H new ATOM 0 HD1 PHE A 101 128.596 -1.685 -2.010 1.00 0.00 H new ATOM 0 HD2 PHE A 101 125.694 -2.073 -5.105 1.00 0.00 H new ATOM 0 HE1 PHE A 101 130.364 -2.332 -3.585 1.00 0.00 H new ATOM 0 HE2 PHE A 101 127.460 -2.721 -6.683 1.00 0.00 H new ATOM 0 HZ PHE A 101 129.801 -2.854 -5.925 1.00 0.00 H new ATOM 336 N ARG A 102 124.533 0.985 -3.900 1.00 0.00 N ATOM 337 CA ARG A 102 124.243 1.730 -5.121 1.00 0.00 C ATOM 338 C ARG A 102 124.687 3.182 -4.999 1.00 0.00 C ATOM 339 O ARG A 102 125.425 3.690 -5.843 1.00 0.00 O ATOM 340 CB ARG A 102 122.746 1.669 -5.435 1.00 0.00 C ATOM 341 CG ARG A 102 122.439 1.601 -6.923 1.00 0.00 C ATOM 342 CD ARG A 102 121.691 0.327 -7.281 1.00 0.00 C ATOM 343 NE ARG A 102 122.596 -0.735 -7.719 1.00 0.00 N ATOM 344 CZ ARG A 102 122.211 -1.986 -7.955 1.00 0.00 C ATOM 345 NH1 ARG A 102 120.941 -2.340 -7.796 1.00 0.00 N ATOM 346 NH2 ARG A 102 123.098 -2.889 -8.350 1.00 0.00 N ATOM 0 H ARG A 102 123.715 0.569 -3.455 1.00 0.00 H new ATOM 0 HA ARG A 102 124.801 1.269 -5.936 1.00 0.00 H new ATOM 0 HB2 ARG A 102 122.315 0.797 -4.943 1.00 0.00 H new ATOM 0 HB3 ARG A 102 122.258 2.547 -5.011 1.00 0.00 H new ATOM 0 HG2 ARG A 102 121.844 2.467 -7.212 1.00 0.00 H new ATOM 0 HG3 ARG A 102 123.369 1.650 -7.490 1.00 0.00 H new ATOM 0 HD2 ARG A 102 121.123 -0.015 -6.416 1.00 0.00 H new ATOM 0 HD3 ARG A 102 120.971 0.539 -8.072 1.00 0.00 H new ATOM 0 HE ARG A 102 123.580 -0.503 -7.851 1.00 0.00 H new ATOM 0 HH11 ARG A 102 120.254 -1.651 -7.491 1.00 0.00 H new ATOM 0 HH12 ARG A 102 120.653 -3.301 -7.979 1.00 0.00 H new ATOM 0 HH21 ARG A 102 124.075 -2.624 -8.473 1.00 0.00 H new ATOM 0 HH22 ARG A 102 122.803 -3.848 -8.531 1.00 0.00 H new ATOM 360 N MET A 103 124.236 3.846 -3.941 1.00 0.00 N ATOM 361 CA MET A 103 124.588 5.244 -3.712 1.00 0.00 C ATOM 362 C MET A 103 126.103 5.420 -3.653 1.00 0.00 C ATOM 363 O MET A 103 126.651 6.356 -4.234 1.00 0.00 O ATOM 364 CB MET A 103 123.951 5.764 -2.420 1.00 0.00 C ATOM 365 CG MET A 103 123.930 4.745 -1.290 1.00 0.00 C ATOM 366 SD MET A 103 124.523 5.423 0.273 1.00 0.00 S ATOM 367 CE MET A 103 126.150 5.998 -0.200 1.00 0.00 C ATOM 0 H MET A 103 123.628 3.441 -3.230 1.00 0.00 H new ATOM 0 HA MET A 103 124.201 5.824 -4.549 1.00 0.00 H new ATOM 0 HB2 MET A 103 124.495 6.648 -2.089 1.00 0.00 H new ATOM 0 HB3 MET A 103 122.929 6.079 -2.631 1.00 0.00 H new ATOM 0 HG2 MET A 103 122.913 4.376 -1.158 1.00 0.00 H new ATOM 0 HG3 MET A 103 124.546 3.889 -1.567 1.00 0.00 H new ATOM 0 HE1 MET A 103 126.716 6.263 0.693 1.00 0.00 H new ATOM 0 HE2 MET A 103 126.673 5.208 -0.739 1.00 0.00 H new ATOM 0 HE3 MET A 103 126.054 6.874 -0.842 1.00 0.00 H new ATOM 377 N PHE A 104 126.773 4.512 -2.951 1.00 0.00 N ATOM 378 CA PHE A 104 128.224 4.570 -2.822 1.00 0.00 C ATOM 379 C PHE A 104 128.898 4.415 -4.182 1.00 0.00 C ATOM 380 O PHE A 104 129.955 4.994 -4.432 1.00 0.00 O ATOM 381 CB PHE A 104 128.715 3.479 -1.864 1.00 0.00 C ATOM 382 CG PHE A 104 129.267 4.019 -0.575 1.00 0.00 C ATOM 383 CD1 PHE A 104 130.498 4.654 -0.546 1.00 0.00 C ATOM 384 CD2 PHE A 104 128.554 3.893 0.606 1.00 0.00 C ATOM 385 CE1 PHE A 104 131.008 5.152 0.638 1.00 0.00 C ATOM 386 CE2 PHE A 104 129.059 4.388 1.793 1.00 0.00 C ATOM 387 CZ PHE A 104 130.288 5.019 1.808 1.00 0.00 C ATOM 0 H PHE A 104 126.336 3.730 -2.464 1.00 0.00 H new ATOM 0 HA PHE A 104 128.491 5.546 -2.416 1.00 0.00 H new ATOM 0 HB2 PHE A 104 127.889 2.803 -1.642 1.00 0.00 H new ATOM 0 HB3 PHE A 104 129.485 2.889 -2.361 1.00 0.00 H new ATOM 0 HD1 PHE A 104 131.065 4.761 -1.459 1.00 0.00 H new ATOM 0 HD2 PHE A 104 127.592 3.402 0.599 1.00 0.00 H new ATOM 0 HE1 PHE A 104 131.969 5.645 0.648 1.00 0.00 H new ATOM 0 HE2 PHE A 104 128.494 4.282 2.707 1.00 0.00 H new ATOM 0 HZ PHE A 104 130.685 5.408 2.734 1.00 0.00 H new ATOM 397 N ASP A 105 128.276 3.632 -5.060 1.00 0.00 N ATOM 398 CA ASP A 105 128.812 3.404 -6.396 1.00 0.00 C ATOM 399 C ASP A 105 128.377 4.512 -7.350 1.00 0.00 C ATOM 400 O ASP A 105 127.304 4.440 -7.951 1.00 0.00 O ATOM 401 CB ASP A 105 128.347 2.046 -6.927 1.00 0.00 C ATOM 402 CG ASP A 105 129.202 1.552 -8.079 1.00 0.00 C ATOM 403 OD1 ASP A 105 129.758 2.397 -8.810 1.00 0.00 O ATOM 404 OD2 ASP A 105 129.313 0.320 -8.251 1.00 0.00 O ATOM 0 H ASP A 105 127.400 3.145 -4.869 1.00 0.00 H new ATOM 0 HA ASP A 105 129.900 3.409 -6.333 1.00 0.00 H new ATOM 0 HB2 ASP A 105 128.373 1.315 -6.119 1.00 0.00 H new ATOM 0 HB3 ASP A 105 127.310 2.123 -7.254 1.00 0.00 H new ATOM 409 N LYS A 106 129.213 5.537 -7.483 1.00 0.00 N ATOM 410 CA LYS A 106 128.913 6.662 -8.362 1.00 0.00 C ATOM 411 C LYS A 106 128.619 6.183 -9.779 1.00 0.00 C ATOM 412 O LYS A 106 127.639 6.602 -10.397 1.00 0.00 O ATOM 413 CB LYS A 106 130.082 7.650 -8.378 1.00 0.00 C ATOM 414 CG LYS A 106 129.719 9.014 -8.940 1.00 0.00 C ATOM 415 CD LYS A 106 129.148 9.927 -7.866 1.00 0.00 C ATOM 416 CE LYS A 106 128.084 10.854 -8.429 1.00 0.00 C ATOM 417 NZ LYS A 106 127.945 12.097 -7.621 1.00 0.00 N ATOM 0 H LYS A 106 130.104 5.612 -6.993 1.00 0.00 H new ATOM 0 HA LYS A 106 128.026 7.165 -7.976 1.00 0.00 H new ATOM 0 HB2 LYS A 106 130.456 7.773 -7.362 1.00 0.00 H new ATOM 0 HB3 LYS A 106 130.895 7.228 -8.968 1.00 0.00 H new ATOM 0 HG2 LYS A 106 130.604 9.475 -9.378 1.00 0.00 H new ATOM 0 HG3 LYS A 106 128.991 8.896 -9.743 1.00 0.00 H new ATOM 0 HD2 LYS A 106 128.720 9.324 -7.065 1.00 0.00 H new ATOM 0 HD3 LYS A 106 129.951 10.518 -7.426 1.00 0.00 H new ATOM 0 HE2 LYS A 106 128.337 11.116 -9.456 1.00 0.00 H new ATOM 0 HE3 LYS A 106 127.127 10.332 -8.460 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 127.209 12.702 -8.039 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 127.678 11.850 -6.647 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 128.850 12.609 -7.613 1.00 0.00 H new ATOM 431 N ASN A 107 129.471 5.301 -10.288 1.00 0.00 N ATOM 432 CA ASN A 107 129.301 4.763 -11.634 1.00 0.00 C ATOM 433 C ASN A 107 128.162 3.749 -11.675 1.00 0.00 C ATOM 434 O ASN A 107 127.496 3.590 -12.698 1.00 0.00 O ATOM 435 CB ASN A 107 130.600 4.111 -12.113 1.00 0.00 C ATOM 436 CG ASN A 107 131.388 5.011 -13.045 1.00 0.00 C ATOM 437 OD1 ASN A 107 131.629 4.666 -14.202 1.00 0.00 O ATOM 438 ND2 ASN A 107 131.793 6.172 -12.545 1.00 0.00 N ATOM 0 H ASN A 107 130.286 4.943 -9.790 1.00 0.00 H new ATOM 0 HA ASN A 107 129.051 5.589 -12.300 1.00 0.00 H new ATOM 0 HB2 ASN A 107 131.216 3.857 -11.250 1.00 0.00 H new ATOM 0 HB3 ASN A 107 130.368 3.177 -12.624 1.00 0.00 H new ATOM 0 HD21 ASN A 107 132.327 6.819 -13.126 1.00 0.00 H new ATOM 0 HD22 ASN A 107 131.571 6.417 -11.580 1.00 0.00 H new ATOM 445 N ALA A 108 127.941 3.067 -10.556 1.00 0.00 N ATOM 446 CA ALA A 108 126.882 2.069 -10.466 1.00 0.00 C ATOM 447 C ALA A 108 127.097 0.946 -11.475 1.00 0.00 C ATOM 448 O ALA A 108 126.197 0.606 -12.242 1.00 0.00 O ATOM 449 CB ALA A 108 125.524 2.722 -10.676 1.00 0.00 C ATOM 0 H ALA A 108 128.481 3.187 -9.699 1.00 0.00 H new ATOM 0 HA ALA A 108 126.911 1.632 -9.468 1.00 0.00 H new ATOM 0 HB1 ALA A 108 124.742 1.966 -10.606 1.00 0.00 H new ATOM 0 HB2 ALA A 108 125.363 3.482 -9.911 1.00 0.00 H new ATOM 0 HB3 ALA A 108 125.492 3.187 -11.661 1.00 0.00 H new ATOM 455 N ASP A 109 128.296 0.373 -11.470 1.00 0.00 N ATOM 456 CA ASP A 109 128.628 -0.710 -12.388 1.00 0.00 C ATOM 457 C ASP A 109 128.813 -2.034 -11.645 1.00 0.00 C ATOM 458 O ASP A 109 129.172 -3.047 -12.247 1.00 0.00 O ATOM 459 CB ASP A 109 129.901 -0.372 -13.168 1.00 0.00 C ATOM 460 CG ASP A 109 129.619 0.468 -14.397 1.00 0.00 C ATOM 461 OD1 ASP A 109 129.466 1.699 -14.252 1.00 0.00 O ATOM 462 OD2 ASP A 109 129.548 -0.105 -15.504 1.00 0.00 O ATOM 0 H ASP A 109 129.053 0.640 -10.841 1.00 0.00 H new ATOM 0 HA ASP A 109 127.796 -0.822 -13.083 1.00 0.00 H new ATOM 0 HB2 ASP A 109 130.592 0.163 -12.516 1.00 0.00 H new ATOM 0 HB3 ASP A 109 130.396 -1.296 -13.468 1.00 0.00 H new ATOM 467 N GLY A 110 128.565 -2.026 -10.336 1.00 0.00 N ATOM 468 CA GLY A 110 128.713 -3.235 -9.547 1.00 0.00 C ATOM 469 C GLY A 110 129.984 -3.243 -8.718 1.00 0.00 C ATOM 470 O GLY A 110 130.122 -4.044 -7.794 1.00 0.00 O ATOM 0 H GLY A 110 128.265 -1.205 -9.811 1.00 0.00 H new ATOM 0 HA2 GLY A 110 127.853 -3.340 -8.886 1.00 0.00 H new ATOM 0 HA3 GLY A 110 128.712 -4.099 -10.211 1.00 0.00 H new ATOM 474 N TYR A 111 130.914 -2.351 -9.049 1.00 0.00 N ATOM 475 CA TYR A 111 132.177 -2.260 -8.325 1.00 0.00 C ATOM 476 C TYR A 111 132.614 -0.808 -8.178 1.00 0.00 C ATOM 477 O TYR A 111 132.325 0.027 -9.037 1.00 0.00 O ATOM 478 CB TYR A 111 133.265 -3.057 -9.051 1.00 0.00 C ATOM 479 CG TYR A 111 132.868 -4.481 -9.367 1.00 0.00 C ATOM 480 CD1 TYR A 111 131.957 -4.762 -10.377 1.00 0.00 C ATOM 481 CD2 TYR A 111 133.408 -5.545 -8.656 1.00 0.00 C ATOM 482 CE1 TYR A 111 131.594 -6.063 -10.669 1.00 0.00 C ATOM 483 CE2 TYR A 111 133.050 -6.849 -8.943 1.00 0.00 C ATOM 484 CZ TYR A 111 132.144 -7.103 -9.950 1.00 0.00 C ATOM 485 OH TYR A 111 131.785 -8.400 -10.238 1.00 0.00 O ATOM 0 H TYR A 111 130.816 -1.682 -9.813 1.00 0.00 H new ATOM 0 HA TYR A 111 132.028 -2.681 -7.331 1.00 0.00 H new ATOM 0 HB2 TYR A 111 133.519 -2.546 -9.980 1.00 0.00 H new ATOM 0 HB3 TYR A 111 134.165 -3.068 -8.437 1.00 0.00 H new ATOM 0 HD1 TYR A 111 131.525 -3.950 -10.944 1.00 0.00 H new ATOM 0 HD2 TYR A 111 134.119 -5.350 -7.866 1.00 0.00 H new ATOM 0 HE1 TYR A 111 130.883 -6.264 -11.457 1.00 0.00 H new ATOM 0 HE2 TYR A 111 133.478 -7.665 -8.380 1.00 0.00 H new ATOM 0 HH TYR A 111 132.264 -9.012 -9.641 1.00 0.00 H new ATOM 495 N ILE A 112 133.314 -0.510 -7.089 1.00 0.00 N ATOM 496 CA ILE A 112 133.793 0.843 -6.837 1.00 0.00 C ATOM 497 C ILE A 112 135.289 0.850 -6.543 1.00 0.00 C ATOM 498 O ILE A 112 135.847 -0.147 -6.084 1.00 0.00 O ATOM 499 CB ILE A 112 133.046 1.500 -5.659 1.00 0.00 C ATOM 500 CG1 ILE A 112 131.535 1.315 -5.814 1.00 0.00 C ATOM 501 CG2 ILE A 112 133.398 2.977 -5.567 1.00 0.00 C ATOM 502 CD1 ILE A 112 130.753 1.679 -4.569 1.00 0.00 C ATOM 0 H ILE A 112 133.562 -1.187 -6.367 1.00 0.00 H new ATOM 0 HA ILE A 112 133.599 1.418 -7.742 1.00 0.00 H new ATOM 0 HB ILE A 112 133.358 1.013 -4.735 1.00 0.00 H new ATOM 0 HG12 ILE A 112 131.185 1.927 -6.646 1.00 0.00 H new ATOM 0 HG13 ILE A 112 131.328 0.277 -6.073 1.00 0.00 H new ATOM 0 HG21 ILE A 112 132.863 3.427 -4.731 1.00 0.00 H new ATOM 0 HG22 ILE A 112 134.471 3.086 -5.412 1.00 0.00 H new ATOM 0 HG23 ILE A 112 133.112 3.477 -6.492 1.00 0.00 H new ATOM 0 HD11 ILE A 112 129.689 1.524 -4.749 1.00 0.00 H new ATOM 0 HD12 ILE A 112 131.076 1.050 -3.740 1.00 0.00 H new ATOM 0 HD13 ILE A 112 130.930 2.725 -4.321 1.00 0.00 H new ATOM 514 N ASP A 113 135.931 1.981 -6.818 1.00 0.00 N ATOM 515 CA ASP A 113 137.363 2.124 -6.589 1.00 0.00 C ATOM 516 C ASP A 113 137.680 3.459 -5.922 1.00 0.00 C ATOM 517 O ASP A 113 136.777 4.218 -5.571 1.00 0.00 O ATOM 518 CB ASP A 113 138.123 2.008 -7.913 1.00 0.00 C ATOM 519 CG ASP A 113 137.609 2.975 -8.961 1.00 0.00 C ATOM 520 OD1 ASP A 113 136.380 3.016 -9.179 1.00 0.00 O ATOM 521 OD2 ASP A 113 138.436 3.691 -9.564 1.00 0.00 O ATOM 0 H ASP A 113 135.481 2.813 -7.200 1.00 0.00 H new ATOM 0 HA ASP A 113 137.681 1.323 -5.921 1.00 0.00 H new ATOM 0 HB2 ASP A 113 139.182 2.195 -7.738 1.00 0.00 H new ATOM 0 HB3 ASP A 113 138.037 0.989 -8.290 1.00 0.00 H new ATOM 526 N LEU A 114 138.969 3.737 -5.749 1.00 0.00 N ATOM 527 CA LEU A 114 139.406 4.980 -5.123 1.00 0.00 C ATOM 528 C LEU A 114 138.907 6.192 -5.902 1.00 0.00 C ATOM 529 O LEU A 114 138.593 7.230 -5.320 1.00 0.00 O ATOM 530 CB LEU A 114 140.934 5.016 -5.030 1.00 0.00 C ATOM 531 CG LEU A 114 141.499 6.070 -4.074 1.00 0.00 C ATOM 532 CD1 LEU A 114 141.857 5.441 -2.737 1.00 0.00 C ATOM 533 CD2 LEU A 114 142.714 6.751 -4.688 1.00 0.00 C ATOM 0 H LEU A 114 139.728 3.118 -6.033 1.00 0.00 H new ATOM 0 HA LEU A 114 138.983 5.018 -4.119 1.00 0.00 H new ATOM 0 HB2 LEU A 114 141.287 4.034 -4.714 1.00 0.00 H new ATOM 0 HB3 LEU A 114 141.340 5.196 -6.026 1.00 0.00 H new ATOM 0 HG LEU A 114 140.732 6.825 -3.903 1.00 0.00 H new ATOM 0 HD11 LEU A 114 142.257 6.205 -2.071 1.00 0.00 H new ATOM 0 HD12 LEU A 114 140.965 5.002 -2.291 1.00 0.00 H new ATOM 0 HD13 LEU A 114 142.606 4.664 -2.889 1.00 0.00 H new ATOM 0 HD21 LEU A 114 143.102 7.497 -3.994 1.00 0.00 H new ATOM 0 HD22 LEU A 114 143.485 6.007 -4.890 1.00 0.00 H new ATOM 0 HD23 LEU A 114 142.426 7.237 -5.620 1.00 0.00 H new ATOM 545 N GLU A 115 138.837 6.053 -7.222 1.00 0.00 N ATOM 546 CA GLU A 115 138.377 7.138 -8.082 1.00 0.00 C ATOM 547 C GLU A 115 136.939 7.524 -7.748 1.00 0.00 C ATOM 548 O GLU A 115 136.643 8.691 -7.487 1.00 0.00 O ATOM 549 CB GLU A 115 138.484 6.732 -9.553 1.00 0.00 C ATOM 550 CG GLU A 115 139.112 7.799 -10.436 1.00 0.00 C ATOM 551 CD GLU A 115 138.413 7.931 -11.774 1.00 0.00 C ATOM 552 OE1 GLU A 115 138.167 6.892 -12.422 1.00 0.00 O ATOM 553 OE2 GLU A 115 138.111 9.075 -12.176 1.00 0.00 O ATOM 0 H GLU A 115 139.093 5.200 -7.719 1.00 0.00 H new ATOM 0 HA GLU A 115 139.015 8.004 -7.906 1.00 0.00 H new ATOM 0 HB2 GLU A 115 139.074 5.818 -9.627 1.00 0.00 H new ATOM 0 HB3 GLU A 115 137.488 6.500 -9.930 1.00 0.00 H new ATOM 0 HG2 GLU A 115 139.083 8.758 -9.918 1.00 0.00 H new ATOM 0 HG3 GLU A 115 140.162 7.558 -10.601 1.00 0.00 H new ATOM 560 N GLU A 116 136.050 6.538 -7.757 1.00 0.00 N ATOM 561 CA GLU A 116 134.643 6.774 -7.455 1.00 0.00 C ATOM 562 C GLU A 116 134.459 7.136 -5.984 1.00 0.00 C ATOM 563 O GLU A 116 133.756 8.091 -5.653 1.00 0.00 O ATOM 564 CB GLU A 116 133.811 5.536 -7.797 1.00 0.00 C ATOM 565 CG GLU A 116 133.200 5.580 -9.188 1.00 0.00 C ATOM 566 CD GLU A 116 133.486 4.326 -9.991 1.00 0.00 C ATOM 567 OE1 GLU A 116 132.813 3.301 -9.750 1.00 0.00 O ATOM 568 OE2 GLU A 116 134.382 4.367 -10.861 1.00 0.00 O ATOM 0 H GLU A 116 136.278 5.567 -7.970 1.00 0.00 H new ATOM 0 HA GLU A 116 134.300 7.611 -8.063 1.00 0.00 H new ATOM 0 HB2 GLU A 116 134.441 4.650 -7.714 1.00 0.00 H new ATOM 0 HB3 GLU A 116 133.013 5.430 -7.062 1.00 0.00 H new ATOM 0 HG2 GLU A 116 132.122 5.714 -9.103 1.00 0.00 H new ATOM 0 HG3 GLU A 116 133.588 6.446 -9.724 1.00 0.00 H new ATOM 575 N LEU A 117 135.096 6.367 -5.108 1.00 0.00 N ATOM 576 CA LEU A 117 135.006 6.603 -3.671 1.00 0.00 C ATOM 577 C LEU A 117 135.426 8.028 -3.323 1.00 0.00 C ATOM 578 O LEU A 117 134.937 8.611 -2.354 1.00 0.00 O ATOM 579 CB LEU A 117 135.879 5.603 -2.912 1.00 0.00 C ATOM 580 CG LEU A 117 135.610 5.515 -1.410 1.00 0.00 C ATOM 581 CD1 LEU A 117 134.241 4.908 -1.148 1.00 0.00 C ATOM 582 CD2 LEU A 117 136.696 4.703 -0.721 1.00 0.00 C ATOM 0 H LEU A 117 135.681 5.573 -5.368 1.00 0.00 H new ATOM 0 HA LEU A 117 133.966 6.468 -3.373 1.00 0.00 H new ATOM 0 HB2 LEU A 117 135.736 4.615 -3.349 1.00 0.00 H new ATOM 0 HB3 LEU A 117 136.925 5.870 -3.063 1.00 0.00 H new ATOM 0 HG LEU A 117 135.622 6.524 -0.998 1.00 0.00 H new ATOM 0 HD11 LEU A 117 134.067 4.853 -0.073 1.00 0.00 H new ATOM 0 HD12 LEU A 117 133.473 5.529 -1.609 1.00 0.00 H new ATOM 0 HD13 LEU A 117 134.200 3.905 -1.574 1.00 0.00 H new ATOM 0 HD21 LEU A 117 136.488 4.651 0.348 1.00 0.00 H new ATOM 0 HD22 LEU A 117 136.716 3.695 -1.137 1.00 0.00 H new ATOM 0 HD23 LEU A 117 137.663 5.180 -0.880 1.00 0.00 H new ATOM 594 N LYS A 118 136.335 8.584 -4.119 1.00 0.00 N ATOM 595 CA LYS A 118 136.818 9.941 -3.894 1.00 0.00 C ATOM 596 C LYS A 118 135.680 10.950 -4.004 1.00 0.00 C ATOM 597 O LYS A 118 135.692 11.990 -3.346 1.00 0.00 O ATOM 598 CB LYS A 118 137.922 10.283 -4.899 1.00 0.00 C ATOM 599 CG LYS A 118 139.224 10.724 -4.247 1.00 0.00 C ATOM 600 CD LYS A 118 139.263 12.230 -4.042 1.00 0.00 C ATOM 601 CE LYS A 118 139.552 12.964 -5.342 1.00 0.00 C ATOM 602 NZ LYS A 118 138.344 13.657 -5.868 1.00 0.00 N ATOM 0 H LYS A 118 136.751 8.116 -4.924 1.00 0.00 H new ATOM 0 HA LYS A 118 137.226 9.993 -2.885 1.00 0.00 H new ATOM 0 HB2 LYS A 118 138.115 9.411 -5.524 1.00 0.00 H new ATOM 0 HB3 LYS A 118 137.569 11.076 -5.558 1.00 0.00 H new ATOM 0 HG2 LYS A 118 139.339 10.222 -3.286 1.00 0.00 H new ATOM 0 HG3 LYS A 118 140.065 10.419 -4.869 1.00 0.00 H new ATOM 0 HD2 LYS A 118 138.309 12.568 -3.637 1.00 0.00 H new ATOM 0 HD3 LYS A 118 140.027 12.478 -3.306 1.00 0.00 H new ATOM 0 HE2 LYS A 118 140.346 13.692 -5.179 1.00 0.00 H new ATOM 0 HE3 LYS A 118 139.917 12.256 -6.086 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 138.288 13.523 -6.898 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 137.493 13.260 -5.421 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 138.405 14.673 -5.653 1.00 0.00 H new ATOM 616 N ILE A 119 134.695 10.636 -4.841 1.00 0.00 N ATOM 617 CA ILE A 119 133.549 11.515 -5.036 1.00 0.00 C ATOM 618 C ILE A 119 132.607 11.465 -3.836 1.00 0.00 C ATOM 619 O ILE A 119 132.024 12.478 -3.451 1.00 0.00 O ATOM 620 CB ILE A 119 132.763 11.138 -6.308 1.00 0.00 C ATOM 621 CG1 ILE A 119 133.710 11.014 -7.503 1.00 0.00 C ATOM 622 CG2 ILE A 119 131.682 12.173 -6.589 1.00 0.00 C ATOM 623 CD1 ILE A 119 133.139 10.199 -8.644 1.00 0.00 C ATOM 0 H ILE A 119 134.669 9.779 -5.394 1.00 0.00 H new ATOM 0 HA ILE A 119 133.940 12.526 -5.145 1.00 0.00 H new ATOM 0 HB ILE A 119 132.283 10.173 -6.147 1.00 0.00 H new ATOM 0 HG12 ILE A 119 133.956 12.012 -7.867 1.00 0.00 H new ATOM 0 HG13 ILE A 119 134.642 10.557 -7.172 1.00 0.00 H new ATOM 0 HG21 ILE A 119 131.136 11.893 -7.490 1.00 0.00 H new ATOM 0 HG22 ILE A 119 130.993 12.217 -5.746 1.00 0.00 H new ATOM 0 HG23 ILE A 119 132.143 13.150 -6.733 1.00 0.00 H new ATOM 0 HD11 ILE A 119 133.864 10.153 -9.457 1.00 0.00 H new ATOM 0 HD12 ILE A 119 132.919 9.190 -8.296 1.00 0.00 H new ATOM 0 HD13 ILE A 119 132.222 10.667 -9.002 1.00 0.00 H new ATOM 635 N MET A 120 132.465 10.281 -3.249 1.00 0.00 N ATOM 636 CA MET A 120 131.595 10.101 -2.095 1.00 0.00 C ATOM 637 C MET A 120 132.067 10.953 -0.920 1.00 0.00 C ATOM 638 O MET A 120 131.257 11.523 -0.188 1.00 0.00 O ATOM 639 CB MET A 120 131.552 8.628 -1.686 1.00 0.00 C ATOM 640 CG MET A 120 130.238 8.212 -1.045 1.00 0.00 C ATOM 641 SD MET A 120 129.975 8.985 0.563 1.00 0.00 S ATOM 642 CE MET A 120 131.520 8.596 1.381 1.00 0.00 C ATOM 0 H MET A 120 132.942 9.433 -3.554 1.00 0.00 H new ATOM 0 HA MET A 120 130.592 10.422 -2.375 1.00 0.00 H new ATOM 0 HB2 MET A 120 131.729 8.010 -2.566 1.00 0.00 H new ATOM 0 HB3 MET A 120 132.366 8.429 -0.988 1.00 0.00 H new ATOM 0 HG2 MET A 120 129.415 8.475 -1.709 1.00 0.00 H new ATOM 0 HG3 MET A 120 130.221 7.128 -0.930 1.00 0.00 H new ATOM 0 HE1 MET A 120 131.318 8.246 2.393 1.00 0.00 H new ATOM 0 HE2 MET A 120 132.040 7.816 0.825 1.00 0.00 H new ATOM 0 HE3 MET A 120 132.144 9.489 1.424 1.00 0.00 H new ATOM 652 N LEU A 121 133.382 11.033 -0.745 1.00 0.00 N ATOM 653 CA LEU A 121 133.962 11.815 0.340 1.00 0.00 C ATOM 654 C LEU A 121 133.832 13.310 0.068 1.00 0.00 C ATOM 655 O LEU A 121 133.737 14.113 0.996 1.00 0.00 O ATOM 656 CB LEU A 121 135.434 11.447 0.533 1.00 0.00 C ATOM 657 CG LEU A 121 135.688 10.261 1.465 1.00 0.00 C ATOM 658 CD1 LEU A 121 135.163 10.556 2.862 1.00 0.00 C ATOM 659 CD2 LEU A 121 135.047 8.999 0.908 1.00 0.00 C ATOM 0 H LEU A 121 134.066 10.566 -1.341 1.00 0.00 H new ATOM 0 HA LEU A 121 133.413 11.582 1.252 1.00 0.00 H new ATOM 0 HB2 LEU A 121 135.868 11.223 -0.442 1.00 0.00 H new ATOM 0 HB3 LEU A 121 135.962 12.317 0.924 1.00 0.00 H new ATOM 0 HG LEU A 121 136.764 10.100 1.531 1.00 0.00 H new ATOM 0 HD11 LEU A 121 135.353 9.701 3.510 1.00 0.00 H new ATOM 0 HD12 LEU A 121 135.669 11.434 3.263 1.00 0.00 H new ATOM 0 HD13 LEU A 121 134.090 10.745 2.815 1.00 0.00 H new ATOM 0 HD21 LEU A 121 135.238 8.165 1.584 1.00 0.00 H new ATOM 0 HD22 LEU A 121 133.972 9.149 0.811 1.00 0.00 H new ATOM 0 HD23 LEU A 121 135.472 8.777 -0.071 1.00 0.00 H new ATOM 671 N GLN A 122 133.824 13.677 -1.211 1.00 0.00 N ATOM 672 CA GLN A 122 133.700 15.076 -1.600 1.00 0.00 C ATOM 673 C GLN A 122 132.381 15.662 -1.109 1.00 0.00 C ATOM 674 O GLN A 122 132.264 16.871 -0.905 1.00 0.00 O ATOM 675 CB GLN A 122 133.801 15.215 -3.119 1.00 0.00 C ATOM 676 CG GLN A 122 135.227 15.370 -3.623 1.00 0.00 C ATOM 677 CD GLN A 122 135.694 16.812 -3.616 1.00 0.00 C ATOM 678 OE1 GLN A 122 135.377 17.584 -4.521 1.00 0.00 O ATOM 679 NE2 GLN A 122 136.451 17.184 -2.590 1.00 0.00 N ATOM 0 H GLN A 122 133.902 13.026 -1.992 1.00 0.00 H new ATOM 0 HA GLN A 122 134.517 15.630 -1.137 1.00 0.00 H new ATOM 0 HB2 GLN A 122 133.353 14.338 -3.586 1.00 0.00 H new ATOM 0 HB3 GLN A 122 133.217 16.079 -3.436 1.00 0.00 H new ATOM 0 HG2 GLN A 122 135.895 14.773 -3.002 1.00 0.00 H new ATOM 0 HG3 GLN A 122 135.295 14.975 -4.637 1.00 0.00 H new ATOM 0 HE21 GLN A 122 136.690 16.511 -1.862 1.00 0.00 H new ATOM 0 HE22 GLN A 122 136.794 18.143 -2.530 1.00 0.00 H new ATOM 688 N ALA A 123 131.388 14.797 -0.916 1.00 0.00 N ATOM 689 CA ALA A 123 130.077 15.230 -0.446 1.00 0.00 C ATOM 690 C ALA A 123 130.188 15.978 0.877 1.00 0.00 C ATOM 691 O ALA A 123 129.596 17.043 1.050 1.00 0.00 O ATOM 692 CB ALA A 123 129.148 14.034 -0.303 1.00 0.00 C ATOM 0 H ALA A 123 131.467 13.793 -1.078 1.00 0.00 H new ATOM 0 HA ALA A 123 129.660 15.914 -1.185 1.00 0.00 H new ATOM 0 HB1 ALA A 123 128.173 14.371 0.049 1.00 0.00 H new ATOM 0 HB2 ALA A 123 129.036 13.543 -1.270 1.00 0.00 H new ATOM 0 HB3 ALA A 123 129.569 13.330 0.415 1.00 0.00 H new ATOM 698 N THR A 124 130.955 15.418 1.806 1.00 0.00 N ATOM 699 CA THR A 124 131.146 16.038 3.112 1.00 0.00 C ATOM 700 C THR A 124 131.885 17.364 2.974 1.00 0.00 C ATOM 701 O THR A 124 132.311 17.735 1.880 1.00 0.00 O ATOM 702 CB THR A 124 131.923 15.100 4.038 1.00 0.00 C ATOM 703 OG1 THR A 124 133.295 15.077 3.691 1.00 0.00 O ATOM 704 CG2 THR A 124 131.416 13.675 4.008 1.00 0.00 C ATOM 0 H THR A 124 131.454 14.537 1.679 1.00 0.00 H new ATOM 0 HA THR A 124 130.165 16.230 3.546 1.00 0.00 H new ATOM 0 HB THR A 124 131.777 15.498 5.042 1.00 0.00 H new ATOM 0 HG1 THR A 124 133.395 14.744 2.775 1.00 0.00 H new ATOM 0 HG21 THR A 124 132.010 13.063 4.687 1.00 0.00 H new ATOM 0 HG22 THR A 124 130.372 13.654 4.320 1.00 0.00 H new ATOM 0 HG23 THR A 124 131.500 13.280 2.995 1.00 0.00 H new ATOM 712 N GLY A 125 132.036 18.076 4.086 1.00 0.00 N ATOM 713 CA GLY A 125 132.727 19.353 4.059 1.00 0.00 C ATOM 714 C GLY A 125 134.027 19.324 4.841 1.00 0.00 C ATOM 715 O GLY A 125 134.476 20.350 5.349 1.00 0.00 O ATOM 0 H GLY A 125 131.693 17.793 5.004 1.00 0.00 H new ATOM 0 HA2 GLY A 125 132.934 19.629 3.025 1.00 0.00 H new ATOM 0 HA3 GLY A 125 132.076 20.124 4.470 1.00 0.00 H new ATOM 719 N GLU A 126 134.630 18.143 4.936 1.00 0.00 N ATOM 720 CA GLU A 126 135.885 17.981 5.660 1.00 0.00 C ATOM 721 C GLU A 126 137.064 17.921 4.695 1.00 0.00 C ATOM 722 O GLU A 126 136.902 18.117 3.490 1.00 0.00 O ATOM 723 CB GLU A 126 135.842 16.715 6.516 1.00 0.00 C ATOM 724 CG GLU A 126 134.716 16.708 7.538 1.00 0.00 C ATOM 725 CD GLU A 126 135.134 16.099 8.862 1.00 0.00 C ATOM 726 OE1 GLU A 126 136.017 16.677 9.529 1.00 0.00 O ATOM 727 OE2 GLU A 126 134.576 15.044 9.232 1.00 0.00 O ATOM 0 H GLU A 126 134.269 17.284 4.520 1.00 0.00 H new ATOM 0 HA GLU A 126 136.017 18.845 6.311 1.00 0.00 H new ATOM 0 HB2 GLU A 126 135.734 15.849 5.863 1.00 0.00 H new ATOM 0 HB3 GLU A 126 136.794 16.606 7.036 1.00 0.00 H new ATOM 0 HG2 GLU A 126 134.375 17.730 7.704 1.00 0.00 H new ATOM 0 HG3 GLU A 126 133.870 16.150 7.137 1.00 0.00 H new ATOM 734 N THR A 127 138.250 17.645 5.228 1.00 0.00 N ATOM 735 CA THR A 127 139.455 17.558 4.413 1.00 0.00 C ATOM 736 C THR A 127 140.079 16.170 4.513 1.00 0.00 C ATOM 737 O THR A 127 140.643 15.807 5.544 1.00 0.00 O ATOM 738 CB THR A 127 140.469 18.617 4.848 1.00 0.00 C ATOM 739 OG1 THR A 127 140.691 18.553 6.245 1.00 0.00 O ATOM 740 CG2 THR A 127 140.040 20.030 4.517 1.00 0.00 C ATOM 0 H THR A 127 138.402 17.478 6.223 1.00 0.00 H new ATOM 0 HA THR A 127 139.175 17.738 3.375 1.00 0.00 H new ATOM 0 HB THR A 127 141.378 18.391 4.291 1.00 0.00 H new ATOM 0 HG1 THR A 127 140.739 17.615 6.526 1.00 0.00 H new ATOM 0 HG21 THR A 127 140.805 20.730 4.853 1.00 0.00 H new ATOM 0 HG22 THR A 127 139.907 20.127 3.439 1.00 0.00 H new ATOM 0 HG23 THR A 127 139.099 20.252 5.020 1.00 0.00 H new ATOM 748 N ILE A 128 139.973 15.397 3.438 1.00 0.00 N ATOM 749 CA ILE A 128 140.528 14.049 3.408 1.00 0.00 C ATOM 750 C ILE A 128 141.696 13.958 2.432 1.00 0.00 C ATOM 751 O ILE A 128 141.682 14.584 1.373 1.00 0.00 O ATOM 752 CB ILE A 128 139.460 13.009 3.011 1.00 0.00 C ATOM 753 CG1 ILE A 128 138.160 13.259 3.780 1.00 0.00 C ATOM 754 CG2 ILE A 128 139.970 11.599 3.269 1.00 0.00 C ATOM 755 CD1 ILE A 128 137.144 14.069 3.004 1.00 0.00 C ATOM 0 H ILE A 128 139.508 15.681 2.576 1.00 0.00 H new ATOM 0 HA ILE A 128 140.881 13.830 4.416 1.00 0.00 H new ATOM 0 HB ILE A 128 139.255 13.111 1.945 1.00 0.00 H new ATOM 0 HG12 ILE A 128 137.718 12.300 4.051 1.00 0.00 H new ATOM 0 HG13 ILE A 128 138.392 13.777 4.710 1.00 0.00 H new ATOM 0 HG21 ILE A 128 139.205 10.877 2.984 1.00 0.00 H new ATOM 0 HG22 ILE A 128 140.871 11.424 2.680 1.00 0.00 H new ATOM 0 HG23 ILE A 128 140.201 11.484 4.328 1.00 0.00 H new ATOM 0 HD11 ILE A 128 136.249 14.207 3.610 1.00 0.00 H new ATOM 0 HD12 ILE A 128 137.568 15.042 2.756 1.00 0.00 H new ATOM 0 HD13 ILE A 128 136.883 13.542 2.086 1.00 0.00 H new ATOM 767 N THR A 129 142.706 13.173 2.796 1.00 0.00 N ATOM 768 CA THR A 129 143.880 13.000 1.950 1.00 0.00 C ATOM 769 C THR A 129 143.702 11.816 1.007 1.00 0.00 C ATOM 770 O THR A 129 142.929 10.900 1.284 1.00 0.00 O ATOM 771 CB THR A 129 145.128 12.798 2.812 1.00 0.00 C ATOM 772 OG1 THR A 129 145.020 11.614 3.581 1.00 0.00 O ATOM 773 CG2 THR A 129 145.387 13.943 3.767 1.00 0.00 C ATOM 0 H THR A 129 142.734 12.648 3.670 1.00 0.00 H new ATOM 0 HA THR A 129 144.002 13.902 1.350 1.00 0.00 H new ATOM 0 HB THR A 129 145.958 12.738 2.108 1.00 0.00 H new ATOM 0 HG1 THR A 129 145.329 11.788 4.495 1.00 0.00 H new ATOM 0 HG21 THR A 129 146.286 13.736 4.348 1.00 0.00 H new ATOM 0 HG22 THR A 129 145.524 14.865 3.201 1.00 0.00 H new ATOM 0 HG23 THR A 129 144.537 14.054 4.441 1.00 0.00 H new ATOM 781 N GLU A 130 144.424 11.839 -0.108 1.00 0.00 N ATOM 782 CA GLU A 130 144.346 10.767 -1.093 1.00 0.00 C ATOM 783 C GLU A 130 144.902 9.466 -0.523 1.00 0.00 C ATOM 784 O GLU A 130 144.469 8.376 -0.900 1.00 0.00 O ATOM 785 CB GLU A 130 145.111 11.151 -2.360 1.00 0.00 C ATOM 786 CG GLU A 130 144.472 12.294 -3.133 1.00 0.00 C ATOM 787 CD GLU A 130 144.802 12.250 -4.614 1.00 0.00 C ATOM 788 OE1 GLU A 130 145.973 11.979 -4.954 1.00 0.00 O ATOM 789 OE2 GLU A 130 143.889 12.488 -5.432 1.00 0.00 O ATOM 0 H GLU A 130 145.070 12.589 -0.352 1.00 0.00 H new ATOM 0 HA GLU A 130 143.297 10.614 -1.345 1.00 0.00 H new ATOM 0 HB2 GLU A 130 146.129 11.431 -2.089 1.00 0.00 H new ATOM 0 HB3 GLU A 130 145.182 10.279 -3.010 1.00 0.00 H new ATOM 0 HG2 GLU A 130 143.390 12.256 -3.004 1.00 0.00 H new ATOM 0 HG3 GLU A 130 144.809 13.243 -2.717 1.00 0.00 H new ATOM 796 N ASP A 131 145.865 9.587 0.386 1.00 0.00 N ATOM 797 CA ASP A 131 146.481 8.421 1.007 1.00 0.00 C ATOM 798 C ASP A 131 145.553 7.804 2.050 1.00 0.00 C ATOM 799 O ASP A 131 145.560 6.592 2.263 1.00 0.00 O ATOM 800 CB ASP A 131 147.812 8.807 1.656 1.00 0.00 C ATOM 801 CG ASP A 131 149.002 8.465 0.781 1.00 0.00 C ATOM 802 OD1 ASP A 131 149.263 9.213 -0.186 1.00 0.00 O ATOM 803 OD2 ASP A 131 149.673 7.449 1.062 1.00 0.00 O ATOM 0 H ASP A 131 146.235 10.481 0.708 1.00 0.00 H new ATOM 0 HA ASP A 131 146.665 7.681 0.228 1.00 0.00 H new ATOM 0 HB2 ASP A 131 147.814 9.877 1.866 1.00 0.00 H new ATOM 0 HB3 ASP A 131 147.909 8.294 2.613 1.00 0.00 H new ATOM 808 N ASP A 132 144.755 8.648 2.696 1.00 0.00 N ATOM 809 CA ASP A 132 143.822 8.186 3.717 1.00 0.00 C ATOM 810 C ASP A 132 142.705 7.353 3.097 1.00 0.00 C ATOM 811 O ASP A 132 142.216 6.400 3.703 1.00 0.00 O ATOM 812 CB ASP A 132 143.228 9.376 4.473 1.00 0.00 C ATOM 813 CG ASP A 132 144.022 9.728 5.714 1.00 0.00 C ATOM 814 OD1 ASP A 132 145.214 10.071 5.580 1.00 0.00 O ATOM 815 OD2 ASP A 132 143.450 9.658 6.824 1.00 0.00 O ATOM 0 H ASP A 132 144.736 9.654 2.531 1.00 0.00 H new ATOM 0 HA ASP A 132 144.372 7.558 4.418 1.00 0.00 H new ATOM 0 HB2 ASP A 132 143.191 10.241 3.811 1.00 0.00 H new ATOM 0 HB3 ASP A 132 142.200 9.147 4.756 1.00 0.00 H new ATOM 820 N ILE A 133 142.306 7.720 1.884 1.00 0.00 N ATOM 821 CA ILE A 133 141.247 7.007 1.180 1.00 0.00 C ATOM 822 C ILE A 133 141.726 5.638 0.699 1.00 0.00 C ATOM 823 O ILE A 133 140.919 4.749 0.431 1.00 0.00 O ATOM 824 CB ILE A 133 140.734 7.813 -0.029 1.00 0.00 C ATOM 825 CG1 ILE A 133 140.390 9.244 0.392 1.00 0.00 C ATOM 826 CG2 ILE A 133 139.520 7.132 -0.646 1.00 0.00 C ATOM 827 CD1 ILE A 133 140.395 10.230 -0.756 1.00 0.00 C ATOM 0 H ILE A 133 142.700 8.507 1.368 1.00 0.00 H new ATOM 0 HA ILE A 133 140.432 6.873 1.891 1.00 0.00 H new ATOM 0 HB ILE A 133 141.524 7.854 -0.779 1.00 0.00 H new ATOM 0 HG12 ILE A 133 139.406 9.250 0.861 1.00 0.00 H new ATOM 0 HG13 ILE A 133 141.104 9.574 1.147 1.00 0.00 H new ATOM 0 HG21 ILE A 133 139.170 7.714 -1.499 1.00 0.00 H new ATOM 0 HG22 ILE A 133 139.794 6.131 -0.978 1.00 0.00 H new ATOM 0 HG23 ILE A 133 138.725 7.063 0.097 1.00 0.00 H new ATOM 0 HD11 ILE A 133 140.143 11.223 -0.384 1.00 0.00 H new ATOM 0 HD12 ILE A 133 141.385 10.254 -1.211 1.00 0.00 H new ATOM 0 HD13 ILE A 133 139.661 9.925 -1.501 1.00 0.00 H new ATOM 839 N GLU A 134 143.043 5.476 0.595 1.00 0.00 N ATOM 840 CA GLU A 134 143.624 4.215 0.149 1.00 0.00 C ATOM 841 C GLU A 134 143.397 3.114 1.183 1.00 0.00 C ATOM 842 O GLU A 134 143.317 1.935 0.840 1.00 0.00 O ATOM 843 CB GLU A 134 145.121 4.385 -0.113 1.00 0.00 C ATOM 844 CG GLU A 134 145.446 4.792 -1.541 1.00 0.00 C ATOM 845 CD GLU A 134 146.932 4.754 -1.836 1.00 0.00 C ATOM 846 OE1 GLU A 134 147.562 3.707 -1.573 1.00 0.00 O ATOM 847 OE2 GLU A 134 147.467 5.769 -2.330 1.00 0.00 O ATOM 0 H GLU A 134 143.726 6.202 0.813 1.00 0.00 H new ATOM 0 HA GLU A 134 143.131 3.924 -0.778 1.00 0.00 H new ATOM 0 HB2 GLU A 134 145.518 5.137 0.569 1.00 0.00 H new ATOM 0 HB3 GLU A 134 145.630 3.448 0.114 1.00 0.00 H new ATOM 0 HG2 GLU A 134 144.926 4.128 -2.231 1.00 0.00 H new ATOM 0 HG3 GLU A 134 145.069 5.799 -1.722 1.00 0.00 H new ATOM 854 N GLU A 135 143.294 3.509 2.449 1.00 0.00 N ATOM 855 CA GLU A 135 143.077 2.554 3.531 1.00 0.00 C ATOM 856 C GLU A 135 141.643 2.029 3.520 1.00 0.00 C ATOM 857 O GLU A 135 141.375 0.923 3.988 1.00 0.00 O ATOM 858 CB GLU A 135 143.383 3.204 4.882 1.00 0.00 C ATOM 859 CG GLU A 135 144.764 2.867 5.421 1.00 0.00 C ATOM 860 CD GLU A 135 144.764 1.618 6.282 1.00 0.00 C ATOM 861 OE1 GLU A 135 144.050 1.603 7.307 1.00 0.00 O ATOM 862 OE2 GLU A 135 145.477 0.655 5.932 1.00 0.00 O ATOM 0 H GLU A 135 143.357 4.481 2.750 1.00 0.00 H new ATOM 0 HA GLU A 135 143.753 1.712 3.377 1.00 0.00 H new ATOM 0 HB2 GLU A 135 143.295 4.286 4.783 1.00 0.00 H new ATOM 0 HB3 GLU A 135 142.632 2.888 5.606 1.00 0.00 H new ATOM 0 HG2 GLU A 135 145.452 2.729 4.587 1.00 0.00 H new ATOM 0 HG3 GLU A 135 145.137 3.708 6.006 1.00 0.00 H new ATOM 869 N LEU A 136 140.727 2.828 2.983 1.00 0.00 N ATOM 870 CA LEU A 136 139.323 2.439 2.914 1.00 0.00 C ATOM 871 C LEU A 136 139.152 1.165 2.091 1.00 0.00 C ATOM 872 O LEU A 136 138.449 0.241 2.498 1.00 0.00 O ATOM 873 CB LEU A 136 138.490 3.571 2.308 1.00 0.00 C ATOM 874 CG LEU A 136 137.878 4.536 3.325 1.00 0.00 C ATOM 875 CD1 LEU A 136 137.843 5.950 2.766 1.00 0.00 C ATOM 876 CD2 LEU A 136 136.481 4.080 3.717 1.00 0.00 C ATOM 0 H LEU A 136 140.931 3.747 2.590 1.00 0.00 H new ATOM 0 HA LEU A 136 138.973 2.243 3.928 1.00 0.00 H new ATOM 0 HB2 LEU A 136 139.119 4.139 1.623 1.00 0.00 H new ATOM 0 HB3 LEU A 136 137.687 3.134 1.715 1.00 0.00 H new ATOM 0 HG LEU A 136 138.502 4.537 4.218 1.00 0.00 H new ATOM 0 HD11 LEU A 136 137.404 6.622 3.504 1.00 0.00 H new ATOM 0 HD12 LEU A 136 138.858 6.276 2.536 1.00 0.00 H new ATOM 0 HD13 LEU A 136 137.242 5.967 1.857 1.00 0.00 H new ATOM 0 HD21 LEU A 136 136.060 4.778 4.441 1.00 0.00 H new ATOM 0 HD22 LEU A 136 135.846 4.050 2.831 1.00 0.00 H new ATOM 0 HD23 LEU A 136 136.534 3.085 4.160 1.00 0.00 H new ATOM 888 N MET A 137 139.801 1.125 0.932 1.00 0.00 N ATOM 889 CA MET A 137 139.722 -0.034 0.050 1.00 0.00 C ATOM 890 C MET A 137 140.472 -1.225 0.642 1.00 0.00 C ATOM 891 O MET A 137 140.132 -2.377 0.377 1.00 0.00 O ATOM 892 CB MET A 137 140.291 0.310 -1.328 1.00 0.00 C ATOM 893 CG MET A 137 139.421 -0.162 -2.482 1.00 0.00 C ATOM 894 SD MET A 137 138.917 1.182 -3.573 1.00 0.00 S ATOM 895 CE MET A 137 137.134 1.037 -3.490 1.00 0.00 C ATOM 0 H MET A 137 140.388 1.882 0.581 1.00 0.00 H new ATOM 0 HA MET A 137 138.672 -0.308 -0.055 1.00 0.00 H new ATOM 0 HB2 MET A 137 140.420 1.390 -1.399 1.00 0.00 H new ATOM 0 HB3 MET A 137 141.281 -0.136 -1.425 1.00 0.00 H new ATOM 0 HG2 MET A 137 139.966 -0.908 -3.060 1.00 0.00 H new ATOM 0 HG3 MET A 137 138.533 -0.653 -2.084 1.00 0.00 H new ATOM 0 HE1 MET A 137 136.676 1.936 -3.903 1.00 0.00 H new ATOM 0 HE2 MET A 137 136.812 0.169 -4.065 1.00 0.00 H new ATOM 0 HE3 MET A 137 136.827 0.918 -2.451 1.00 0.00 H new ATOM 905 N LYS A 138 141.498 -0.936 1.439 1.00 0.00 N ATOM 906 CA LYS A 138 142.300 -1.985 2.064 1.00 0.00 C ATOM 907 C LYS A 138 141.420 -2.965 2.836 1.00 0.00 C ATOM 908 O LYS A 138 141.305 -4.134 2.466 1.00 0.00 O ATOM 909 CB LYS A 138 143.342 -1.367 2.999 1.00 0.00 C ATOM 910 CG LYS A 138 144.737 -1.304 2.399 1.00 0.00 C ATOM 911 CD LYS A 138 145.304 -2.694 2.153 1.00 0.00 C ATOM 912 CE LYS A 138 146.711 -2.831 2.712 1.00 0.00 C ATOM 913 NZ LYS A 138 146.707 -3.378 4.097 1.00 0.00 N ATOM 0 H LYS A 138 141.793 0.013 1.667 1.00 0.00 H new ATOM 0 HA LYS A 138 142.810 -2.536 1.274 1.00 0.00 H new ATOM 0 HB2 LYS A 138 143.025 -0.359 3.267 1.00 0.00 H new ATOM 0 HB3 LYS A 138 143.378 -1.946 3.922 1.00 0.00 H new ATOM 0 HG2 LYS A 138 144.705 -0.752 1.460 1.00 0.00 H new ATOM 0 HG3 LYS A 138 145.398 -0.754 3.069 1.00 0.00 H new ATOM 0 HD2 LYS A 138 144.655 -3.439 2.613 1.00 0.00 H new ATOM 0 HD3 LYS A 138 145.316 -2.899 1.082 1.00 0.00 H new ATOM 0 HE2 LYS A 138 147.297 -3.484 2.065 1.00 0.00 H new ATOM 0 HE3 LYS A 138 147.200 -1.857 2.708 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 147.685 -3.456 4.442 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 146.170 -2.742 4.720 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 146.264 -4.319 4.097 1.00 0.00 H new ATOM 927 N ASP A 139 140.804 -2.485 3.912 1.00 0.00 N ATOM 928 CA ASP A 139 139.940 -3.324 4.734 1.00 0.00 C ATOM 929 C ASP A 139 138.670 -3.716 3.984 1.00 0.00 C ATOM 930 O ASP A 139 138.151 -4.818 4.161 1.00 0.00 O ATOM 931 CB ASP A 139 139.601 -2.613 6.050 1.00 0.00 C ATOM 932 CG ASP A 139 138.630 -1.459 5.872 1.00 0.00 C ATOM 933 OD1 ASP A 139 138.561 -0.907 4.754 1.00 0.00 O ATOM 934 OD2 ASP A 139 137.948 -1.102 6.856 1.00 0.00 O ATOM 0 H ASP A 139 140.887 -1.521 4.234 1.00 0.00 H new ATOM 0 HA ASP A 139 140.481 -4.242 4.965 1.00 0.00 H new ATOM 0 HB2 ASP A 139 139.174 -3.335 6.746 1.00 0.00 H new ATOM 0 HB3 ASP A 139 140.520 -2.240 6.501 1.00 0.00 H new ATOM 939 N GLY A 140 138.174 -2.814 3.143 1.00 0.00 N ATOM 940 CA GLY A 140 136.974 -3.097 2.380 1.00 0.00 C ATOM 941 C GLY A 140 137.190 -4.199 1.362 1.00 0.00 C ATOM 942 O GLY A 140 136.302 -5.018 1.123 1.00 0.00 O ATOM 0 H GLY A 140 138.581 -1.894 2.977 1.00 0.00 H new ATOM 0 HA2 GLY A 140 136.172 -3.385 3.060 1.00 0.00 H new ATOM 0 HA3 GLY A 140 136.648 -2.191 1.869 1.00 0.00 H new ATOM 946 N ASP A 141 138.377 -4.219 0.766 1.00 0.00 N ATOM 947 CA ASP A 141 138.718 -5.226 -0.233 1.00 0.00 C ATOM 948 C ASP A 141 138.964 -6.579 0.422 1.00 0.00 C ATOM 949 O ASP A 141 139.710 -6.685 1.395 1.00 0.00 O ATOM 950 CB ASP A 141 139.954 -4.795 -1.024 1.00 0.00 C ATOM 951 CG ASP A 141 140.201 -5.672 -2.236 1.00 0.00 C ATOM 952 OD1 ASP A 141 139.542 -6.726 -2.351 1.00 0.00 O ATOM 953 OD2 ASP A 141 141.054 -5.304 -3.070 1.00 0.00 O ATOM 0 H ASP A 141 139.121 -3.548 0.958 1.00 0.00 H new ATOM 0 HA ASP A 141 137.875 -5.322 -0.917 1.00 0.00 H new ATOM 0 HB2 ASP A 141 139.833 -3.761 -1.346 1.00 0.00 H new ATOM 0 HB3 ASP A 141 140.828 -4.826 -0.373 1.00 0.00 H new ATOM 958 N LYS A 142 138.325 -7.611 -0.117 1.00 0.00 N ATOM 959 CA LYS A 142 138.468 -8.961 0.414 1.00 0.00 C ATOM 960 C LYS A 142 139.218 -9.860 -0.566 1.00 0.00 C ATOM 961 O LYS A 142 139.831 -10.851 -0.168 1.00 0.00 O ATOM 962 CB LYS A 142 137.090 -9.552 0.722 1.00 0.00 C ATOM 963 CG LYS A 142 136.644 -9.346 2.160 1.00 0.00 C ATOM 964 CD LYS A 142 136.756 -7.889 2.587 1.00 0.00 C ATOM 965 CE LYS A 142 137.871 -7.687 3.602 1.00 0.00 C ATOM 966 NZ LYS A 142 137.338 -7.416 4.965 1.00 0.00 N ATOM 0 H LYS A 142 137.703 -7.538 -0.922 1.00 0.00 H new ATOM 0 HA LYS A 142 139.048 -8.905 1.335 1.00 0.00 H new ATOM 0 HB2 LYS A 142 136.354 -9.102 0.055 1.00 0.00 H new ATOM 0 HB3 LYS A 142 137.106 -10.620 0.505 1.00 0.00 H new ATOM 0 HG2 LYS A 142 135.612 -9.678 2.271 1.00 0.00 H new ATOM 0 HG3 LYS A 142 137.251 -9.965 2.820 1.00 0.00 H new ATOM 0 HD2 LYS A 142 136.942 -7.266 1.712 1.00 0.00 H new ATOM 0 HD3 LYS A 142 135.809 -7.561 3.016 1.00 0.00 H new ATOM 0 HE2 LYS A 142 138.503 -8.575 3.629 1.00 0.00 H new ATOM 0 HE3 LYS A 142 138.502 -6.856 3.287 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 137.915 -7.918 5.670 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 137.372 -6.394 5.154 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 136.354 -7.746 5.025 1.00 0.00 H new ATOM 980 N ASN A 143 139.169 -9.509 -1.848 1.00 0.00 N ATOM 981 CA ASN A 143 139.849 -10.285 -2.879 1.00 0.00 C ATOM 982 C ASN A 143 141.104 -9.568 -3.375 1.00 0.00 C ATOM 983 O ASN A 143 141.755 -10.022 -4.316 1.00 0.00 O ATOM 984 CB ASN A 143 138.903 -10.550 -4.052 1.00 0.00 C ATOM 985 CG ASN A 143 138.251 -9.280 -4.568 1.00 0.00 C ATOM 986 OD1 ASN A 143 138.339 -8.225 -3.941 1.00 0.00 O ATOM 987 ND2 ASN A 143 137.593 -9.379 -5.717 1.00 0.00 N ATOM 0 H ASN A 143 138.666 -8.693 -2.197 1.00 0.00 H new ATOM 0 HA ASN A 143 140.151 -11.235 -2.438 1.00 0.00 H new ATOM 0 HB2 ASN A 143 139.457 -11.026 -4.861 1.00 0.00 H new ATOM 0 HB3 ASN A 143 138.129 -11.251 -3.740 1.00 0.00 H new ATOM 0 HD21 ASN A 143 137.134 -8.559 -6.114 1.00 0.00 H new ATOM 0 HD22 ASN A 143 137.546 -10.275 -6.202 1.00 0.00 H new ATOM 994 N ASN A 144 141.442 -8.447 -2.738 1.00 0.00 N ATOM 995 CA ASN A 144 142.619 -7.677 -3.119 1.00 0.00 C ATOM 996 C ASN A 144 142.538 -7.235 -4.576 1.00 0.00 C ATOM 997 O ASN A 144 143.561 -7.069 -5.241 1.00 0.00 O ATOM 998 CB ASN A 144 143.888 -8.501 -2.892 1.00 0.00 C ATOM 999 CG ASN A 144 144.494 -8.262 -1.522 1.00 0.00 C ATOM 1000 OD1 ASN A 144 144.319 -7.198 -0.930 1.00 0.00 O ATOM 1001 ND2 ASN A 144 145.213 -9.256 -1.013 1.00 0.00 N ATOM 0 H ASN A 144 140.916 -8.055 -1.957 1.00 0.00 H new ATOM 0 HA ASN A 144 142.655 -6.785 -2.493 1.00 0.00 H new ATOM 0 HB2 ASN A 144 143.655 -9.560 -3.004 1.00 0.00 H new ATOM 0 HB3 ASN A 144 144.621 -8.253 -3.659 1.00 0.00 H new ATOM 0 HD21 ASN A 144 145.646 -9.154 -0.095 1.00 0.00 H new ATOM 0 HD22 ASN A 144 145.332 -10.121 -1.540 1.00 0.00 H new ATOM 1008 N ASP A 145 141.317 -7.047 -5.069 1.00 0.00 N ATOM 1009 CA ASP A 145 141.106 -6.625 -6.449 1.00 0.00 C ATOM 1010 C ASP A 145 141.197 -5.104 -6.588 1.00 0.00 C ATOM 1011 O ASP A 145 141.050 -4.567 -7.686 1.00 0.00 O ATOM 1012 CB ASP A 145 139.745 -7.113 -6.947 1.00 0.00 C ATOM 1013 CG ASP A 145 138.594 -6.518 -6.158 1.00 0.00 C ATOM 1014 OD1 ASP A 145 138.832 -6.037 -5.031 1.00 0.00 O ATOM 1015 OD2 ASP A 145 137.453 -6.533 -6.670 1.00 0.00 O ATOM 0 H ASP A 145 140.459 -7.180 -4.533 1.00 0.00 H new ATOM 0 HA ASP A 145 141.894 -7.068 -7.058 1.00 0.00 H new ATOM 0 HB2 ASP A 145 139.632 -6.855 -8.000 1.00 0.00 H new ATOM 0 HB3 ASP A 145 139.705 -8.200 -6.880 1.00 0.00 H new ATOM 1020 N GLY A 146 141.438 -4.416 -5.474 1.00 0.00 N ATOM 1021 CA GLY A 146 141.541 -2.969 -5.508 1.00 0.00 C ATOM 1022 C GLY A 146 140.198 -2.291 -5.706 1.00 0.00 C ATOM 1023 O GLY A 146 140.131 -1.162 -6.189 1.00 0.00 O ATOM 0 H GLY A 146 141.563 -4.834 -4.552 1.00 0.00 H new ATOM 0 HA2 GLY A 146 141.987 -2.619 -4.577 1.00 0.00 H new ATOM 0 HA3 GLY A 146 142.214 -2.676 -6.314 1.00 0.00 H new ATOM 1027 N ARG A 147 139.125 -2.984 -5.332 1.00 0.00 N ATOM 1028 CA ARG A 147 137.779 -2.442 -5.472 1.00 0.00 C ATOM 1029 C ARG A 147 136.839 -3.049 -4.436 1.00 0.00 C ATOM 1030 O ARG A 147 137.280 -3.722 -3.503 1.00 0.00 O ATOM 1031 CB ARG A 147 137.242 -2.705 -6.881 1.00 0.00 C ATOM 1032 CG ARG A 147 138.230 -2.359 -7.983 1.00 0.00 C ATOM 1033 CD ARG A 147 137.577 -2.408 -9.354 1.00 0.00 C ATOM 1034 NE ARG A 147 138.460 -2.991 -10.361 1.00 0.00 N ATOM 1035 CZ ARG A 147 138.305 -2.821 -11.672 1.00 0.00 C ATOM 1036 NH1 ARG A 147 137.303 -2.088 -12.141 1.00 0.00 N ATOM 1037 NH2 ARG A 147 139.156 -3.387 -12.517 1.00 0.00 N ATOM 0 H ARG A 147 139.163 -3.921 -4.930 1.00 0.00 H new ATOM 0 HA ARG A 147 137.829 -1.366 -5.306 1.00 0.00 H new ATOM 0 HB2 ARG A 147 136.969 -3.757 -6.966 1.00 0.00 H new ATOM 0 HB3 ARG A 147 136.330 -2.126 -7.027 1.00 0.00 H new ATOM 0 HG2 ARG A 147 138.637 -1.363 -7.808 1.00 0.00 H new ATOM 0 HG3 ARG A 147 139.068 -3.055 -7.953 1.00 0.00 H new ATOM 0 HD2 ARG A 147 136.658 -2.991 -9.297 1.00 0.00 H new ATOM 0 HD3 ARG A 147 137.297 -1.400 -9.658 1.00 0.00 H new ATOM 0 HE ARG A 147 139.242 -3.562 -10.040 1.00 0.00 H new ATOM 0 HH11 ARG A 147 136.645 -1.651 -11.496 1.00 0.00 H new ATOM 0 HH12 ARG A 147 137.190 -1.962 -13.147 1.00 0.00 H new ATOM 0 HH21 ARG A 147 139.928 -3.952 -12.162 1.00 0.00 H new ATOM 0 HH22 ARG A 147 139.039 -3.258 -13.522 1.00 0.00 H new ATOM 1051 N ILE A 148 135.543 -2.807 -4.603 1.00 0.00 N ATOM 1052 CA ILE A 148 134.544 -3.333 -3.679 1.00 0.00 C ATOM 1053 C ILE A 148 133.229 -3.624 -4.394 1.00 0.00 C ATOM 1054 O ILE A 148 132.780 -2.842 -5.232 1.00 0.00 O ATOM 1055 CB ILE A 148 134.280 -2.354 -2.518 1.00 0.00 C ATOM 1056 CG1 ILE A 148 135.600 -1.906 -1.888 1.00 0.00 C ATOM 1057 CG2 ILE A 148 133.378 -2.999 -1.475 1.00 0.00 C ATOM 1058 CD1 ILE A 148 135.423 -0.917 -0.756 1.00 0.00 C ATOM 0 H ILE A 148 135.160 -2.251 -5.368 1.00 0.00 H new ATOM 0 HA ILE A 148 134.947 -4.262 -3.276 1.00 0.00 H new ATOM 0 HB ILE A 148 133.773 -1.474 -2.913 1.00 0.00 H new ATOM 0 HG12 ILE A 148 136.131 -2.782 -1.515 1.00 0.00 H new ATOM 0 HG13 ILE A 148 136.227 -1.457 -2.658 1.00 0.00 H new ATOM 0 HG21 ILE A 148 133.201 -2.295 -0.662 1.00 0.00 H new ATOM 0 HG22 ILE A 148 132.427 -3.270 -1.934 1.00 0.00 H new ATOM 0 HG23 ILE A 148 133.859 -3.894 -1.082 1.00 0.00 H new ATOM 0 HD11 ILE A 148 136.399 -0.643 -0.356 1.00 0.00 H new ATOM 0 HD12 ILE A 148 134.920 -0.025 -1.128 1.00 0.00 H new ATOM 0 HD13 ILE A 148 134.822 -1.370 0.033 1.00 0.00 H new ATOM 1070 N ASP A 149 132.615 -4.754 -4.055 1.00 0.00 N ATOM 1071 CA ASP A 149 131.349 -5.146 -4.661 1.00 0.00 C ATOM 1072 C ASP A 149 130.362 -5.620 -3.596 1.00 0.00 C ATOM 1073 O ASP A 149 130.655 -5.580 -2.403 1.00 0.00 O ATOM 1074 CB ASP A 149 131.572 -6.245 -5.702 1.00 0.00 C ATOM 1075 CG ASP A 149 132.296 -7.448 -5.135 1.00 0.00 C ATOM 1076 OD1 ASP A 149 133.476 -7.304 -4.751 1.00 0.00 O ATOM 1077 OD2 ASP A 149 131.685 -8.535 -5.078 1.00 0.00 O ATOM 0 H ASP A 149 132.974 -5.413 -3.364 1.00 0.00 H new ATOM 0 HA ASP A 149 130.926 -4.273 -5.158 1.00 0.00 H new ATOM 0 HB2 ASP A 149 130.609 -6.561 -6.103 1.00 0.00 H new ATOM 0 HB3 ASP A 149 132.146 -5.840 -6.535 1.00 0.00 H new ATOM 1082 N TYR A 150 129.189 -6.062 -4.037 1.00 0.00 N ATOM 1083 CA TYR A 150 128.153 -6.533 -3.123 1.00 0.00 C ATOM 1084 C TYR A 150 128.596 -7.784 -2.369 1.00 0.00 C ATOM 1085 O TYR A 150 128.129 -8.046 -1.260 1.00 0.00 O ATOM 1086 CB TYR A 150 126.862 -6.820 -3.891 1.00 0.00 C ATOM 1087 CG TYR A 150 125.687 -7.153 -2.998 1.00 0.00 C ATOM 1088 CD1 TYR A 150 124.945 -6.149 -2.391 1.00 0.00 C ATOM 1089 CD2 TYR A 150 125.320 -8.473 -2.765 1.00 0.00 C ATOM 1090 CE1 TYR A 150 123.870 -6.450 -1.575 1.00 0.00 C ATOM 1091 CE2 TYR A 150 124.246 -8.782 -1.951 1.00 0.00 C ATOM 1092 CZ TYR A 150 123.525 -7.767 -1.358 1.00 0.00 C ATOM 1093 OH TYR A 150 122.456 -8.071 -0.547 1.00 0.00 O ATOM 0 H TYR A 150 128.931 -6.104 -5.023 1.00 0.00 H new ATOM 0 HA TYR A 150 127.973 -5.744 -2.392 1.00 0.00 H new ATOM 0 HB2 TYR A 150 126.610 -5.951 -4.499 1.00 0.00 H new ATOM 0 HB3 TYR A 150 127.034 -7.650 -4.576 1.00 0.00 H new ATOM 0 HD1 TYR A 150 125.212 -5.116 -2.559 1.00 0.00 H new ATOM 0 HD2 TYR A 150 125.883 -9.270 -3.227 1.00 0.00 H new ATOM 0 HE1 TYR A 150 123.303 -5.657 -1.110 1.00 0.00 H new ATOM 0 HE2 TYR A 150 123.973 -9.813 -1.780 1.00 0.00 H new ATOM 0 HH TYR A 150 122.347 -9.044 -0.500 1.00 0.00 H new ATOM 1103 N ASP A 151 129.492 -8.559 -2.972 1.00 0.00 N ATOM 1104 CA ASP A 151 129.981 -9.782 -2.349 1.00 0.00 C ATOM 1105 C ASP A 151 130.811 -9.469 -1.109 1.00 0.00 C ATOM 1106 O ASP A 151 130.465 -9.876 0.000 1.00 0.00 O ATOM 1107 CB ASP A 151 130.819 -10.591 -3.342 1.00 0.00 C ATOM 1108 CG ASP A 151 130.127 -10.760 -4.679 1.00 0.00 C ATOM 1109 OD1 ASP A 151 128.880 -10.842 -4.697 1.00 0.00 O ATOM 1110 OD2 ASP A 151 130.831 -10.812 -5.710 1.00 0.00 O ATOM 0 H ASP A 151 129.893 -8.362 -3.889 1.00 0.00 H new ATOM 0 HA ASP A 151 129.116 -10.373 -2.048 1.00 0.00 H new ATOM 0 HB2 ASP A 151 131.778 -10.095 -3.492 1.00 0.00 H new ATOM 0 HB3 ASP A 151 131.031 -11.573 -2.919 1.00 0.00 H new ATOM 1115 N GLU A 152 131.908 -8.747 -1.306 1.00 0.00 N ATOM 1116 CA GLU A 152 132.790 -8.384 -0.202 1.00 0.00 C ATOM 1117 C GLU A 152 132.204 -7.248 0.634 1.00 0.00 C ATOM 1118 O GLU A 152 132.748 -6.894 1.680 1.00 0.00 O ATOM 1119 CB GLU A 152 134.168 -7.986 -0.732 1.00 0.00 C ATOM 1120 CG GLU A 152 134.148 -6.732 -1.586 1.00 0.00 C ATOM 1121 CD GLU A 152 135.524 -6.115 -1.743 1.00 0.00 C ATOM 1122 OE1 GLU A 152 136.414 -6.781 -2.313 1.00 0.00 O ATOM 1123 OE2 GLU A 152 135.711 -4.963 -1.296 1.00 0.00 O ATOM 0 H GLU A 152 132.208 -8.402 -2.218 1.00 0.00 H new ATOM 0 HA GLU A 152 132.891 -9.258 0.441 1.00 0.00 H new ATOM 0 HB2 GLU A 152 134.842 -7.832 0.111 1.00 0.00 H new ATOM 0 HB3 GLU A 152 134.575 -8.810 -1.319 1.00 0.00 H new ATOM 0 HG2 GLU A 152 133.747 -6.973 -2.570 1.00 0.00 H new ATOM 0 HG3 GLU A 152 133.475 -6.001 -1.138 1.00 0.00 H new ATOM 1130 N PHE A 153 131.090 -6.679 0.176 1.00 0.00 N ATOM 1131 CA PHE A 153 130.440 -5.589 0.897 1.00 0.00 C ATOM 1132 C PHE A 153 129.679 -6.127 2.107 1.00 0.00 C ATOM 1133 O PHE A 153 129.811 -5.608 3.217 1.00 0.00 O ATOM 1134 CB PHE A 153 129.490 -4.830 -0.036 1.00 0.00 C ATOM 1135 CG PHE A 153 128.540 -3.906 0.678 1.00 0.00 C ATOM 1136 CD1 PHE A 153 129.018 -2.918 1.523 1.00 0.00 C ATOM 1137 CD2 PHE A 153 127.172 -4.030 0.501 1.00 0.00 C ATOM 1138 CE1 PHE A 153 128.146 -2.070 2.180 1.00 0.00 C ATOM 1139 CE2 PHE A 153 126.296 -3.186 1.155 1.00 0.00 C ATOM 1140 CZ PHE A 153 126.782 -2.203 1.995 1.00 0.00 C ATOM 0 H PHE A 153 130.621 -6.954 -0.687 1.00 0.00 H new ATOM 0 HA PHE A 153 131.207 -4.900 1.251 1.00 0.00 H new ATOM 0 HB2 PHE A 153 130.080 -4.250 -0.746 1.00 0.00 H new ATOM 0 HB3 PHE A 153 128.913 -5.551 -0.615 1.00 0.00 H new ATOM 0 HD1 PHE A 153 130.082 -2.809 1.670 1.00 0.00 H new ATOM 0 HD2 PHE A 153 126.786 -4.795 -0.156 1.00 0.00 H new ATOM 0 HE1 PHE A 153 128.530 -1.304 2.837 1.00 0.00 H new ATOM 0 HE2 PHE A 153 125.231 -3.295 1.010 1.00 0.00 H new ATOM 0 HZ PHE A 153 126.099 -1.540 2.506 1.00 0.00 H new ATOM 1150 N LEU A 154 128.884 -7.170 1.885 1.00 0.00 N ATOM 1151 CA LEU A 154 128.103 -7.778 2.955 1.00 0.00 C ATOM 1152 C LEU A 154 129.011 -8.281 4.073 1.00 0.00 C ATOM 1153 O LEU A 154 128.610 -8.330 5.237 1.00 0.00 O ATOM 1154 CB LEU A 154 127.257 -8.931 2.404 1.00 0.00 C ATOM 1155 CG LEU A 154 125.745 -8.756 2.558 1.00 0.00 C ATOM 1156 CD1 LEU A 154 125.371 -8.625 4.026 1.00 0.00 C ATOM 1157 CD2 LEU A 154 125.269 -7.542 1.775 1.00 0.00 C ATOM 0 H LEU A 154 128.764 -7.611 0.973 1.00 0.00 H new ATOM 0 HA LEU A 154 127.441 -7.017 3.368 1.00 0.00 H new ATOM 0 HB2 LEU A 154 127.487 -9.057 1.346 1.00 0.00 H new ATOM 0 HB3 LEU A 154 127.554 -9.852 2.906 1.00 0.00 H new ATOM 0 HG LEU A 154 125.252 -9.641 2.156 1.00 0.00 H new ATOM 0 HD11 LEU A 154 124.292 -8.501 4.117 1.00 0.00 H new ATOM 0 HD12 LEU A 154 125.680 -9.523 4.562 1.00 0.00 H new ATOM 0 HD13 LEU A 154 125.873 -7.757 4.453 1.00 0.00 H new ATOM 0 HD21 LEU A 154 124.191 -7.431 1.895 1.00 0.00 H new ATOM 0 HD22 LEU A 154 125.769 -6.649 2.149 1.00 0.00 H new ATOM 0 HD23 LEU A 154 125.505 -7.675 0.719 1.00 0.00 H new ATOM 1169 N GLU A 155 130.236 -8.654 3.714 1.00 0.00 N ATOM 1170 CA GLU A 155 131.200 -9.150 4.689 1.00 0.00 C ATOM 1171 C GLU A 155 131.922 -7.994 5.373 1.00 0.00 C ATOM 1172 O GLU A 155 132.205 -8.046 6.569 1.00 0.00 O ATOM 1173 CB GLU A 155 132.216 -10.071 4.011 1.00 0.00 C ATOM 1174 CG GLU A 155 131.689 -11.473 3.754 1.00 0.00 C ATOM 1175 CD GLU A 155 132.776 -12.527 3.835 1.00 0.00 C ATOM 1176 OE1 GLU A 155 133.966 -12.167 3.712 1.00 0.00 O ATOM 1177 OE2 GLU A 155 132.438 -13.715 4.024 1.00 0.00 O ATOM 0 H GLU A 155 130.584 -8.622 2.756 1.00 0.00 H new ATOM 0 HA GLU A 155 130.657 -9.716 5.446 1.00 0.00 H new ATOM 0 HB2 GLU A 155 132.521 -9.627 3.063 1.00 0.00 H new ATOM 0 HB3 GLU A 155 133.108 -10.136 4.634 1.00 0.00 H new ATOM 0 HG2 GLU A 155 130.910 -11.703 4.480 1.00 0.00 H new ATOM 0 HG3 GLU A 155 131.226 -11.508 2.768 1.00 0.00 H new ATOM 1184 N PHE A 156 132.213 -6.949 4.604 1.00 0.00 N ATOM 1185 CA PHE A 156 132.900 -5.777 5.132 1.00 0.00 C ATOM 1186 C PHE A 156 132.019 -5.040 6.134 1.00 0.00 C ATOM 1187 O PHE A 156 132.507 -4.519 7.137 1.00 0.00 O ATOM 1188 CB PHE A 156 133.299 -4.839 3.992 1.00 0.00 C ATOM 1189 CG PHE A 156 134.130 -3.668 4.435 1.00 0.00 C ATOM 1190 CD1 PHE A 156 135.140 -3.831 5.370 1.00 0.00 C ATOM 1191 CD2 PHE A 156 133.900 -2.404 3.916 1.00 0.00 C ATOM 1192 CE1 PHE A 156 135.905 -2.755 5.777 1.00 0.00 C ATOM 1193 CE2 PHE A 156 134.661 -1.325 4.321 1.00 0.00 C ATOM 1194 CZ PHE A 156 135.665 -1.499 5.251 1.00 0.00 C ATOM 0 H PHE A 156 131.983 -6.891 3.612 1.00 0.00 H new ATOM 0 HA PHE A 156 133.801 -6.112 5.647 1.00 0.00 H new ATOM 0 HB2 PHE A 156 133.855 -5.406 3.245 1.00 0.00 H new ATOM 0 HB3 PHE A 156 132.397 -4.469 3.505 1.00 0.00 H new ATOM 0 HD1 PHE A 156 135.331 -4.810 5.785 1.00 0.00 H new ATOM 0 HD2 PHE A 156 133.117 -2.261 3.186 1.00 0.00 H new ATOM 0 HE1 PHE A 156 136.690 -2.895 6.506 1.00 0.00 H new ATOM 0 HE2 PHE A 156 134.470 -0.345 3.910 1.00 0.00 H new ATOM 0 HZ PHE A 156 136.262 -0.656 5.567 1.00 0.00 H new ATOM 1204 N MET A 157 130.721 -5.004 5.860 1.00 0.00 N ATOM 1205 CA MET A 157 129.772 -4.335 6.743 1.00 0.00 C ATOM 1206 C MET A 157 129.279 -5.281 7.840 1.00 0.00 C ATOM 1207 O MET A 157 128.380 -4.937 8.606 1.00 0.00 O ATOM 1208 CB MET A 157 128.585 -3.801 5.938 1.00 0.00 C ATOM 1209 CG MET A 157 128.653 -2.306 5.670 1.00 0.00 C ATOM 1210 SD MET A 157 130.191 -1.812 4.867 1.00 0.00 S ATOM 1211 CE MET A 157 130.058 -0.028 4.952 1.00 0.00 C ATOM 0 H MET A 157 130.301 -5.430 5.034 1.00 0.00 H new ATOM 0 HA MET A 157 130.285 -3.499 7.219 1.00 0.00 H new ATOM 0 HB2 MET A 157 128.535 -4.330 4.986 1.00 0.00 H new ATOM 0 HB3 MET A 157 127.663 -4.024 6.475 1.00 0.00 H new ATOM 0 HG2 MET A 157 127.811 -2.015 5.043 1.00 0.00 H new ATOM 0 HG3 MET A 157 128.550 -1.767 6.612 1.00 0.00 H new ATOM 0 HE1 MET A 157 130.938 0.425 4.494 1.00 0.00 H new ATOM 0 HE2 MET A 157 129.164 0.296 4.419 1.00 0.00 H new ATOM 0 HE3 MET A 157 129.991 0.283 5.995 1.00 0.00 H new ATOM 1221 N LYS A 158 129.871 -6.473 7.908 1.00 0.00 N ATOM 1222 CA LYS A 158 129.486 -7.461 8.909 1.00 0.00 C ATOM 1223 C LYS A 158 130.327 -7.317 10.175 1.00 0.00 C ATOM 1224 O LYS A 158 130.777 -8.309 10.750 1.00 0.00 O ATOM 1225 CB LYS A 158 129.633 -8.874 8.339 1.00 0.00 C ATOM 1226 CG LYS A 158 128.426 -9.761 8.593 1.00 0.00 C ATOM 1227 CD LYS A 158 128.417 -10.968 7.669 1.00 0.00 C ATOM 1228 CE LYS A 158 129.309 -12.080 8.195 1.00 0.00 C ATOM 1229 NZ LYS A 158 129.818 -12.949 7.099 1.00 0.00 N ATOM 0 H LYS A 158 130.617 -6.775 7.282 1.00 0.00 H new ATOM 0 HA LYS A 158 128.442 -7.288 9.172 1.00 0.00 H new ATOM 0 HB2 LYS A 158 129.805 -8.807 7.265 1.00 0.00 H new ATOM 0 HB3 LYS A 158 130.516 -9.342 8.774 1.00 0.00 H new ATOM 0 HG2 LYS A 158 128.431 -10.096 9.630 1.00 0.00 H new ATOM 0 HG3 LYS A 158 127.512 -9.184 8.449 1.00 0.00 H new ATOM 0 HD2 LYS A 158 127.397 -11.338 7.562 1.00 0.00 H new ATOM 0 HD3 LYS A 158 128.753 -10.670 6.676 1.00 0.00 H new ATOM 0 HE2 LYS A 158 130.151 -11.646 8.734 1.00 0.00 H new ATOM 0 HE3 LYS A 158 128.751 -12.686 8.909 1.00 0.00 H new ATOM 0 HZ1 LYS A 158 130.352 -13.743 7.505 1.00 0.00 H new ATOM 0 HZ2 LYS A 158 129.017 -13.317 6.547 1.00 0.00 H new ATOM 0 HZ3 LYS A 158 130.441 -12.395 6.478 1.00 0.00 H new ATOM 1243 N GLY A 159 130.532 -6.077 10.608 1.00 0.00 N ATOM 1244 CA GLY A 159 131.312 -5.829 11.806 1.00 0.00 C ATOM 1245 C GLY A 159 132.698 -5.298 11.501 1.00 0.00 C ATOM 1246 O GLY A 159 133.654 -6.065 11.380 1.00 0.00 O ATOM 0 H GLY A 159 130.172 -5.240 10.150 1.00 0.00 H new ATOM 0 HA2 GLY A 159 130.784 -5.114 12.437 1.00 0.00 H new ATOM 0 HA3 GLY A 159 131.399 -6.754 12.376 1.00 0.00 H new ATOM 1250 N VAL A 160 132.808 -3.980 11.378 1.00 0.00 N ATOM 1251 CA VAL A 160 134.086 -3.339 11.086 1.00 0.00 C ATOM 1252 C VAL A 160 134.562 -2.500 12.269 1.00 0.00 C ATOM 1253 O VAL A 160 135.760 -2.404 12.532 1.00 0.00 O ATOM 1254 CB VAL A 160 134.010 -2.441 9.832 1.00 0.00 C ATOM 1255 CG1 VAL A 160 134.420 -3.224 8.593 1.00 0.00 C ATOM 1256 CG2 VAL A 160 132.615 -1.856 9.663 1.00 0.00 C ATOM 0 H VAL A 160 132.026 -3.333 11.476 1.00 0.00 H new ATOM 0 HA VAL A 160 134.798 -4.142 10.897 1.00 0.00 H new ATOM 0 HB VAL A 160 134.706 -1.613 9.964 1.00 0.00 H new ATOM 0 HG11 VAL A 160 134.361 -2.577 7.718 1.00 0.00 H new ATOM 0 HG12 VAL A 160 135.443 -3.583 8.711 1.00 0.00 H new ATOM 0 HG13 VAL A 160 133.750 -4.074 8.462 1.00 0.00 H new ATOM 0 HG21 VAL A 160 132.589 -1.228 8.773 1.00 0.00 H new ATOM 0 HG22 VAL A 160 131.892 -2.665 9.558 1.00 0.00 H new ATOM 0 HG23 VAL A 160 132.364 -1.256 10.538 1.00 0.00 H new ATOM 1266 N GLU A 161 133.615 -1.895 12.979 1.00 0.00 N ATOM 1267 CA GLU A 161 133.938 -1.066 14.134 1.00 0.00 C ATOM 1268 C GLU A 161 134.455 -1.918 15.288 1.00 0.00 C ATOM 1269 O GLU A 161 133.737 -2.768 15.815 1.00 0.00 O ATOM 1270 CB GLU A 161 132.708 -0.273 14.579 1.00 0.00 C ATOM 1271 CG GLU A 161 132.516 1.029 13.821 1.00 0.00 C ATOM 1272 CD GLU A 161 131.054 1.405 13.667 1.00 0.00 C ATOM 1273 OE1 GLU A 161 130.325 0.673 12.963 1.00 0.00 O ATOM 1274 OE2 GLU A 161 130.639 2.428 14.251 1.00 0.00 O ATOM 0 H GLU A 161 132.618 -1.963 12.775 1.00 0.00 H new ATOM 0 HA GLU A 161 134.724 -0.369 13.842 1.00 0.00 H new ATOM 0 HB2 GLU A 161 131.821 -0.893 14.450 1.00 0.00 H new ATOM 0 HB3 GLU A 161 132.793 -0.055 15.644 1.00 0.00 H new ATOM 0 HG2 GLU A 161 133.040 1.830 14.343 1.00 0.00 H new ATOM 0 HG3 GLU A 161 132.970 0.941 12.834 1.00 0.00 H new TER 1281 GLU A 161 HETATM 1282 CA CA A 162 132.289 2.077 -11.865 1.00 0.00 CA HETATM 1283 CA CA A 163 136.052 -5.770 -4.665 1.00 0.00 CA