USER MOD reduce.3.24.130724 H: found=0, std=0, add=1051, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1053 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 Set 1.1: A 86 CYS SG : rot 91:sc= -1.24 USER MOD Set 1.2: A 90 THR OG1 : rot 90:sc= 1.05 USER MOD Set 2.1: A 80 TYR OH : rot 120:sc= -0.597 USER MOD Set 2.2: A 89 GLN : amide:sc= -0.991 K(o=-1.6,f=-6.5) USER MOD Set 3.1: A 34 GLN : amide:sc= -1.29 K(o=-2.2,f=-5.1!) USER MOD Set 3.2: A 37 GLN : amide:sc= -0.954 K(o=-2.2,f=-3.9!) USER MOD Single : A 10 MET CE :methyl -94:sc= -0.775 (180deg=-1.76!) USER MOD Single : A 19 CYS SG : rot 41:sc= 0.722 USER MOD Single : A 20 TYR OH : rot 150:sc= 0 USER MOD Single : A 21 CYS SG : rot -51:sc= -1.44 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 26 GLN : amide:sc= -0.257 K(o=-0.26,f=-2.4!) USER MOD Single : A 29 GLN : amide:sc= -2.46 K(o=-2.5,f=-1.6) USER MOD Single : A 31 MET CE :methyl -153:sc= -1.12 (180deg=-2.29!) USER MOD Single : A 43 LYS NZ :NH3+ -117:sc= -0.435 (180deg=-2.25!) USER MOD Single : A 45 CYS SG : rot -3:sc= -1.97 USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 CYS SG : rot -106:sc= -1.77 USER MOD Single : A 72 MET CE :methyl -118:sc= -2.57 (180deg=-9.19!) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 82 GLN : amide:sc= 0.786 K(o=0.79,f=-0.35) USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 SER OG : rot 180:sc= -1.87! USER MOD Single : A 97 SER OG : rot 180:sc= -0.0352 USER MOD Single : A 101 HIS : no HE2:sc= -0.213 K(o=-0.21,f=-1.1) USER MOD Single : A 102 GLN : amide:sc= -0.0525 K(o=-0.053,f=-1.1!) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 TYR OH : rot 180:sc= -0.0642 USER MOD Single : A 111 LYS NZ :NH3+ 152:sc= -0.162 (180deg=-0.64) USER MOD Single : A 113 MET CE :methyl 134:sc= -4.7! (180deg=-12.7!) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 LYS NZ :NH3+ 155:sc= -1.9 (180deg=-3.25!) USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 125 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 CYS SG : rot -164:sc= 1.4 USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 130 THR OG1 : rot 180:sc= -0.324 USER MOD Single : A 131 ASN : amide:sc=-0.00359 K(o=-0.0036,f=-1.7) USER MOD Single : A 133 CYS SG : rot 180:sc= 0 USER MOD Single : A 134 THR OG1 : rot 180:sc= 0 USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 140 THR OG1 : rot 180:sc= 0 USER MOD Single : A 144 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 147 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 19 N MET A 10 -6.338 -11.228 -13.158 1.00 0.00 N ATOM 20 CA MET A 10 -6.112 -11.333 -11.722 1.00 0.00 C ATOM 21 C MET A 10 -5.430 -12.655 -11.373 1.00 0.00 C ATOM 22 O MET A 10 -6.089 -13.617 -10.979 1.00 0.00 O ATOM 23 CB MET A 10 -7.439 -11.214 -10.967 1.00 0.00 C ATOM 24 CG MET A 10 -7.293 -11.302 -9.456 1.00 0.00 C ATOM 25 SD MET A 10 -8.770 -11.947 -8.650 1.00 0.00 S ATOM 26 CE MET A 10 -9.666 -10.432 -8.320 1.00 0.00 C ATOM 0 HA MET A 10 -5.456 -10.517 -11.421 1.00 0.00 H new ATOM 0 HB2 MET A 10 -7.908 -10.264 -11.223 1.00 0.00 H new ATOM 0 HB3 MET A 10 -8.111 -12.003 -11.305 1.00 0.00 H new ATOM 0 HG2 MET A 10 -6.444 -11.941 -9.214 1.00 0.00 H new ATOM 0 HG3 MET A 10 -7.070 -10.312 -9.058 1.00 0.00 H new ATOM 0 HE1 MET A 10 -9.437 -10.086 -7.312 1.00 0.00 H new ATOM 0 HE2 MET A 10 -9.370 -9.670 -9.041 1.00 0.00 H new ATOM 0 HE3 MET A 10 -10.737 -10.617 -8.406 1.00 0.00 H new ATOM 36 N PRO A 11 -4.095 -12.717 -11.515 1.00 0.00 N ATOM 37 CA PRO A 11 -3.324 -13.929 -11.213 1.00 0.00 C ATOM 38 C PRO A 11 -3.593 -14.452 -9.806 1.00 0.00 C ATOM 39 O PRO A 11 -4.424 -13.909 -9.078 1.00 0.00 O ATOM 40 CB PRO A 11 -1.869 -13.470 -11.341 1.00 0.00 C ATOM 41 CG PRO A 11 -1.919 -12.294 -12.253 1.00 0.00 C ATOM 42 CD PRO A 11 -3.231 -11.615 -11.979 1.00 0.00 C ATOM 0 HA PRO A 11 -3.585 -14.752 -11.879 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -1.453 -13.200 -10.370 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -1.239 -14.261 -11.749 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -1.084 -11.619 -12.066 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -1.851 -12.605 -13.295 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -3.131 -10.837 -11.222 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -3.632 -11.139 -12.874 1.00 0.00 H new ATOM 50 N GLU A 12 -2.881 -15.508 -9.428 1.00 0.00 N ATOM 51 CA GLU A 12 -3.039 -16.105 -8.108 1.00 0.00 C ATOM 52 C GLU A 12 -2.044 -15.507 -7.119 1.00 0.00 C ATOM 53 O GLU A 12 -2.371 -15.278 -5.955 1.00 0.00 O ATOM 54 CB GLU A 12 -2.849 -17.622 -8.184 1.00 0.00 C ATOM 55 CG GLU A 12 -3.860 -18.318 -9.080 1.00 0.00 C ATOM 56 CD GLU A 12 -4.316 -19.650 -8.518 1.00 0.00 C ATOM 57 OE1 GLU A 12 -3.497 -20.591 -8.482 1.00 0.00 O ATOM 58 OE2 GLU A 12 -5.493 -19.751 -8.112 1.00 0.00 O ATOM 0 H GLU A 12 -2.188 -15.968 -10.018 1.00 0.00 H new ATOM 0 HA GLU A 12 -4.048 -15.889 -7.758 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -1.845 -17.836 -8.549 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -2.919 -18.039 -7.179 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -4.726 -17.670 -9.217 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -3.420 -18.475 -10.065 1.00 0.00 H new ATOM 65 N ARG A 13 -0.830 -15.255 -7.595 1.00 0.00 N ATOM 66 CA ARG A 13 0.216 -14.679 -6.758 1.00 0.00 C ATOM 67 C ARG A 13 0.398 -13.197 -7.060 1.00 0.00 C ATOM 68 O ARG A 13 0.649 -12.811 -8.202 1.00 0.00 O ATOM 69 CB ARG A 13 1.536 -15.420 -6.975 1.00 0.00 C ATOM 70 CG ARG A 13 1.432 -16.923 -6.769 1.00 0.00 C ATOM 71 CD ARG A 13 1.506 -17.289 -5.295 1.00 0.00 C ATOM 72 NE ARG A 13 2.007 -18.647 -5.094 1.00 0.00 N ATOM 73 CZ ARG A 13 1.320 -19.744 -5.403 1.00 0.00 C ATOM 74 NH1 ARG A 13 0.103 -19.648 -5.927 1.00 0.00 N ATOM 75 NH2 ARG A 13 1.849 -20.940 -5.190 1.00 0.00 N ATOM 0 H ARG A 13 -0.546 -15.441 -8.557 1.00 0.00 H new ATOM 0 HA ARG A 13 -0.086 -14.785 -5.716 1.00 0.00 H new ATOM 0 HB2 ARG A 13 1.891 -15.224 -7.987 1.00 0.00 H new ATOM 0 HB3 ARG A 13 2.285 -15.019 -6.292 1.00 0.00 H new ATOM 0 HG2 ARG A 13 0.493 -17.285 -7.188 1.00 0.00 H new ATOM 0 HG3 ARG A 13 2.236 -17.422 -7.310 1.00 0.00 H new ATOM 0 HD2 ARG A 13 2.155 -16.583 -4.778 1.00 0.00 H new ATOM 0 HD3 ARG A 13 0.516 -17.198 -4.848 1.00 0.00 H new ATOM 0 HE ARG A 13 2.938 -18.761 -4.693 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -0.309 -18.730 -6.094 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -0.419 -20.492 -6.162 1.00 0.00 H new ATOM 0 HH21 ARG A 13 2.783 -21.020 -4.789 1.00 0.00 H new ATOM 0 HH22 ARG A 13 1.322 -21.780 -5.427 1.00 0.00 H new ATOM 89 N PHE A 14 0.266 -12.368 -6.030 1.00 0.00 N ATOM 90 CA PHE A 14 0.416 -10.926 -6.187 1.00 0.00 C ATOM 91 C PHE A 14 1.600 -10.408 -5.381 1.00 0.00 C ATOM 92 O PHE A 14 2.222 -11.153 -4.623 1.00 0.00 O ATOM 93 CB PHE A 14 -0.866 -10.212 -5.758 1.00 0.00 C ATOM 94 CG PHE A 14 -1.991 -10.369 -6.741 1.00 0.00 C ATOM 95 CD1 PHE A 14 -1.933 -9.754 -7.982 1.00 0.00 C ATOM 96 CD2 PHE A 14 -3.103 -11.133 -6.427 1.00 0.00 C ATOM 97 CE1 PHE A 14 -2.963 -9.900 -8.890 1.00 0.00 C ATOM 98 CE2 PHE A 14 -4.136 -11.280 -7.332 1.00 0.00 C ATOM 99 CZ PHE A 14 -4.066 -10.663 -8.565 1.00 0.00 C ATOM 0 H PHE A 14 0.056 -12.670 -5.079 1.00 0.00 H new ATOM 0 HA PHE A 14 0.604 -10.717 -7.240 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -1.182 -10.599 -4.789 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -0.655 -9.151 -5.624 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -1.073 -9.154 -8.241 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -3.163 -11.619 -5.464 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -2.905 -9.417 -9.854 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -4.998 -11.877 -7.075 1.00 0.00 H new ATOM 0 HZ PHE A 14 -4.873 -10.777 -9.274 1.00 0.00 H new ATOM 109 N ASP A 15 1.916 -9.130 -5.557 1.00 0.00 N ATOM 110 CA ASP A 15 3.035 -8.517 -4.850 1.00 0.00 C ATOM 111 C ASP A 15 2.562 -7.757 -3.617 1.00 0.00 C ATOM 112 O ASP A 15 2.914 -8.106 -2.491 1.00 0.00 O ATOM 113 CB ASP A 15 3.798 -7.574 -5.782 1.00 0.00 C ATOM 114 CG ASP A 15 5.069 -7.042 -5.151 1.00 0.00 C ATOM 115 OD1 ASP A 15 4.969 -6.199 -4.232 1.00 0.00 O ATOM 116 OD2 ASP A 15 6.165 -7.465 -5.573 1.00 0.00 O ATOM 0 H ASP A 15 1.414 -8.499 -6.182 1.00 0.00 H new ATOM 0 HA ASP A 15 3.700 -9.316 -4.523 1.00 0.00 H new ATOM 0 HB2 ASP A 15 4.046 -8.100 -6.704 1.00 0.00 H new ATOM 0 HB3 ASP A 15 3.154 -6.738 -6.056 1.00 0.00 H new ATOM 121 N ALA A 16 1.769 -6.709 -3.832 1.00 0.00 N ATOM 122 CA ALA A 16 1.266 -5.905 -2.723 1.00 0.00 C ATOM 123 C ALA A 16 -0.140 -5.381 -2.990 1.00 0.00 C ATOM 124 O ALA A 16 -0.684 -5.536 -4.084 1.00 0.00 O ATOM 125 CB ALA A 16 2.209 -4.741 -2.449 1.00 0.00 C ATOM 0 H ALA A 16 1.464 -6.400 -4.755 1.00 0.00 H new ATOM 0 HA ALA A 16 1.218 -6.551 -1.847 1.00 0.00 H new ATOM 0 HB1 ALA A 16 1.824 -4.148 -1.620 1.00 0.00 H new ATOM 0 HB2 ALA A 16 3.196 -5.125 -2.192 1.00 0.00 H new ATOM 0 HB3 ALA A 16 2.283 -4.116 -3.339 1.00 0.00 H new ATOM 131 N PHE A 17 -0.716 -4.742 -1.976 1.00 0.00 N ATOM 132 CA PHE A 17 -2.052 -4.173 -2.088 1.00 0.00 C ATOM 133 C PHE A 17 -2.044 -2.704 -1.678 1.00 0.00 C ATOM 134 O PHE A 17 -1.194 -2.271 -0.901 1.00 0.00 O ATOM 135 CB PHE A 17 -3.044 -4.955 -1.225 1.00 0.00 C ATOM 136 CG PHE A 17 -4.448 -4.424 -1.294 1.00 0.00 C ATOM 137 CD1 PHE A 17 -5.323 -4.869 -2.272 1.00 0.00 C ATOM 138 CD2 PHE A 17 -4.892 -3.481 -0.382 1.00 0.00 C ATOM 139 CE1 PHE A 17 -6.615 -4.383 -2.337 1.00 0.00 C ATOM 140 CE2 PHE A 17 -6.183 -2.991 -0.442 1.00 0.00 C ATOM 141 CZ PHE A 17 -7.045 -3.443 -1.423 1.00 0.00 C ATOM 0 H PHE A 17 -0.276 -4.606 -1.066 1.00 0.00 H new ATOM 0 HA PHE A 17 -2.366 -4.243 -3.129 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -3.043 -5.999 -1.540 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -2.707 -4.934 -0.189 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -4.992 -5.603 -2.991 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -4.221 -3.124 0.386 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -7.288 -4.739 -3.103 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -6.517 -2.257 0.276 1.00 0.00 H new ATOM 0 HZ PHE A 17 -8.054 -3.061 -1.474 1.00 0.00 H new ATOM 151 N ILE A 18 -2.990 -1.938 -2.213 1.00 0.00 N ATOM 152 CA ILE A 18 -3.084 -0.516 -1.911 1.00 0.00 C ATOM 153 C ILE A 18 -4.279 -0.215 -1.009 1.00 0.00 C ATOM 154 O ILE A 18 -5.420 -0.523 -1.353 1.00 0.00 O ATOM 155 CB ILE A 18 -3.205 0.317 -3.200 1.00 0.00 C ATOM 156 CG1 ILE A 18 -2.080 -0.049 -4.169 1.00 0.00 C ATOM 157 CG2 ILE A 18 -3.181 1.806 -2.880 1.00 0.00 C ATOM 158 CD1 ILE A 18 -0.709 0.408 -3.713 1.00 0.00 C ATOM 0 H ILE A 18 -3.702 -2.280 -2.858 1.00 0.00 H new ATOM 0 HA ILE A 18 -2.167 -0.242 -1.389 1.00 0.00 H new ATOM 0 HB ILE A 18 -4.159 0.090 -3.676 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -2.066 -1.131 -4.304 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -2.294 0.391 -5.143 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -3.268 2.378 -3.804 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -4.015 2.050 -2.222 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -2.243 2.057 -2.385 1.00 0.00 H new ATOM 0 HD11 ILE A 18 0.037 0.113 -4.451 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -0.704 1.493 -3.606 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -0.472 -0.052 -2.754 1.00 0.00 H new ATOM 170 N CYS A 19 -4.011 0.389 0.145 1.00 0.00 N ATOM 171 CA CYS A 19 -5.069 0.729 1.093 1.00 0.00 C ATOM 172 C CYS A 19 -5.221 2.242 1.241 1.00 0.00 C ATOM 173 O CYS A 19 -4.496 2.876 2.009 1.00 0.00 O ATOM 174 CB CYS A 19 -4.779 0.102 2.457 1.00 0.00 C ATOM 175 SG CYS A 19 -5.508 -1.536 2.687 1.00 0.00 S ATOM 0 H CYS A 19 -3.073 0.653 0.446 1.00 0.00 H new ATOM 0 HA CYS A 19 -6.005 0.330 0.702 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -3.699 0.029 2.589 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -5.151 0.766 3.237 1.00 0.00 H new ATOM 0 HG CYS A 19 -5.386 -2.223 1.590 1.00 0.00 H new ATOM 181 N TYR A 20 -6.171 2.815 0.504 1.00 0.00 N ATOM 182 CA TYR A 20 -6.423 4.254 0.560 1.00 0.00 C ATOM 183 C TYR A 20 -7.910 4.553 0.375 1.00 0.00 C ATOM 184 O TYR A 20 -8.684 3.679 -0.016 1.00 0.00 O ATOM 185 CB TYR A 20 -5.602 4.980 -0.509 1.00 0.00 C ATOM 186 CG TYR A 20 -5.497 6.474 -0.292 1.00 0.00 C ATOM 187 CD1 TYR A 20 -5.322 7.010 0.979 1.00 0.00 C ATOM 188 CD2 TYR A 20 -5.568 7.352 -1.366 1.00 0.00 C ATOM 189 CE1 TYR A 20 -5.221 8.375 1.172 1.00 0.00 C ATOM 190 CE2 TYR A 20 -5.470 8.719 -1.181 1.00 0.00 C ATOM 191 CZ TYR A 20 -5.297 9.224 0.089 1.00 0.00 C ATOM 192 OH TYR A 20 -5.198 10.584 0.277 1.00 0.00 O ATOM 0 H TYR A 20 -6.778 2.306 -0.138 1.00 0.00 H new ATOM 0 HA TYR A 20 -6.120 4.614 1.543 1.00 0.00 H new ATOM 0 HB2 TYR A 20 -4.599 4.555 -0.533 1.00 0.00 H new ATOM 0 HB3 TYR A 20 -6.050 4.795 -1.485 1.00 0.00 H new ATOM 0 HD1 TYR A 20 -5.264 6.348 1.830 1.00 0.00 H new ATOM 0 HD2 TYR A 20 -5.702 6.960 -2.363 1.00 0.00 H new ATOM 0 HE1 TYR A 20 -5.083 8.774 2.166 1.00 0.00 H new ATOM 0 HE2 TYR A 20 -5.529 9.387 -2.028 1.00 0.00 H new ATOM 0 HH TYR A 20 -4.799 10.996 -0.518 1.00 0.00 H new ATOM 202 N CYS A 21 -8.302 5.792 0.661 1.00 0.00 N ATOM 203 CA CYS A 21 -9.696 6.207 0.530 1.00 0.00 C ATOM 204 C CYS A 21 -9.990 6.718 -0.881 1.00 0.00 C ATOM 205 O CYS A 21 -9.096 7.211 -1.569 1.00 0.00 O ATOM 206 CB CYS A 21 -10.030 7.295 1.554 1.00 0.00 C ATOM 207 SG CYS A 21 -8.912 8.716 1.515 1.00 0.00 S ATOM 0 H CYS A 21 -7.673 6.527 0.985 1.00 0.00 H new ATOM 0 HA CYS A 21 -10.321 5.334 0.718 1.00 0.00 H new ATOM 0 HB2 CYS A 21 -11.048 7.643 1.379 1.00 0.00 H new ATOM 0 HB3 CYS A 21 -10.009 6.858 2.552 1.00 0.00 H new ATOM 0 HG CYS A 21 -7.681 8.302 1.582 1.00 0.00 H new ATOM 213 N PRO A 22 -11.255 6.605 -1.332 1.00 0.00 N ATOM 214 CA PRO A 22 -11.670 7.052 -2.665 1.00 0.00 C ATOM 215 C PRO A 22 -11.781 8.575 -2.778 1.00 0.00 C ATOM 216 O PRO A 22 -12.170 9.096 -3.822 1.00 0.00 O ATOM 217 CB PRO A 22 -13.054 6.407 -2.859 1.00 0.00 C ATOM 218 CG PRO A 22 -13.257 5.503 -1.684 1.00 0.00 C ATOM 219 CD PRO A 22 -12.379 6.028 -0.588 1.00 0.00 C ATOM 0 HA PRO A 22 -10.938 6.764 -3.419 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -13.835 7.166 -2.907 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -13.096 5.847 -3.793 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -14.302 5.497 -1.375 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -12.993 4.476 -1.934 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -12.890 6.775 0.019 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -12.055 5.236 0.087 1.00 0.00 H new ATOM 227 N SER A 23 -11.437 9.284 -1.707 1.00 0.00 N ATOM 228 CA SER A 23 -11.502 10.740 -1.706 1.00 0.00 C ATOM 229 C SER A 23 -10.404 11.314 -2.589 1.00 0.00 C ATOM 230 O SER A 23 -10.588 12.343 -3.240 1.00 0.00 O ATOM 231 CB SER A 23 -11.367 11.280 -0.281 1.00 0.00 C ATOM 232 OG SER A 23 -12.493 10.934 0.506 1.00 0.00 O ATOM 0 H SER A 23 -11.111 8.874 -0.831 1.00 0.00 H new ATOM 0 HA SER A 23 -12.470 11.045 -2.103 1.00 0.00 H new ATOM 0 HB2 SER A 23 -10.463 10.881 0.178 1.00 0.00 H new ATOM 0 HB3 SER A 23 -11.259 12.364 -0.309 1.00 0.00 H new ATOM 0 HG SER A 23 -12.380 11.290 1.412 1.00 0.00 H new ATOM 238 N ASP A 24 -9.266 10.632 -2.611 1.00 0.00 N ATOM 239 CA ASP A 24 -8.137 11.060 -3.420 1.00 0.00 C ATOM 240 C ASP A 24 -7.350 9.856 -3.923 1.00 0.00 C ATOM 241 O ASP A 24 -6.133 9.920 -4.093 1.00 0.00 O ATOM 242 CB ASP A 24 -7.225 11.989 -2.618 1.00 0.00 C ATOM 243 CG ASP A 24 -6.281 12.780 -3.505 1.00 0.00 C ATOM 244 OD1 ASP A 24 -6.751 13.351 -4.511 1.00 0.00 O ATOM 245 OD2 ASP A 24 -5.073 12.826 -3.192 1.00 0.00 O ATOM 0 H ASP A 24 -9.102 9.779 -2.076 1.00 0.00 H new ATOM 0 HA ASP A 24 -8.522 11.607 -4.281 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -7.835 12.679 -2.035 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -6.644 11.400 -1.908 1.00 0.00 H new ATOM 250 N ILE A 25 -8.058 8.757 -4.155 1.00 0.00 N ATOM 251 CA ILE A 25 -7.439 7.527 -4.634 1.00 0.00 C ATOM 252 C ILE A 25 -6.862 7.705 -6.036 1.00 0.00 C ATOM 253 O ILE A 25 -5.785 7.192 -6.342 1.00 0.00 O ATOM 254 CB ILE A 25 -8.452 6.361 -4.633 1.00 0.00 C ATOM 255 CG1 ILE A 25 -7.722 5.017 -4.647 1.00 0.00 C ATOM 256 CG2 ILE A 25 -9.408 6.471 -5.815 1.00 0.00 C ATOM 257 CD1 ILE A 25 -6.962 4.750 -5.928 1.00 0.00 C ATOM 0 H ILE A 25 -9.067 8.693 -4.018 1.00 0.00 H new ATOM 0 HA ILE A 25 -6.624 7.289 -3.950 1.00 0.00 H new ATOM 0 HB ILE A 25 -9.041 6.421 -3.718 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -7.026 4.983 -3.809 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -8.447 4.218 -4.492 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -10.112 5.639 -5.793 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -9.956 7.411 -5.753 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -8.841 6.442 -6.745 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -6.470 3.779 -5.864 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -7.655 4.751 -6.769 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -6.212 5.527 -6.075 1.00 0.00 H new ATOM 269 N GLN A 26 -7.589 8.430 -6.883 1.00 0.00 N ATOM 270 CA GLN A 26 -7.162 8.678 -8.260 1.00 0.00 C ATOM 271 C GLN A 26 -5.669 8.985 -8.335 1.00 0.00 C ATOM 272 O GLN A 26 -4.963 8.496 -9.220 1.00 0.00 O ATOM 273 CB GLN A 26 -7.962 9.836 -8.860 1.00 0.00 C ATOM 274 CG GLN A 26 -9.464 9.688 -8.689 1.00 0.00 C ATOM 275 CD GLN A 26 -10.245 10.332 -9.818 1.00 0.00 C ATOM 276 OE1 GLN A 26 -9.684 10.683 -10.856 1.00 0.00 O ATOM 277 NE2 GLN A 26 -11.549 10.491 -9.619 1.00 0.00 N ATOM 0 H GLN A 26 -8.482 8.859 -6.639 1.00 0.00 H new ATOM 0 HA GLN A 26 -7.350 7.771 -8.835 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -7.642 10.768 -8.395 1.00 0.00 H new ATOM 0 HB3 GLN A 26 -7.731 9.914 -9.922 1.00 0.00 H new ATOM 0 HG2 GLN A 26 -9.717 8.629 -8.635 1.00 0.00 H new ATOM 0 HG3 GLN A 26 -9.764 10.137 -7.742 1.00 0.00 H new ATOM 0 HE21 GLN A 26 -11.972 10.185 -8.743 1.00 0.00 H new ATOM 0 HE22 GLN A 26 -12.127 10.919 -10.342 1.00 0.00 H new ATOM 286 N PHE A 27 -5.193 9.792 -7.397 1.00 0.00 N ATOM 287 CA PHE A 27 -3.782 10.161 -7.352 1.00 0.00 C ATOM 288 C PHE A 27 -2.913 8.936 -7.091 1.00 0.00 C ATOM 289 O PHE A 27 -1.987 8.647 -7.848 1.00 0.00 O ATOM 290 CB PHE A 27 -3.542 11.213 -6.268 1.00 0.00 C ATOM 291 CG PHE A 27 -2.411 12.151 -6.586 1.00 0.00 C ATOM 292 CD1 PHE A 27 -1.109 11.684 -6.661 1.00 0.00 C ATOM 293 CD2 PHE A 27 -2.651 13.496 -6.809 1.00 0.00 C ATOM 294 CE1 PHE A 27 -0.067 12.543 -6.953 1.00 0.00 C ATOM 295 CE2 PHE A 27 -1.614 14.360 -7.102 1.00 0.00 C ATOM 296 CZ PHE A 27 -0.320 13.883 -7.174 1.00 0.00 C ATOM 0 H PHE A 27 -5.761 10.204 -6.657 1.00 0.00 H new ATOM 0 HA PHE A 27 -3.508 10.581 -8.320 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -4.455 11.792 -6.125 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -3.332 10.710 -5.324 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -0.906 10.637 -6.489 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -3.661 13.874 -6.753 1.00 0.00 H new ATOM 0 HE1 PHE A 27 0.944 12.167 -7.008 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -1.815 15.407 -7.275 1.00 0.00 H new ATOM 0 HZ PHE A 27 0.493 14.556 -7.403 1.00 0.00 H new ATOM 306 N VAL A 28 -3.222 8.219 -6.014 1.00 0.00 N ATOM 307 CA VAL A 28 -2.474 7.024 -5.650 1.00 0.00 C ATOM 308 C VAL A 28 -2.449 6.017 -6.794 1.00 0.00 C ATOM 309 O VAL A 28 -1.379 5.617 -7.254 1.00 0.00 O ATOM 310 CB VAL A 28 -3.071 6.349 -4.402 1.00 0.00 C ATOM 311 CG1 VAL A 28 -2.164 5.230 -3.912 1.00 0.00 C ATOM 312 CG2 VAL A 28 -3.305 7.375 -3.306 1.00 0.00 C ATOM 0 H VAL A 28 -3.987 8.447 -5.379 1.00 0.00 H new ATOM 0 HA VAL A 28 -1.455 7.344 -5.432 1.00 0.00 H new ATOM 0 HB VAL A 28 -4.032 5.911 -4.671 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -2.604 4.766 -3.029 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -2.052 4.483 -4.697 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -1.186 5.639 -3.658 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -3.727 6.882 -2.430 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -2.358 7.843 -3.037 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -3.998 8.137 -3.663 1.00 0.00 H new ATOM 322 N GLN A 29 -3.631 5.607 -7.252 1.00 0.00 N ATOM 323 CA GLN A 29 -3.736 4.647 -8.342 1.00 0.00 C ATOM 324 C GLN A 29 -2.813 5.027 -9.493 1.00 0.00 C ATOM 325 O GLN A 29 -2.200 4.163 -10.119 1.00 0.00 O ATOM 326 CB GLN A 29 -5.181 4.556 -8.829 1.00 0.00 C ATOM 327 CG GLN A 29 -5.749 5.877 -9.313 1.00 0.00 C ATOM 328 CD GLN A 29 -7.002 5.703 -10.147 1.00 0.00 C ATOM 329 OE1 GLN A 29 -6.935 5.588 -11.372 1.00 0.00 O ATOM 330 NE2 GLN A 29 -8.154 5.680 -9.488 1.00 0.00 N ATOM 0 H GLN A 29 -4.527 5.926 -6.883 1.00 0.00 H new ATOM 0 HA GLN A 29 -3.428 3.671 -7.967 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -5.236 3.829 -9.639 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -5.804 4.178 -8.019 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -5.974 6.508 -8.453 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -4.995 6.398 -9.902 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -8.163 5.779 -8.473 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -9.030 5.563 -9.997 1.00 0.00 H new ATOM 339 N GLU A 30 -2.699 6.325 -9.756 1.00 0.00 N ATOM 340 CA GLU A 30 -1.828 6.806 -10.821 1.00 0.00 C ATOM 341 C GLU A 30 -0.382 6.433 -10.508 1.00 0.00 C ATOM 342 O GLU A 30 0.372 6.009 -11.385 1.00 0.00 O ATOM 343 CB GLU A 30 -1.960 8.322 -10.980 1.00 0.00 C ATOM 344 CG GLU A 30 -1.929 8.786 -12.426 1.00 0.00 C ATOM 345 CD GLU A 30 -3.296 9.206 -12.933 1.00 0.00 C ATOM 346 OE1 GLU A 30 -4.107 9.694 -12.118 1.00 0.00 O ATOM 347 OE2 GLU A 30 -3.554 9.046 -14.144 1.00 0.00 O ATOM 0 H GLU A 30 -3.196 7.058 -9.250 1.00 0.00 H new ATOM 0 HA GLU A 30 -2.125 6.337 -11.759 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -2.895 8.647 -10.523 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -1.152 8.808 -10.434 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -1.238 9.623 -12.520 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -1.544 7.982 -13.054 1.00 0.00 H new ATOM 354 N MET A 31 -0.016 6.580 -9.240 1.00 0.00 N ATOM 355 CA MET A 31 1.327 6.250 -8.783 1.00 0.00 C ATOM 356 C MET A 31 1.548 4.744 -8.849 1.00 0.00 C ATOM 357 O MET A 31 2.573 4.275 -9.343 1.00 0.00 O ATOM 358 CB MET A 31 1.529 6.748 -7.349 1.00 0.00 C ATOM 359 CG MET A 31 2.920 6.480 -6.795 1.00 0.00 C ATOM 360 SD MET A 31 2.909 5.375 -5.368 1.00 0.00 S ATOM 361 CE MET A 31 1.560 6.056 -4.402 1.00 0.00 C ATOM 0 H MET A 31 -0.635 6.927 -8.507 1.00 0.00 H new ATOM 0 HA MET A 31 2.051 6.740 -9.433 1.00 0.00 H new ATOM 0 HB2 MET A 31 1.336 7.820 -7.316 1.00 0.00 H new ATOM 0 HB3 MET A 31 0.793 6.271 -6.702 1.00 0.00 H new ATOM 0 HG2 MET A 31 3.540 6.046 -7.579 1.00 0.00 H new ATOM 0 HG3 MET A 31 3.381 7.426 -6.512 1.00 0.00 H new ATOM 0 HE1 MET A 31 1.720 5.834 -3.347 1.00 0.00 H new ATOM 0 HE2 MET A 31 1.520 7.136 -4.543 1.00 0.00 H new ATOM 0 HE3 MET A 31 0.619 5.613 -4.728 1.00 0.00 H new ATOM 371 N ILE A 32 0.572 3.993 -8.350 1.00 0.00 N ATOM 372 CA ILE A 32 0.647 2.537 -8.349 1.00 0.00 C ATOM 373 C ILE A 32 0.721 1.988 -9.768 1.00 0.00 C ATOM 374 O ILE A 32 1.689 1.321 -10.134 1.00 0.00 O ATOM 375 CB ILE A 32 -0.570 1.916 -7.634 1.00 0.00 C ATOM 376 CG1 ILE A 32 -0.816 2.606 -6.289 1.00 0.00 C ATOM 377 CG2 ILE A 32 -0.366 0.421 -7.441 1.00 0.00 C ATOM 378 CD1 ILE A 32 0.426 2.743 -5.435 1.00 0.00 C ATOM 0 H ILE A 32 -0.282 4.370 -7.940 1.00 0.00 H new ATOM 0 HA ILE A 32 1.556 2.267 -7.811 1.00 0.00 H new ATOM 0 HB ILE A 32 -1.450 2.066 -8.259 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -1.232 3.597 -6.471 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -1.566 2.043 -5.734 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -1.234 -0.002 -6.935 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -0.243 -0.058 -8.412 1.00 0.00 H new ATOM 0 HG23 ILE A 32 0.525 0.250 -6.837 1.00 0.00 H new ATOM 0 HD11 ILE A 32 0.171 3.241 -4.499 1.00 0.00 H new ATOM 0 HD12 ILE A 32 0.831 1.754 -5.221 1.00 0.00 H new ATOM 0 HD13 ILE A 32 1.171 3.333 -5.969 1.00 0.00 H new ATOM 390 N ARG A 33 -0.305 2.271 -10.566 1.00 0.00 N ATOM 391 CA ARG A 33 -0.356 1.805 -11.944 1.00 0.00 C ATOM 392 C ARG A 33 0.923 2.171 -12.690 1.00 0.00 C ATOM 393 O ARG A 33 1.356 1.450 -13.589 1.00 0.00 O ATOM 394 CB ARG A 33 -1.571 2.400 -12.651 1.00 0.00 C ATOM 395 CG ARG A 33 -1.533 3.915 -12.761 1.00 0.00 C ATOM 396 CD ARG A 33 -1.095 4.364 -14.147 1.00 0.00 C ATOM 397 NE ARG A 33 -2.080 4.021 -15.170 1.00 0.00 N ATOM 398 CZ ARG A 33 -3.265 4.615 -15.287 1.00 0.00 C ATOM 399 NH1 ARG A 33 -3.615 5.582 -14.449 1.00 0.00 N ATOM 400 NH2 ARG A 33 -4.101 4.243 -16.247 1.00 0.00 N ATOM 0 H ARG A 33 -1.113 2.823 -10.279 1.00 0.00 H new ATOM 0 HA ARG A 33 -0.445 0.719 -11.938 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -1.643 1.974 -13.652 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -2.473 2.106 -12.114 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -2.520 4.321 -12.541 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -0.849 4.318 -12.014 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -0.935 5.442 -14.145 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -0.140 3.900 -14.393 1.00 0.00 H new ATOM 0 HE ARG A 33 -1.846 3.283 -15.834 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -2.975 5.874 -13.711 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -4.525 6.034 -14.543 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -3.836 3.502 -16.895 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -5.009 4.698 -16.337 1.00 0.00 H new ATOM 414 N GLN A 34 1.532 3.288 -12.302 1.00 0.00 N ATOM 415 CA GLN A 34 2.769 3.737 -12.926 1.00 0.00 C ATOM 416 C GLN A 34 3.947 2.910 -12.421 1.00 0.00 C ATOM 417 O GLN A 34 4.971 2.791 -13.094 1.00 0.00 O ATOM 418 CB GLN A 34 3.006 5.220 -12.634 1.00 0.00 C ATOM 419 CG GLN A 34 4.098 5.843 -13.487 1.00 0.00 C ATOM 420 CD GLN A 34 3.565 6.428 -14.780 1.00 0.00 C ATOM 421 OE1 GLN A 34 4.044 6.104 -15.867 1.00 0.00 O ATOM 422 NE2 GLN A 34 2.567 7.297 -14.669 1.00 0.00 N ATOM 0 H GLN A 34 1.188 3.897 -11.559 1.00 0.00 H new ATOM 0 HA GLN A 34 2.681 3.602 -14.004 1.00 0.00 H new ATOM 0 HB2 GLN A 34 2.076 5.766 -12.794 1.00 0.00 H new ATOM 0 HB3 GLN A 34 3.267 5.337 -11.582 1.00 0.00 H new ATOM 0 HG2 GLN A 34 4.597 6.626 -12.917 1.00 0.00 H new ATOM 0 HG3 GLN A 34 4.850 5.088 -13.717 1.00 0.00 H new ATOM 0 HE21 GLN A 34 2.200 7.537 -13.748 1.00 0.00 H new ATOM 0 HE22 GLN A 34 2.167 7.724 -15.505 1.00 0.00 H new ATOM 431 N LEU A 35 3.791 2.342 -11.227 1.00 0.00 N ATOM 432 CA LEU A 35 4.835 1.527 -10.623 1.00 0.00 C ATOM 433 C LEU A 35 4.829 0.111 -11.196 1.00 0.00 C ATOM 434 O LEU A 35 5.841 -0.590 -11.147 1.00 0.00 O ATOM 435 CB LEU A 35 4.645 1.472 -9.106 1.00 0.00 C ATOM 436 CG LEU A 35 5.120 2.709 -8.342 1.00 0.00 C ATOM 437 CD1 LEU A 35 4.999 2.488 -6.843 1.00 0.00 C ATOM 438 CD2 LEU A 35 6.552 3.052 -8.719 1.00 0.00 C ATOM 0 H LEU A 35 2.948 2.433 -10.660 1.00 0.00 H new ATOM 0 HA LEU A 35 5.797 1.986 -10.852 1.00 0.00 H new ATOM 0 HB2 LEU A 35 3.587 1.319 -8.894 1.00 0.00 H new ATOM 0 HB3 LEU A 35 5.176 0.601 -8.721 1.00 0.00 H new ATOM 0 HG LEU A 35 4.483 3.550 -8.617 1.00 0.00 H new ATOM 0 HD11 LEU A 35 5.341 3.378 -6.315 1.00 0.00 H new ATOM 0 HD12 LEU A 35 3.958 2.292 -6.587 1.00 0.00 H new ATOM 0 HD13 LEU A 35 5.611 1.635 -6.550 1.00 0.00 H new ATOM 0 HD21 LEU A 35 6.872 3.935 -8.166 1.00 0.00 H new ATOM 0 HD22 LEU A 35 7.204 2.213 -8.474 1.00 0.00 H new ATOM 0 HD23 LEU A 35 6.608 3.254 -9.789 1.00 0.00 H new ATOM 450 N GLU A 36 3.686 -0.309 -11.730 1.00 0.00 N ATOM 451 CA GLU A 36 3.554 -1.644 -12.303 1.00 0.00 C ATOM 452 C GLU A 36 4.009 -1.670 -13.758 1.00 0.00 C ATOM 453 O GLU A 36 4.677 -2.606 -14.194 1.00 0.00 O ATOM 454 CB GLU A 36 2.104 -2.125 -12.204 1.00 0.00 C ATOM 455 CG GLU A 36 1.469 -1.870 -10.847 1.00 0.00 C ATOM 456 CD GLU A 36 -0.034 -2.067 -10.861 1.00 0.00 C ATOM 457 OE1 GLU A 36 -0.480 -3.210 -11.097 1.00 0.00 O ATOM 458 OE2 GLU A 36 -0.764 -1.081 -10.635 1.00 0.00 O ATOM 0 H GLU A 36 2.838 0.256 -11.778 1.00 0.00 H new ATOM 0 HA GLU A 36 4.196 -2.315 -11.732 1.00 0.00 H new ATOM 0 HB2 GLU A 36 1.512 -1.627 -12.972 1.00 0.00 H new ATOM 0 HB3 GLU A 36 2.069 -3.193 -12.417 1.00 0.00 H new ATOM 0 HG2 GLU A 36 1.913 -2.540 -10.111 1.00 0.00 H new ATOM 0 HG3 GLU A 36 1.695 -0.852 -10.529 1.00 0.00 H new ATOM 465 N GLN A 37 3.641 -0.637 -14.504 1.00 0.00 N ATOM 466 CA GLN A 37 4.005 -0.542 -15.910 1.00 0.00 C ATOM 467 C GLN A 37 5.518 -0.450 -16.081 1.00 0.00 C ATOM 468 O GLN A 37 6.081 -1.009 -17.021 1.00 0.00 O ATOM 469 CB GLN A 37 3.332 0.674 -16.548 1.00 0.00 C ATOM 470 CG GLN A 37 3.422 1.937 -15.704 1.00 0.00 C ATOM 471 CD GLN A 37 4.038 3.100 -16.457 1.00 0.00 C ATOM 472 OE1 GLN A 37 3.331 3.977 -16.953 1.00 0.00 O ATOM 473 NE2 GLN A 37 5.363 3.112 -16.546 1.00 0.00 N ATOM 0 H GLN A 37 3.090 0.148 -14.157 1.00 0.00 H new ATOM 0 HA GLN A 37 3.660 -1.447 -16.410 1.00 0.00 H new ATOM 0 HB2 GLN A 37 3.790 0.863 -17.519 1.00 0.00 H new ATOM 0 HB3 GLN A 37 2.282 0.443 -16.730 1.00 0.00 H new ATOM 0 HG2 GLN A 37 2.424 2.216 -15.366 1.00 0.00 H new ATOM 0 HG3 GLN A 37 4.014 1.732 -14.812 1.00 0.00 H new ATOM 0 HE21 GLN A 37 5.910 2.364 -16.119 1.00 0.00 H new ATOM 0 HE22 GLN A 37 5.834 3.869 -17.041 1.00 0.00 H new ATOM 555 N LEU A 42 6.565 -6.109 -10.539 1.00 0.00 N ATOM 556 CA LEU A 42 5.710 -5.558 -9.494 1.00 0.00 C ATOM 557 C LEU A 42 4.236 -5.765 -9.825 1.00 0.00 C ATOM 558 O LEU A 42 3.780 -5.426 -10.916 1.00 0.00 O ATOM 559 CB LEU A 42 5.995 -4.068 -9.303 1.00 0.00 C ATOM 560 CG LEU A 42 5.369 -3.445 -8.052 1.00 0.00 C ATOM 561 CD1 LEU A 42 6.378 -3.405 -6.914 1.00 0.00 C ATOM 562 CD2 LEU A 42 4.845 -2.047 -8.353 1.00 0.00 C ATOM 0 HA LEU A 42 5.932 -6.086 -8.567 1.00 0.00 H new ATOM 0 HB2 LEU A 42 7.074 -3.922 -9.262 1.00 0.00 H new ATOM 0 HB3 LEU A 42 5.634 -3.529 -10.179 1.00 0.00 H new ATOM 0 HG LEU A 42 4.528 -4.066 -7.744 1.00 0.00 H new ATOM 0 HD11 LEU A 42 5.916 -2.959 -6.033 1.00 0.00 H new ATOM 0 HD12 LEU A 42 6.702 -4.419 -6.680 1.00 0.00 H new ATOM 0 HD13 LEU A 42 7.240 -2.808 -7.213 1.00 0.00 H new ATOM 0 HD21 LEU A 42 4.404 -1.622 -7.451 1.00 0.00 H new ATOM 0 HD22 LEU A 42 5.667 -1.415 -8.688 1.00 0.00 H new ATOM 0 HD23 LEU A 42 4.088 -2.103 -9.135 1.00 0.00 H new ATOM 574 N LYS A 43 3.498 -6.326 -8.872 1.00 0.00 N ATOM 575 CA LYS A 43 2.075 -6.581 -9.055 1.00 0.00 C ATOM 576 C LYS A 43 1.278 -6.107 -7.843 1.00 0.00 C ATOM 577 O LYS A 43 1.084 -6.854 -6.883 1.00 0.00 O ATOM 578 CB LYS A 43 1.827 -8.072 -9.291 1.00 0.00 C ATOM 579 CG LYS A 43 2.430 -8.590 -10.587 1.00 0.00 C ATOM 580 CD LYS A 43 1.783 -7.942 -11.802 1.00 0.00 C ATOM 581 CE LYS A 43 2.825 -7.379 -12.760 1.00 0.00 C ATOM 582 NZ LYS A 43 2.597 -7.831 -14.161 1.00 0.00 N ATOM 0 H LYS A 43 3.864 -6.613 -7.964 1.00 0.00 H new ATOM 0 HA LYS A 43 1.741 -6.022 -9.929 1.00 0.00 H new ATOM 0 HB2 LYS A 43 2.240 -8.637 -8.456 1.00 0.00 H new ATOM 0 HB3 LYS A 43 0.753 -8.256 -9.300 1.00 0.00 H new ATOM 0 HG2 LYS A 43 3.502 -8.392 -10.595 1.00 0.00 H new ATOM 0 HG3 LYS A 43 2.305 -9.672 -10.641 1.00 0.00 H new ATOM 0 HD2 LYS A 43 1.169 -8.677 -12.323 1.00 0.00 H new ATOM 0 HD3 LYS A 43 1.117 -7.142 -11.477 1.00 0.00 H new ATOM 0 HE2 LYS A 43 2.801 -6.290 -12.722 1.00 0.00 H new ATOM 0 HE3 LYS A 43 3.819 -7.688 -12.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 3.407 -8.401 -14.478 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 1.731 -8.406 -14.204 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 2.493 -7.002 -14.781 1.00 0.00 H new ATOM 596 N LEU A 44 0.821 -4.861 -7.894 1.00 0.00 N ATOM 597 CA LEU A 44 0.045 -4.287 -6.803 1.00 0.00 C ATOM 598 C LEU A 44 -1.449 -4.490 -7.041 1.00 0.00 C ATOM 599 O LEU A 44 -1.863 -4.848 -8.143 1.00 0.00 O ATOM 600 CB LEU A 44 0.356 -2.798 -6.655 1.00 0.00 C ATOM 601 CG LEU A 44 1.549 -2.477 -5.754 1.00 0.00 C ATOM 602 CD1 LEU A 44 2.161 -1.138 -6.131 1.00 0.00 C ATOM 603 CD2 LEU A 44 1.125 -2.475 -4.295 1.00 0.00 C ATOM 0 H LEU A 44 0.975 -4.229 -8.680 1.00 0.00 H new ATOM 0 HA LEU A 44 0.322 -4.798 -5.881 1.00 0.00 H new ATOM 0 HB2 LEU A 44 0.544 -2.381 -7.644 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -0.526 -2.295 -6.259 1.00 0.00 H new ATOM 0 HG LEU A 44 2.304 -3.250 -5.895 1.00 0.00 H new ATOM 0 HD11 LEU A 44 3.008 -0.928 -5.478 1.00 0.00 H new ATOM 0 HD12 LEU A 44 2.500 -1.172 -7.166 1.00 0.00 H new ATOM 0 HD13 LEU A 44 1.414 -0.352 -6.020 1.00 0.00 H new ATOM 0 HD21 LEU A 44 1.985 -2.245 -3.666 1.00 0.00 H new ATOM 0 HD22 LEU A 44 0.352 -1.722 -4.142 1.00 0.00 H new ATOM 0 HD23 LEU A 44 0.733 -3.457 -4.029 1.00 0.00 H new ATOM 615 N CYS A 45 -2.252 -4.266 -6.007 1.00 0.00 N ATOM 616 CA CYS A 45 -3.697 -4.436 -6.125 1.00 0.00 C ATOM 617 C CYS A 45 -4.451 -3.381 -5.321 1.00 0.00 C ATOM 618 O CYS A 45 -3.888 -2.739 -4.438 1.00 0.00 O ATOM 619 CB CYS A 45 -4.104 -5.832 -5.659 1.00 0.00 C ATOM 620 SG CYS A 45 -3.399 -7.185 -6.654 1.00 0.00 S ATOM 0 H CYS A 45 -1.932 -3.969 -5.085 1.00 0.00 H new ATOM 0 HA CYS A 45 -3.961 -4.314 -7.176 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -3.797 -5.961 -4.621 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -5.191 -5.908 -5.681 1.00 0.00 H new ATOM 0 HG CYS A 45 -2.721 -6.687 -7.645 1.00 0.00 H new ATOM 625 N VAL A 46 -5.732 -3.215 -5.637 1.00 0.00 N ATOM 626 CA VAL A 46 -6.573 -2.246 -4.947 1.00 0.00 C ATOM 627 C VAL A 46 -7.967 -2.819 -4.698 1.00 0.00 C ATOM 628 O VAL A 46 -8.226 -3.988 -4.980 1.00 0.00 O ATOM 629 CB VAL A 46 -6.695 -0.930 -5.743 1.00 0.00 C ATOM 630 CG1 VAL A 46 -5.317 -0.346 -6.021 1.00 0.00 C ATOM 631 CG2 VAL A 46 -7.463 -1.148 -7.043 1.00 0.00 C ATOM 0 H VAL A 46 -6.210 -3.741 -6.369 1.00 0.00 H new ATOM 0 HA VAL A 46 -6.094 -2.030 -3.992 1.00 0.00 H new ATOM 0 HB VAL A 46 -7.255 -0.217 -5.139 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -5.422 0.582 -6.583 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -4.811 -0.143 -5.077 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -4.731 -1.058 -6.602 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -7.535 -0.205 -7.585 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -6.939 -1.881 -7.657 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -8.465 -1.514 -6.817 1.00 0.00 H new ATOM 641 N SER A 47 -8.859 -1.987 -4.174 1.00 0.00 N ATOM 642 CA SER A 47 -10.224 -2.415 -3.897 1.00 0.00 C ATOM 643 C SER A 47 -11.030 -2.526 -5.187 1.00 0.00 C ATOM 644 O SER A 47 -10.657 -1.960 -6.214 1.00 0.00 O ATOM 645 CB SER A 47 -10.899 -1.434 -2.938 1.00 0.00 C ATOM 646 OG SER A 47 -11.471 -0.341 -3.637 1.00 0.00 O ATOM 0 H SER A 47 -8.662 -1.016 -3.933 1.00 0.00 H new ATOM 0 HA SER A 47 -10.186 -3.399 -3.431 1.00 0.00 H new ATOM 0 HB2 SER A 47 -11.673 -1.951 -2.371 1.00 0.00 H new ATOM 0 HB3 SER A 47 -10.169 -1.066 -2.218 1.00 0.00 H new ATOM 0 HG SER A 47 -11.897 0.269 -2.999 1.00 0.00 H new ATOM 781 N VAL A 57 -8.593 -1.011 -14.665 1.00 0.00 N ATOM 782 CA VAL A 57 -7.500 -0.804 -13.724 1.00 0.00 C ATOM 783 C VAL A 57 -7.163 -2.090 -12.977 1.00 0.00 C ATOM 784 O VAL A 57 -7.931 -3.053 -12.995 1.00 0.00 O ATOM 785 CB VAL A 57 -7.842 0.293 -12.698 1.00 0.00 C ATOM 786 CG1 VAL A 57 -7.936 1.650 -13.377 1.00 0.00 C ATOM 787 CG2 VAL A 57 -9.136 -0.039 -11.971 1.00 0.00 C ATOM 0 HA VAL A 57 -6.637 -0.490 -14.310 1.00 0.00 H new ATOM 0 HB VAL A 57 -7.040 0.337 -11.961 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -8.178 2.412 -12.636 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -6.981 1.890 -13.845 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -8.716 1.623 -14.138 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -9.361 0.748 -11.251 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -9.950 -0.114 -12.692 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -9.026 -0.989 -11.448 1.00 0.00 H new ATOM 797 N TRP A 58 -6.009 -2.096 -12.316 1.00 0.00 N ATOM 798 CA TRP A 58 -5.564 -3.254 -11.557 1.00 0.00 C ATOM 799 C TRP A 58 -6.225 -3.281 -10.183 1.00 0.00 C ATOM 800 O TRP A 58 -6.015 -2.383 -9.368 1.00 0.00 O ATOM 801 CB TRP A 58 -4.042 -3.219 -11.410 1.00 0.00 C ATOM 802 CG TRP A 58 -3.410 -4.572 -11.443 1.00 0.00 C ATOM 803 CD1 TRP A 58 -3.733 -5.639 -10.662 1.00 0.00 C ATOM 804 CD2 TRP A 58 -2.347 -5.006 -12.300 1.00 0.00 C ATOM 805 NE1 TRP A 58 -2.934 -6.714 -10.974 1.00 0.00 N ATOM 806 CE2 TRP A 58 -2.075 -6.349 -11.980 1.00 0.00 C ATOM 807 CE3 TRP A 58 -1.599 -4.389 -13.306 1.00 0.00 C ATOM 808 CZ2 TRP A 58 -1.088 -7.085 -12.629 1.00 0.00 C ATOM 809 CZ3 TRP A 58 -0.619 -5.120 -13.951 1.00 0.00 C ATOM 810 CH2 TRP A 58 -0.372 -6.457 -13.610 1.00 0.00 C ATOM 0 H TRP A 58 -5.364 -1.306 -12.293 1.00 0.00 H new ATOM 0 HA TRP A 58 -5.852 -4.158 -12.093 1.00 0.00 H new ATOM 0 HB2 TRP A 58 -3.621 -2.610 -12.210 1.00 0.00 H new ATOM 0 HB3 TRP A 58 -3.787 -2.730 -10.470 1.00 0.00 H new ATOM 0 HD1 TRP A 58 -4.505 -5.641 -9.907 1.00 0.00 H new ATOM 0 HE1 TRP A 58 -2.973 -7.632 -10.531 1.00 0.00 H new ATOM 0 HE3 TRP A 58 -1.783 -3.359 -13.575 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 -0.895 -8.115 -12.367 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 -0.034 -4.654 -14.730 1.00 0.00 H new ATOM 0 HH2 TRP A 58 0.400 -7.002 -14.133 1.00 0.00 H new ATOM 821 N SER A 59 -7.032 -4.308 -9.933 1.00 0.00 N ATOM 822 CA SER A 59 -7.727 -4.434 -8.656 1.00 0.00 C ATOM 823 C SER A 59 -7.769 -5.885 -8.186 1.00 0.00 C ATOM 824 O SER A 59 -7.489 -6.807 -8.951 1.00 0.00 O ATOM 825 CB SER A 59 -9.150 -3.885 -8.775 1.00 0.00 C ATOM 826 OG SER A 59 -9.817 -4.436 -9.896 1.00 0.00 O ATOM 0 H SER A 59 -7.220 -5.062 -10.594 1.00 0.00 H new ATOM 0 HA SER A 59 -7.175 -3.854 -7.917 1.00 0.00 H new ATOM 0 HB2 SER A 59 -9.708 -4.114 -7.867 1.00 0.00 H new ATOM 0 HB3 SER A 59 -9.118 -2.799 -8.865 1.00 0.00 H new ATOM 0 HG SER A 59 -10.725 -4.071 -9.949 1.00 0.00 H new ATOM 832 N ILE A 60 -8.125 -6.077 -6.918 1.00 0.00 N ATOM 833 CA ILE A 60 -8.211 -7.411 -6.338 1.00 0.00 C ATOM 834 C ILE A 60 -9.184 -7.437 -5.161 1.00 0.00 C ATOM 835 O ILE A 60 -9.382 -6.426 -4.487 1.00 0.00 O ATOM 836 CB ILE A 60 -6.826 -7.913 -5.861 1.00 0.00 C ATOM 837 CG1 ILE A 60 -6.745 -9.439 -5.973 1.00 0.00 C ATOM 838 CG2 ILE A 60 -6.547 -7.464 -4.429 1.00 0.00 C ATOM 839 CD1 ILE A 60 -5.686 -10.061 -5.084 1.00 0.00 C ATOM 0 H ILE A 60 -8.359 -5.322 -6.273 1.00 0.00 H new ATOM 0 HA ILE A 60 -8.576 -8.073 -7.123 1.00 0.00 H new ATOM 0 HB ILE A 60 -6.063 -7.476 -6.506 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -7.716 -9.865 -5.719 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -6.540 -9.708 -7.009 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -5.568 -7.829 -4.117 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -6.561 -6.375 -4.380 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -7.313 -7.867 -3.766 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -5.688 -11.143 -5.218 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -4.707 -9.664 -5.352 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -5.901 -9.824 -4.042 1.00 0.00 H new ATOM 851 N ALA A 61 -9.776 -8.599 -4.910 1.00 0.00 N ATOM 852 CA ALA A 61 -10.709 -8.748 -3.802 1.00 0.00 C ATOM 853 C ALA A 61 -9.980 -8.576 -2.474 1.00 0.00 C ATOM 854 O ALA A 61 -8.894 -9.120 -2.277 1.00 0.00 O ATOM 855 CB ALA A 61 -11.396 -10.104 -3.865 1.00 0.00 C ATOM 0 H ALA A 61 -9.627 -9.447 -5.456 1.00 0.00 H new ATOM 0 HA ALA A 61 -11.473 -7.974 -3.881 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -12.090 -10.199 -3.030 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -11.943 -10.191 -4.804 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -10.647 -10.894 -3.807 1.00 0.00 H new ATOM 861 N SER A 62 -10.575 -7.808 -1.568 1.00 0.00 N ATOM 862 CA SER A 62 -9.971 -7.559 -0.263 1.00 0.00 C ATOM 863 C SER A 62 -9.639 -8.862 0.460 1.00 0.00 C ATOM 864 O SER A 62 -8.775 -8.890 1.335 1.00 0.00 O ATOM 865 CB SER A 62 -10.901 -6.704 0.598 1.00 0.00 C ATOM 866 OG SER A 62 -11.905 -7.499 1.207 1.00 0.00 O ATOM 0 H SER A 62 -11.474 -7.347 -1.712 1.00 0.00 H new ATOM 0 HA SER A 62 -9.038 -7.020 -0.428 1.00 0.00 H new ATOM 0 HB2 SER A 62 -10.322 -6.192 1.366 1.00 0.00 H new ATOM 0 HB3 SER A 62 -11.366 -5.934 -0.017 1.00 0.00 H new ATOM 0 HG SER A 62 -12.486 -6.930 1.754 1.00 0.00 H new ATOM 872 N GLU A 63 -10.320 -9.941 0.086 1.00 0.00 N ATOM 873 CA GLU A 63 -10.081 -11.239 0.702 1.00 0.00 C ATOM 874 C GLU A 63 -8.890 -11.937 0.046 1.00 0.00 C ATOM 875 O GLU A 63 -8.458 -13.000 0.491 1.00 0.00 O ATOM 876 CB GLU A 63 -11.328 -12.120 0.592 1.00 0.00 C ATOM 877 CG GLU A 63 -11.902 -12.188 -0.813 1.00 0.00 C ATOM 878 CD GLU A 63 -12.919 -13.300 -0.973 1.00 0.00 C ATOM 879 OE1 GLU A 63 -13.738 -13.495 -0.050 1.00 0.00 O ATOM 880 OE2 GLU A 63 -12.898 -13.978 -2.022 1.00 0.00 O ATOM 0 H GLU A 63 -11.039 -9.941 -0.638 1.00 0.00 H new ATOM 0 HA GLU A 63 -9.854 -11.078 1.756 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -11.081 -13.128 0.924 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -12.092 -11.740 1.270 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -12.370 -11.234 -1.057 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -11.091 -12.337 -1.526 1.00 0.00 H new ATOM 887 N LEU A 64 -8.371 -11.332 -1.019 1.00 0.00 N ATOM 888 CA LEU A 64 -7.244 -11.883 -1.745 1.00 0.00 C ATOM 889 C LEU A 64 -5.930 -11.234 -1.313 1.00 0.00 C ATOM 890 O LEU A 64 -4.854 -11.642 -1.751 1.00 0.00 O ATOM 891 CB LEU A 64 -7.461 -11.664 -3.239 1.00 0.00 C ATOM 892 CG LEU A 64 -8.657 -12.409 -3.832 1.00 0.00 C ATOM 893 CD1 LEU A 64 -8.776 -12.129 -5.321 1.00 0.00 C ATOM 894 CD2 LEU A 64 -8.526 -13.901 -3.578 1.00 0.00 C ATOM 0 H LEU A 64 -8.721 -10.452 -1.397 1.00 0.00 H new ATOM 0 HA LEU A 64 -7.177 -12.948 -1.525 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -7.590 -10.597 -3.420 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -6.560 -11.971 -3.771 1.00 0.00 H new ATOM 0 HG LEU A 64 -9.564 -12.052 -3.344 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -9.633 -12.668 -5.725 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -8.912 -11.059 -5.480 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -7.869 -12.459 -5.827 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -9.384 -14.420 -4.005 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -7.611 -14.270 -4.042 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -8.488 -14.085 -2.504 1.00 0.00 H new ATOM 906 N ILE A 65 -6.019 -10.217 -0.461 1.00 0.00 N ATOM 907 CA ILE A 65 -4.833 -9.514 0.012 1.00 0.00 C ATOM 908 C ILE A 65 -4.060 -10.339 1.036 1.00 0.00 C ATOM 909 O ILE A 65 -2.914 -10.723 0.801 1.00 0.00 O ATOM 910 CB ILE A 65 -5.199 -8.156 0.639 1.00 0.00 C ATOM 911 CG1 ILE A 65 -6.145 -7.381 -0.281 1.00 0.00 C ATOM 912 CG2 ILE A 65 -3.941 -7.345 0.918 1.00 0.00 C ATOM 913 CD1 ILE A 65 -6.746 -6.153 0.365 1.00 0.00 C ATOM 0 H ILE A 65 -6.898 -9.863 -0.085 1.00 0.00 H new ATOM 0 HA ILE A 65 -4.202 -9.350 -0.862 1.00 0.00 H new ATOM 0 HB ILE A 65 -5.710 -8.336 1.585 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -5.602 -7.081 -1.177 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -6.949 -8.043 -0.602 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -4.216 -6.388 1.361 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -3.300 -7.894 1.608 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -3.405 -7.172 -0.015 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -7.405 -5.654 -0.345 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -7.317 -6.448 1.245 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -5.949 -5.471 0.661 1.00 0.00 H new ATOM 925 N GLU A 66 -4.692 -10.604 2.172 1.00 0.00 N ATOM 926 CA GLU A 66 -4.067 -11.377 3.235 1.00 0.00 C ATOM 927 C GLU A 66 -3.696 -12.781 2.762 1.00 0.00 C ATOM 928 O GLU A 66 -2.880 -13.457 3.389 1.00 0.00 O ATOM 929 CB GLU A 66 -5.006 -11.463 4.438 1.00 0.00 C ATOM 930 CG GLU A 66 -6.443 -11.791 4.070 1.00 0.00 C ATOM 931 CD GLU A 66 -7.082 -12.776 5.031 1.00 0.00 C ATOM 932 OE1 GLU A 66 -6.434 -13.793 5.355 1.00 0.00 O ATOM 933 OE2 GLU A 66 -8.229 -12.527 5.459 1.00 0.00 O ATOM 0 H GLU A 66 -5.641 -10.293 2.380 1.00 0.00 H new ATOM 0 HA GLU A 66 -3.148 -10.867 3.525 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -4.634 -12.223 5.124 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -4.985 -10.513 4.972 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -7.029 -10.872 4.055 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -6.471 -12.203 3.061 1.00 0.00 H new ATOM 940 N LYS A 67 -4.302 -13.222 1.662 1.00 0.00 N ATOM 941 CA LYS A 67 -4.030 -14.551 1.126 1.00 0.00 C ATOM 942 C LYS A 67 -3.043 -14.497 -0.037 1.00 0.00 C ATOM 943 O LYS A 67 -2.000 -15.150 -0.008 1.00 0.00 O ATOM 944 CB LYS A 67 -5.332 -15.214 0.672 1.00 0.00 C ATOM 945 CG LYS A 67 -6.411 -15.233 1.743 1.00 0.00 C ATOM 946 CD LYS A 67 -6.681 -16.644 2.240 1.00 0.00 C ATOM 947 CE LYS A 67 -7.711 -17.349 1.374 1.00 0.00 C ATOM 948 NZ LYS A 67 -7.590 -18.831 1.460 1.00 0.00 N ATOM 0 H LYS A 67 -4.981 -12.681 1.127 1.00 0.00 H new ATOM 0 HA LYS A 67 -3.579 -15.143 1.923 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -5.711 -14.689 -0.205 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -5.120 -16.238 0.363 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -6.105 -14.604 2.579 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -7.330 -14.806 1.342 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -5.752 -17.215 2.241 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -7.034 -16.607 3.271 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -8.712 -17.048 1.683 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -7.590 -17.035 0.337 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -8.311 -19.274 0.855 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -6.644 -19.121 1.141 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -7.731 -19.134 2.445 1.00 0.00 H new ATOM 962 N ARG A 68 -3.382 -13.725 -1.065 1.00 0.00 N ATOM 963 CA ARG A 68 -2.525 -13.603 -2.242 1.00 0.00 C ATOM 964 C ARG A 68 -1.433 -12.558 -2.032 1.00 0.00 C ATOM 965 O ARG A 68 -0.245 -12.877 -2.067 1.00 0.00 O ATOM 966 CB ARG A 68 -3.360 -13.248 -3.476 1.00 0.00 C ATOM 967 CG ARG A 68 -4.683 -13.992 -3.548 1.00 0.00 C ATOM 968 CD ARG A 68 -5.116 -14.232 -4.987 1.00 0.00 C ATOM 969 NE ARG A 68 -5.438 -15.635 -5.233 1.00 0.00 N ATOM 970 CZ ARG A 68 -6.186 -16.059 -6.249 1.00 0.00 C ATOM 971 NH1 ARG A 68 -6.689 -15.191 -7.120 1.00 0.00 N ATOM 972 NH2 ARG A 68 -6.429 -17.354 -6.396 1.00 0.00 N ATOM 0 H ARG A 68 -4.241 -13.176 -1.108 1.00 0.00 H new ATOM 0 HA ARG A 68 -2.043 -14.568 -2.401 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -3.555 -12.176 -3.477 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -2.780 -13.467 -4.373 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -4.592 -14.947 -3.031 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -5.451 -13.420 -3.027 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -5.986 -13.615 -5.212 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -4.320 -13.919 -5.663 1.00 0.00 H new ATOM 0 HE ARG A 68 -5.067 -16.332 -4.587 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -6.503 -14.194 -7.012 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -7.262 -15.522 -7.897 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -6.043 -18.024 -5.731 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -7.002 -17.680 -7.174 1.00 0.00 H new ATOM 986 N CYS A 69 -1.837 -11.309 -1.818 1.00 0.00 N ATOM 987 CA CYS A 69 -0.880 -10.225 -1.610 1.00 0.00 C ATOM 988 C CYS A 69 0.055 -10.537 -0.446 1.00 0.00 C ATOM 989 O CYS A 69 -0.376 -11.035 0.594 1.00 0.00 O ATOM 990 CB CYS A 69 -1.614 -8.908 -1.353 1.00 0.00 C ATOM 991 SG CYS A 69 -2.614 -8.336 -2.747 1.00 0.00 S ATOM 0 H CYS A 69 -2.815 -11.023 -1.784 1.00 0.00 H new ATOM 0 HA CYS A 69 -0.281 -10.127 -2.515 1.00 0.00 H new ATOM 0 HB2 CYS A 69 -2.259 -9.028 -0.482 1.00 0.00 H new ATOM 0 HB3 CYS A 69 -0.882 -8.139 -1.105 1.00 0.00 H new ATOM 0 HG CYS A 69 -2.028 -7.325 -3.316 1.00 0.00 H new ATOM 997 N ARG A 70 1.338 -10.243 -0.631 1.00 0.00 N ATOM 998 CA ARG A 70 2.336 -10.496 0.401 1.00 0.00 C ATOM 999 C ARG A 70 2.537 -9.266 1.281 1.00 0.00 C ATOM 1000 O ARG A 70 2.628 -9.373 2.505 1.00 0.00 O ATOM 1001 CB ARG A 70 3.664 -10.907 -0.238 1.00 0.00 C ATOM 1002 CG ARG A 70 4.208 -12.229 0.285 1.00 0.00 C ATOM 1003 CD ARG A 70 5.580 -12.062 0.919 1.00 0.00 C ATOM 1004 NE ARG A 70 6.552 -13.012 0.380 1.00 0.00 N ATOM 1005 CZ ARG A 70 7.870 -12.875 0.504 1.00 0.00 C ATOM 1006 NH1 ARG A 70 8.379 -11.829 1.145 1.00 0.00 N ATOM 1007 NH2 ARG A 70 8.683 -13.785 -0.015 1.00 0.00 N ATOM 0 H ARG A 70 1.710 -9.829 -1.486 1.00 0.00 H new ATOM 0 HA ARG A 70 1.975 -11.310 1.029 1.00 0.00 H new ATOM 0 HB2 ARG A 70 3.531 -10.980 -1.317 1.00 0.00 H new ATOM 0 HB3 ARG A 70 4.401 -10.124 -0.060 1.00 0.00 H new ATOM 0 HG2 ARG A 70 3.516 -12.642 1.019 1.00 0.00 H new ATOM 0 HG3 ARG A 70 4.270 -12.946 -0.534 1.00 0.00 H new ATOM 0 HD2 ARG A 70 5.935 -11.045 0.751 1.00 0.00 H new ATOM 0 HD3 ARG A 70 5.500 -12.198 1.998 1.00 0.00 H new ATOM 0 HE ARG A 70 6.199 -13.828 -0.121 1.00 0.00 H new ATOM 0 HH11 ARG A 70 7.759 -11.125 1.546 1.00 0.00 H new ATOM 0 HH12 ARG A 70 9.390 -11.730 1.237 1.00 0.00 H new ATOM 0 HH21 ARG A 70 8.298 -14.590 -0.509 1.00 0.00 H new ATOM 0 HH22 ARG A 70 9.693 -13.680 0.080 1.00 0.00 H new ATOM 1021 N ARG A 71 2.606 -8.096 0.651 1.00 0.00 N ATOM 1022 CA ARG A 71 2.797 -6.847 1.378 1.00 0.00 C ATOM 1023 C ARG A 71 1.658 -5.869 1.099 1.00 0.00 C ATOM 1024 O ARG A 71 0.843 -6.088 0.201 1.00 0.00 O ATOM 1025 CB ARG A 71 4.141 -6.210 1.011 1.00 0.00 C ATOM 1026 CG ARG A 71 4.507 -6.351 -0.460 1.00 0.00 C ATOM 1027 CD ARG A 71 5.549 -7.437 -0.685 1.00 0.00 C ATOM 1028 NE ARG A 71 6.748 -7.237 0.127 1.00 0.00 N ATOM 1029 CZ ARG A 71 7.003 -7.890 1.261 1.00 0.00 C ATOM 1030 NH1 ARG A 71 6.127 -8.760 1.752 1.00 0.00 N ATOM 1031 NH2 ARG A 71 8.136 -7.667 1.910 1.00 0.00 N ATOM 0 H ARG A 71 2.532 -7.988 -0.361 1.00 0.00 H new ATOM 0 HA ARG A 71 2.797 -7.078 2.443 1.00 0.00 H new ATOM 0 HB2 ARG A 71 4.113 -5.151 1.269 1.00 0.00 H new ATOM 0 HB3 ARG A 71 4.925 -6.665 1.616 1.00 0.00 H new ATOM 0 HG2 ARG A 71 3.611 -6.583 -1.036 1.00 0.00 H new ATOM 0 HG3 ARG A 71 4.888 -5.400 -0.832 1.00 0.00 H new ATOM 0 HD2 ARG A 71 5.113 -8.408 -0.451 1.00 0.00 H new ATOM 0 HD3 ARG A 71 5.827 -7.457 -1.739 1.00 0.00 H new ATOM 0 HE ARG A 71 7.434 -6.554 -0.195 1.00 0.00 H new ATOM 0 HH11 ARG A 71 5.250 -8.933 1.261 1.00 0.00 H new ATOM 0 HH12 ARG A 71 6.331 -9.255 2.620 1.00 0.00 H new ATOM 0 HH21 ARG A 71 8.811 -6.997 1.542 1.00 0.00 H new ATOM 0 HH22 ARG A 71 8.333 -8.165 2.778 1.00 0.00 H new ATOM 1045 N MET A 72 1.604 -4.793 1.873 1.00 0.00 N ATOM 1046 CA MET A 72 0.559 -3.790 1.706 1.00 0.00 C ATOM 1047 C MET A 72 1.146 -2.383 1.647 1.00 0.00 C ATOM 1048 O MET A 72 2.236 -2.127 2.161 1.00 0.00 O ATOM 1049 CB MET A 72 -0.455 -3.887 2.851 1.00 0.00 C ATOM 1050 CG MET A 72 -1.847 -4.289 2.396 1.00 0.00 C ATOM 1051 SD MET A 72 -2.949 -4.656 3.776 1.00 0.00 S ATOM 1052 CE MET A 72 -2.963 -6.446 3.731 1.00 0.00 C ATOM 0 H MET A 72 2.269 -4.592 2.620 1.00 0.00 H new ATOM 0 HA MET A 72 0.054 -3.986 0.760 1.00 0.00 H new ATOM 0 HB2 MET A 72 -0.097 -4.612 3.582 1.00 0.00 H new ATOM 0 HB3 MET A 72 -0.511 -2.924 3.358 1.00 0.00 H new ATOM 0 HG2 MET A 72 -2.276 -3.485 1.797 1.00 0.00 H new ATOM 0 HG3 MET A 72 -1.776 -5.164 1.750 1.00 0.00 H new ATOM 0 HE1 MET A 72 -3.977 -6.797 3.537 1.00 0.00 H new ATOM 0 HE2 MET A 72 -2.300 -6.795 2.939 1.00 0.00 H new ATOM 0 HE3 MET A 72 -2.621 -6.837 4.689 1.00 0.00 H new ATOM 1062 N VAL A 73 0.407 -1.474 1.023 1.00 0.00 N ATOM 1063 CA VAL A 73 0.835 -0.090 0.901 1.00 0.00 C ATOM 1064 C VAL A 73 -0.292 0.842 1.321 1.00 0.00 C ATOM 1065 O VAL A 73 -1.179 1.158 0.528 1.00 0.00 O ATOM 1066 CB VAL A 73 1.267 0.241 -0.544 1.00 0.00 C ATOM 1067 CG1 VAL A 73 1.699 1.695 -0.661 1.00 0.00 C ATOM 1068 CG2 VAL A 73 2.383 -0.690 -0.992 1.00 0.00 C ATOM 0 H VAL A 73 -0.496 -1.674 0.592 1.00 0.00 H new ATOM 0 HA VAL A 73 1.694 0.052 1.556 1.00 0.00 H new ATOM 0 HB VAL A 73 0.409 0.091 -1.200 1.00 0.00 H new ATOM 0 HG11 VAL A 73 1.999 1.904 -1.688 1.00 0.00 H new ATOM 0 HG12 VAL A 73 0.868 2.345 -0.386 1.00 0.00 H new ATOM 0 HG13 VAL A 73 2.540 1.880 0.007 1.00 0.00 H new ATOM 0 HG21 VAL A 73 2.675 -0.443 -2.013 1.00 0.00 H new ATOM 0 HG22 VAL A 73 3.241 -0.574 -0.330 1.00 0.00 H new ATOM 0 HG23 VAL A 73 2.033 -1.722 -0.955 1.00 0.00 H new ATOM 1078 N VAL A 74 -0.261 1.268 2.579 1.00 0.00 N ATOM 1079 CA VAL A 74 -1.287 2.148 3.108 1.00 0.00 C ATOM 1080 C VAL A 74 -0.897 3.612 2.955 1.00 0.00 C ATOM 1081 O VAL A 74 0.281 3.963 3.012 1.00 0.00 O ATOM 1082 CB VAL A 74 -1.570 1.858 4.594 1.00 0.00 C ATOM 1083 CG1 VAL A 74 -2.524 0.682 4.739 1.00 0.00 C ATOM 1084 CG2 VAL A 74 -0.280 1.601 5.358 1.00 0.00 C ATOM 0 H VAL A 74 0.466 1.016 3.249 1.00 0.00 H new ATOM 0 HA VAL A 74 -2.190 1.955 2.529 1.00 0.00 H new ATOM 0 HB VAL A 74 -2.044 2.740 5.024 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -2.711 0.493 5.796 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -3.465 0.913 4.240 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -2.081 -0.204 4.285 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -0.511 1.399 6.404 1.00 0.00 H new ATOM 0 HG22 VAL A 74 0.233 0.741 4.927 1.00 0.00 H new ATOM 0 HG23 VAL A 74 0.363 2.478 5.291 1.00 0.00 H new ATOM 1094 N VAL A 75 -1.897 4.460 2.758 1.00 0.00 N ATOM 1095 CA VAL A 75 -1.668 5.888 2.600 1.00 0.00 C ATOM 1096 C VAL A 75 -2.360 6.666 3.717 1.00 0.00 C ATOM 1097 O VAL A 75 -3.570 6.891 3.674 1.00 0.00 O ATOM 1098 CB VAL A 75 -2.169 6.382 1.225 1.00 0.00 C ATOM 1099 CG1 VAL A 75 -2.121 7.902 1.137 1.00 0.00 C ATOM 1100 CG2 VAL A 75 -1.350 5.755 0.107 1.00 0.00 C ATOM 0 H VAL A 75 -2.877 4.182 2.704 1.00 0.00 H new ATOM 0 HA VAL A 75 -0.594 6.063 2.658 1.00 0.00 H new ATOM 0 HB VAL A 75 -3.208 6.073 1.112 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -2.479 8.221 0.158 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -2.754 8.332 1.913 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -1.095 8.242 1.276 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -1.715 6.113 -0.856 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -0.302 6.032 0.224 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -1.445 4.670 0.151 1.00 0.00 H new ATOM 1110 N VAL A 76 -1.585 7.066 4.720 1.00 0.00 N ATOM 1111 CA VAL A 76 -2.122 7.808 5.855 1.00 0.00 C ATOM 1112 C VAL A 76 -2.226 9.298 5.546 1.00 0.00 C ATOM 1113 O VAL A 76 -1.316 10.067 5.846 1.00 0.00 O ATOM 1114 CB VAL A 76 -1.256 7.609 7.118 1.00 0.00 C ATOM 1115 CG1 VAL A 76 0.180 8.039 6.860 1.00 0.00 C ATOM 1116 CG2 VAL A 76 -1.845 8.366 8.300 1.00 0.00 C ATOM 0 H VAL A 76 -0.582 6.888 4.770 1.00 0.00 H new ATOM 0 HA VAL A 76 -3.121 7.414 6.044 1.00 0.00 H new ATOM 0 HB VAL A 76 -1.252 6.547 7.364 1.00 0.00 H new ATOM 0 HG11 VAL A 76 0.772 7.890 7.763 1.00 0.00 H new ATOM 0 HG12 VAL A 76 0.598 7.442 6.049 1.00 0.00 H new ATOM 0 HG13 VAL A 76 0.200 9.093 6.583 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -1.219 8.212 9.179 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -1.887 9.430 8.066 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -2.851 7.999 8.502 1.00 0.00 H new ATOM 1126 N SER A 77 -3.342 9.699 4.953 1.00 0.00 N ATOM 1127 CA SER A 77 -3.560 11.101 4.611 1.00 0.00 C ATOM 1128 C SER A 77 -4.837 11.628 5.256 1.00 0.00 C ATOM 1129 O SER A 77 -5.741 10.858 5.582 1.00 0.00 O ATOM 1130 CB SER A 77 -3.636 11.271 3.093 1.00 0.00 C ATOM 1131 OG SER A 77 -3.150 12.542 2.698 1.00 0.00 O ATOM 0 H SER A 77 -4.109 9.077 4.699 1.00 0.00 H new ATOM 0 HA SER A 77 -2.717 11.676 4.994 1.00 0.00 H new ATOM 0 HB2 SER A 77 -3.054 10.488 2.607 1.00 0.00 H new ATOM 0 HB3 SER A 77 -4.668 11.154 2.762 1.00 0.00 H new ATOM 0 HG SER A 77 -3.207 12.626 1.723 1.00 0.00 H new ATOM 1137 N ASP A 78 -4.902 12.944 5.435 1.00 0.00 N ATOM 1138 CA ASP A 78 -6.067 13.590 6.041 1.00 0.00 C ATOM 1139 C ASP A 78 -7.377 13.007 5.512 1.00 0.00 C ATOM 1140 O ASP A 78 -8.254 12.617 6.282 1.00 0.00 O ATOM 1141 CB ASP A 78 -6.030 15.094 5.761 1.00 0.00 C ATOM 1142 CG ASP A 78 -5.787 15.909 7.013 1.00 0.00 C ATOM 1143 OD1 ASP A 78 -4.910 15.518 7.810 1.00 0.00 O ATOM 1144 OD2 ASP A 78 -6.473 16.935 7.196 1.00 0.00 O ATOM 0 H ASP A 78 -4.158 13.589 5.168 1.00 0.00 H new ATOM 0 HA ASP A 78 -6.025 13.408 7.115 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -5.245 15.306 5.035 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -6.974 15.400 5.309 1.00 0.00 H new ATOM 1149 N ASP A 79 -7.500 12.963 4.191 1.00 0.00 N ATOM 1150 CA ASP A 79 -8.701 12.444 3.542 1.00 0.00 C ATOM 1151 C ASP A 79 -8.963 10.983 3.908 1.00 0.00 C ATOM 1152 O ASP A 79 -10.073 10.484 3.729 1.00 0.00 O ATOM 1153 CB ASP A 79 -8.580 12.583 2.024 1.00 0.00 C ATOM 1154 CG ASP A 79 -9.120 13.907 1.520 1.00 0.00 C ATOM 1155 OD1 ASP A 79 -9.111 14.886 2.297 1.00 0.00 O ATOM 1156 OD2 ASP A 79 -9.550 13.966 0.350 1.00 0.00 O ATOM 0 H ASP A 79 -6.779 13.282 3.544 1.00 0.00 H new ATOM 0 HA ASP A 79 -9.546 13.033 3.899 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -7.533 12.487 1.735 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -9.119 11.767 1.543 1.00 0.00 H new ATOM 1161 N TYR A 80 -7.941 10.299 4.409 1.00 0.00 N ATOM 1162 CA TYR A 80 -8.075 8.897 4.782 1.00 0.00 C ATOM 1163 C TYR A 80 -8.456 8.751 6.250 1.00 0.00 C ATOM 1164 O TYR A 80 -9.233 7.869 6.614 1.00 0.00 O ATOM 1165 CB TYR A 80 -6.768 8.150 4.506 1.00 0.00 C ATOM 1166 CG TYR A 80 -6.884 6.648 4.637 1.00 0.00 C ATOM 1167 CD1 TYR A 80 -7.628 5.907 3.727 1.00 0.00 C ATOM 1168 CD2 TYR A 80 -6.248 5.970 5.669 1.00 0.00 C ATOM 1169 CE1 TYR A 80 -7.737 4.535 3.843 1.00 0.00 C ATOM 1170 CE2 TYR A 80 -6.351 4.597 5.791 1.00 0.00 C ATOM 1171 CZ TYR A 80 -7.096 3.885 4.876 1.00 0.00 C ATOM 1172 OH TYR A 80 -7.201 2.518 4.995 1.00 0.00 O ATOM 0 H TYR A 80 -7.013 10.692 4.566 1.00 0.00 H new ATOM 0 HA TYR A 80 -8.872 8.464 4.178 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -6.428 8.392 3.499 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -6.003 8.508 5.196 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -8.130 6.413 2.915 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -5.663 6.525 6.388 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -8.321 3.974 3.128 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -5.850 4.085 6.599 1.00 0.00 H new ATOM 0 HH TYR A 80 -6.309 2.116 4.943 1.00 0.00 H new ATOM 1182 N LEU A 81 -7.903 9.618 7.088 1.00 0.00 N ATOM 1183 CA LEU A 81 -8.179 9.583 8.511 1.00 0.00 C ATOM 1184 C LEU A 81 -9.544 10.179 8.818 1.00 0.00 C ATOM 1185 O LEU A 81 -10.172 9.834 9.820 1.00 0.00 O ATOM 1186 CB LEU A 81 -7.091 10.337 9.265 1.00 0.00 C ATOM 1187 CG LEU A 81 -5.684 9.776 9.085 1.00 0.00 C ATOM 1188 CD1 LEU A 81 -4.630 10.843 9.337 1.00 0.00 C ATOM 1189 CD2 LEU A 81 -5.478 8.605 10.018 1.00 0.00 C ATOM 0 H LEU A 81 -7.259 10.355 6.802 1.00 0.00 H new ATOM 0 HA LEU A 81 -8.187 8.543 8.836 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -7.097 11.377 8.940 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.335 10.334 10.327 1.00 0.00 H new ATOM 0 HG LEU A 81 -5.578 9.439 8.054 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -3.638 10.413 9.201 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -4.769 11.665 8.634 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -4.727 11.217 10.356 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -4.472 8.207 9.886 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -5.606 8.934 11.049 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -6.208 7.827 9.793 1.00 0.00 H new ATOM 1201 N GLN A 82 -10.002 11.075 7.951 1.00 0.00 N ATOM 1202 CA GLN A 82 -11.291 11.710 8.133 1.00 0.00 C ATOM 1203 C GLN A 82 -12.430 10.779 7.721 1.00 0.00 C ATOM 1204 O GLN A 82 -13.605 11.131 7.847 1.00 0.00 O ATOM 1205 CB GLN A 82 -11.351 13.003 7.324 1.00 0.00 C ATOM 1206 CG GLN A 82 -10.995 12.826 5.859 1.00 0.00 C ATOM 1207 CD GLN A 82 -12.165 13.094 4.933 1.00 0.00 C ATOM 1208 OE1 GLN A 82 -12.910 14.056 5.119 1.00 0.00 O ATOM 1209 NE2 GLN A 82 -12.332 12.244 3.928 1.00 0.00 N ATOM 0 H GLN A 82 -9.496 11.374 7.117 1.00 0.00 H new ATOM 0 HA GLN A 82 -11.411 11.940 9.192 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -12.356 13.420 7.396 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -10.671 13.730 7.768 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -10.175 13.498 5.605 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -10.635 11.810 5.698 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -11.690 11.460 3.811 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -13.102 12.375 3.272 1.00 0.00 H new ATOM 1218 N SER A 83 -12.082 9.591 7.226 1.00 0.00 N ATOM 1219 CA SER A 83 -13.083 8.622 6.797 1.00 0.00 C ATOM 1220 C SER A 83 -13.015 7.353 7.643 1.00 0.00 C ATOM 1221 O SER A 83 -12.002 7.074 8.282 1.00 0.00 O ATOM 1222 CB SER A 83 -12.887 8.274 5.321 1.00 0.00 C ATOM 1223 OG SER A 83 -14.134 8.086 4.672 1.00 0.00 O ATOM 0 H SER A 83 -11.117 9.280 7.114 1.00 0.00 H new ATOM 0 HA SER A 83 -14.066 9.073 6.931 1.00 0.00 H new ATOM 0 HB2 SER A 83 -12.332 9.071 4.826 1.00 0.00 H new ATOM 0 HB3 SER A 83 -12.288 7.368 5.234 1.00 0.00 H new ATOM 0 HG SER A 83 -13.982 7.866 3.729 1.00 0.00 H new ATOM 1229 N LYS A 84 -14.105 6.588 7.640 1.00 0.00 N ATOM 1230 CA LYS A 84 -14.176 5.354 8.401 1.00 0.00 C ATOM 1231 C LYS A 84 -13.358 4.252 7.735 1.00 0.00 C ATOM 1232 O LYS A 84 -12.909 3.314 8.395 1.00 0.00 O ATOM 1233 CB LYS A 84 -15.632 4.912 8.534 1.00 0.00 C ATOM 1234 CG LYS A 84 -16.549 5.992 9.085 1.00 0.00 C ATOM 1235 CD LYS A 84 -17.374 6.641 7.985 1.00 0.00 C ATOM 1236 CE LYS A 84 -17.599 8.120 8.255 1.00 0.00 C ATOM 1237 NZ LYS A 84 -19.013 8.410 8.618 1.00 0.00 N ATOM 0 H LYS A 84 -14.952 6.807 7.115 1.00 0.00 H new ATOM 0 HA LYS A 84 -13.759 5.537 9.391 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -15.999 4.600 7.556 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -15.680 4.040 9.186 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -17.214 5.559 9.832 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -15.954 6.752 9.591 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -16.867 6.518 7.028 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -18.336 6.135 7.903 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -16.943 8.445 9.062 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -17.326 8.696 7.371 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -19.124 9.429 8.794 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -19.638 8.123 7.837 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -19.267 7.881 9.477 1.00 0.00 H new ATOM 1251 N GLU A 85 -13.165 4.372 6.425 1.00 0.00 N ATOM 1252 CA GLU A 85 -12.397 3.387 5.669 1.00 0.00 C ATOM 1253 C GLU A 85 -11.051 3.129 6.333 1.00 0.00 C ATOM 1254 O GLU A 85 -10.523 2.017 6.282 1.00 0.00 O ATOM 1255 CB GLU A 85 -12.189 3.866 4.231 1.00 0.00 C ATOM 1256 CG GLU A 85 -13.340 3.521 3.301 1.00 0.00 C ATOM 1257 CD GLU A 85 -12.927 2.581 2.184 1.00 0.00 C ATOM 1258 OE1 GLU A 85 -13.015 1.350 2.381 1.00 0.00 O ATOM 1259 OE2 GLU A 85 -12.515 3.075 1.114 1.00 0.00 O ATOM 0 H GLU A 85 -13.530 5.142 5.864 1.00 0.00 H new ATOM 0 HA GLU A 85 -12.960 2.454 5.653 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -12.047 4.947 4.234 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -11.272 3.425 3.839 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -14.143 3.063 3.878 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -13.741 4.438 2.869 1.00 0.00 H new ATOM 1266 N CYS A 86 -10.507 4.161 6.966 1.00 0.00 N ATOM 1267 CA CYS A 86 -9.229 4.046 7.652 1.00 0.00 C ATOM 1268 C CYS A 86 -9.413 3.343 8.990 1.00 0.00 C ATOM 1269 O CYS A 86 -8.530 2.621 9.449 1.00 0.00 O ATOM 1270 CB CYS A 86 -8.611 5.430 7.865 1.00 0.00 C ATOM 1271 SG CYS A 86 -7.068 5.420 8.810 1.00 0.00 S ATOM 0 H CYS A 86 -10.932 5.087 7.018 1.00 0.00 H new ATOM 0 HA CYS A 86 -8.554 3.455 7.033 1.00 0.00 H new ATOM 0 HB2 CYS A 86 -8.425 5.885 6.892 1.00 0.00 H new ATOM 0 HB3 CYS A 86 -9.334 6.063 8.380 1.00 0.00 H new ATOM 0 HG CYS A 86 -6.061 5.316 7.995 1.00 0.00 H new ATOM 1277 N ASP A 87 -10.573 3.552 9.605 1.00 0.00 N ATOM 1278 CA ASP A 87 -10.876 2.930 10.887 1.00 0.00 C ATOM 1279 C ASP A 87 -10.858 1.414 10.753 1.00 0.00 C ATOM 1280 O ASP A 87 -10.338 0.708 11.618 1.00 0.00 O ATOM 1281 CB ASP A 87 -12.239 3.398 11.401 1.00 0.00 C ATOM 1282 CG ASP A 87 -12.260 4.881 11.715 1.00 0.00 C ATOM 1283 OD1 ASP A 87 -11.686 5.662 10.927 1.00 0.00 O ATOM 1284 OD2 ASP A 87 -12.851 5.261 12.748 1.00 0.00 O ATOM 0 H ASP A 87 -11.316 4.146 9.237 1.00 0.00 H new ATOM 0 HA ASP A 87 -10.113 3.229 11.606 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -13.001 3.177 10.654 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -12.499 2.836 12.298 1.00 0.00 H new ATOM 1289 N PHE A 88 -11.417 0.921 9.654 1.00 0.00 N ATOM 1290 CA PHE A 88 -11.452 -0.513 9.395 1.00 0.00 C ATOM 1291 C PHE A 88 -10.050 -1.016 9.077 1.00 0.00 C ATOM 1292 O PHE A 88 -9.618 -2.054 9.581 1.00 0.00 O ATOM 1293 CB PHE A 88 -12.400 -0.822 8.235 1.00 0.00 C ATOM 1294 CG PHE A 88 -12.676 -2.289 8.060 1.00 0.00 C ATOM 1295 CD1 PHE A 88 -13.189 -3.039 9.105 1.00 0.00 C ATOM 1296 CD2 PHE A 88 -12.425 -2.916 6.850 1.00 0.00 C ATOM 1297 CE1 PHE A 88 -13.445 -4.387 8.948 1.00 0.00 C ATOM 1298 CE2 PHE A 88 -12.679 -4.264 6.687 1.00 0.00 C ATOM 1299 CZ PHE A 88 -13.190 -5.001 7.737 1.00 0.00 C ATOM 0 H PHE A 88 -11.851 1.492 8.929 1.00 0.00 H new ATOM 0 HA PHE A 88 -11.819 -1.023 10.286 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -13.343 -0.300 8.398 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -11.973 -0.428 7.313 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -13.391 -2.564 10.054 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -12.026 -2.344 6.025 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -13.844 -4.961 9.771 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -12.478 -4.741 5.739 1.00 0.00 H new ATOM 0 HZ PHE A 88 -13.390 -6.055 7.612 1.00 0.00 H new ATOM 1309 N GLN A 89 -9.337 -0.257 8.250 1.00 0.00 N ATOM 1310 CA GLN A 89 -7.975 -0.608 7.874 1.00 0.00 C ATOM 1311 C GLN A 89 -7.086 -0.625 9.110 1.00 0.00 C ATOM 1312 O GLN A 89 -6.197 -1.463 9.238 1.00 0.00 O ATOM 1313 CB GLN A 89 -7.433 0.389 6.847 1.00 0.00 C ATOM 1314 CG GLN A 89 -6.000 0.108 6.421 1.00 0.00 C ATOM 1315 CD GLN A 89 -5.063 1.260 6.722 1.00 0.00 C ATOM 1316 OE1 GLN A 89 -4.792 2.096 5.860 1.00 0.00 O ATOM 1317 NE2 GLN A 89 -4.564 1.311 7.952 1.00 0.00 N ATOM 0 H GLN A 89 -9.682 0.605 7.828 1.00 0.00 H new ATOM 0 HA GLN A 89 -7.978 -1.601 7.424 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -8.074 0.375 5.966 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -7.488 1.394 7.265 1.00 0.00 H new ATOM 0 HG2 GLN A 89 -5.643 -0.787 6.930 1.00 0.00 H new ATOM 0 HG3 GLN A 89 -5.978 -0.103 5.352 1.00 0.00 H new ATOM 0 HE21 GLN A 89 -4.816 0.596 8.635 1.00 0.00 H new ATOM 0 HE22 GLN A 89 -3.929 2.065 8.214 1.00 0.00 H new ATOM 1326 N THR A 90 -7.348 0.305 10.020 1.00 0.00 N ATOM 1327 CA THR A 90 -6.596 0.406 11.260 1.00 0.00 C ATOM 1328 C THR A 90 -6.746 -0.851 12.085 1.00 0.00 C ATOM 1329 O THR A 90 -5.782 -1.574 12.285 1.00 0.00 O ATOM 1330 CB THR A 90 -7.060 1.628 12.058 1.00 0.00 C ATOM 1331 OG1 THR A 90 -6.924 2.809 11.288 1.00 0.00 O ATOM 1332 CG2 THR A 90 -6.294 1.835 13.345 1.00 0.00 C ATOM 0 H THR A 90 -8.083 1.005 9.919 1.00 0.00 H new ATOM 0 HA THR A 90 -5.541 0.525 11.014 1.00 0.00 H new ATOM 0 HB THR A 90 -8.103 1.429 12.304 1.00 0.00 H new ATOM 0 HG1 THR A 90 -7.748 2.966 10.782 1.00 0.00 H new ATOM 0 HG21 THR A 90 -6.676 2.718 13.858 1.00 0.00 H new ATOM 0 HG22 THR A 90 -6.416 0.962 13.986 1.00 0.00 H new ATOM 0 HG23 THR A 90 -5.237 1.975 13.121 1.00 0.00 H new ATOM 1340 N LYS A 91 -7.952 -1.114 12.563 1.00 0.00 N ATOM 1341 CA LYS A 91 -8.197 -2.298 13.378 1.00 0.00 C ATOM 1342 C LYS A 91 -7.621 -3.551 12.726 1.00 0.00 C ATOM 1343 O LYS A 91 -7.249 -4.500 13.416 1.00 0.00 O ATOM 1344 CB LYS A 91 -9.695 -2.472 13.634 1.00 0.00 C ATOM 1345 CG LYS A 91 -10.206 -1.667 14.816 1.00 0.00 C ATOM 1346 CD LYS A 91 -10.020 -0.174 14.595 1.00 0.00 C ATOM 1347 CE LYS A 91 -10.389 0.625 15.835 1.00 0.00 C ATOM 1348 NZ LYS A 91 -10.067 2.071 15.679 1.00 0.00 N ATOM 0 H LYS A 91 -8.773 -0.530 12.403 1.00 0.00 H new ATOM 0 HA LYS A 91 -7.691 -2.154 14.333 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -10.245 -2.178 12.740 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -9.906 -3.528 13.805 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -11.262 -1.884 14.976 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -9.678 -1.971 15.720 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -8.983 0.028 14.326 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -10.636 0.150 13.756 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -11.454 0.510 16.038 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -9.855 0.225 16.697 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -10.333 2.581 16.545 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -9.047 2.183 15.511 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -10.596 2.459 14.872 1.00 0.00 H new ATOM 1362 N PHE A 92 -7.538 -3.545 11.403 1.00 0.00 N ATOM 1363 CA PHE A 92 -6.989 -4.683 10.680 1.00 0.00 C ATOM 1364 C PHE A 92 -5.491 -4.506 10.451 1.00 0.00 C ATOM 1365 O PHE A 92 -4.764 -5.478 10.243 1.00 0.00 O ATOM 1366 CB PHE A 92 -7.708 -4.869 9.343 1.00 0.00 C ATOM 1367 CG PHE A 92 -7.309 -6.120 8.618 1.00 0.00 C ATOM 1368 CD1 PHE A 92 -7.774 -7.358 9.039 1.00 0.00 C ATOM 1369 CD2 PHE A 92 -6.470 -6.064 7.517 1.00 0.00 C ATOM 1370 CE1 PHE A 92 -7.408 -8.513 8.374 1.00 0.00 C ATOM 1371 CE2 PHE A 92 -6.101 -7.217 6.849 1.00 0.00 C ATOM 1372 CZ PHE A 92 -6.571 -8.442 7.278 1.00 0.00 C ATOM 0 H PHE A 92 -7.841 -2.771 10.812 1.00 0.00 H new ATOM 0 HA PHE A 92 -7.144 -5.575 11.287 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -8.784 -4.887 9.517 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -7.503 -4.008 8.706 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -8.429 -7.420 9.896 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -6.100 -5.108 7.176 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -7.776 -9.471 8.711 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -5.446 -7.159 5.992 1.00 0.00 H new ATOM 0 HZ PHE A 92 -6.284 -9.344 6.757 1.00 0.00 H new ATOM 1382 N ALA A 93 -5.036 -3.257 10.495 1.00 0.00 N ATOM 1383 CA ALA A 93 -3.629 -2.946 10.298 1.00 0.00 C ATOM 1384 C ALA A 93 -2.881 -2.928 11.624 1.00 0.00 C ATOM 1385 O ALA A 93 -1.688 -3.230 11.683 1.00 0.00 O ATOM 1386 CB ALA A 93 -3.483 -1.610 9.591 1.00 0.00 C ATOM 0 H ALA A 93 -5.626 -2.443 10.666 1.00 0.00 H new ATOM 0 HA ALA A 93 -3.191 -3.726 9.675 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -2.426 -1.387 9.449 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -3.978 -1.656 8.621 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -3.941 -0.827 10.195 1.00 0.00 H new ATOM 1392 N LEU A 94 -3.590 -2.582 12.691 1.00 0.00 N ATOM 1393 CA LEU A 94 -3.004 -2.533 14.015 1.00 0.00 C ATOM 1394 C LEU A 94 -3.030 -3.911 14.641 1.00 0.00 C ATOM 1395 O LEU A 94 -2.044 -4.389 15.199 1.00 0.00 O ATOM 1396 CB LEU A 94 -3.787 -1.552 14.881 1.00 0.00 C ATOM 1397 CG LEU A 94 -5.302 -1.773 14.951 1.00 0.00 C ATOM 1398 CD1 LEU A 94 -5.656 -2.762 16.035 1.00 0.00 C ATOM 1399 CD2 LEU A 94 -6.022 -0.455 15.189 1.00 0.00 C ATOM 0 H LEU A 94 -4.578 -2.330 12.659 1.00 0.00 H new ATOM 0 HA LEU A 94 -1.969 -2.200 13.940 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -3.387 -1.594 15.894 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -3.604 -0.544 14.508 1.00 0.00 H new ATOM 0 HG LEU A 94 -5.626 -2.183 13.995 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -6.737 -2.900 16.063 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -5.173 -3.717 15.828 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -5.314 -2.384 16.998 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -7.097 -0.631 15.236 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -5.684 -0.020 16.130 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -5.802 0.232 14.372 1.00 0.00 H new ATOM 1411 N SER A 95 -4.184 -4.532 14.529 1.00 0.00 N ATOM 1412 CA SER A 95 -4.403 -5.870 15.064 1.00 0.00 C ATOM 1413 C SER A 95 -4.490 -6.896 13.939 1.00 0.00 C ATOM 1414 O SER A 95 -5.457 -7.652 13.845 1.00 0.00 O ATOM 1415 CB SER A 95 -5.679 -5.908 15.907 1.00 0.00 C ATOM 1416 OG SER A 95 -5.493 -5.250 17.148 1.00 0.00 O ATOM 0 H SER A 95 -4.999 -4.130 14.066 1.00 0.00 H new ATOM 0 HA SER A 95 -3.554 -6.123 15.699 1.00 0.00 H new ATOM 0 HB2 SER A 95 -6.494 -5.434 15.360 1.00 0.00 H new ATOM 0 HB3 SER A 95 -5.972 -6.943 16.082 1.00 0.00 H new ATOM 0 HG SER A 95 -6.324 -5.288 17.666 1.00 0.00 H new ATOM 1422 N LEU A 96 -3.470 -6.918 13.087 1.00 0.00 N ATOM 1423 CA LEU A 96 -3.433 -7.858 11.968 1.00 0.00 C ATOM 1424 C LEU A 96 -2.934 -9.224 12.432 1.00 0.00 C ATOM 1425 O LEU A 96 -3.722 -10.144 12.656 1.00 0.00 O ATOM 1426 CB LEU A 96 -2.548 -7.344 10.819 1.00 0.00 C ATOM 1427 CG LEU A 96 -1.835 -6.012 11.061 1.00 0.00 C ATOM 1428 CD1 LEU A 96 -0.599 -6.212 11.923 1.00 0.00 C ATOM 1429 CD2 LEU A 96 -1.461 -5.371 9.736 1.00 0.00 C ATOM 0 H LEU A 96 -2.661 -6.300 13.148 1.00 0.00 H new ATOM 0 HA LEU A 96 -4.452 -7.954 11.593 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -1.795 -8.101 10.601 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -3.167 -7.244 9.927 1.00 0.00 H new ATOM 0 HG LEU A 96 -2.515 -5.347 11.593 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -0.107 -5.252 12.082 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -0.890 -6.635 12.885 1.00 0.00 H new ATOM 0 HD13 LEU A 96 0.088 -6.893 11.421 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -0.954 -4.424 9.920 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -0.797 -6.037 9.184 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -2.363 -5.192 9.151 1.00 0.00 H new ATOM 1441 N SER A 97 -1.620 -9.343 12.575 1.00 0.00 N ATOM 1442 CA SER A 97 -0.997 -10.584 13.013 1.00 0.00 C ATOM 1443 C SER A 97 0.093 -10.302 14.044 1.00 0.00 C ATOM 1444 O SER A 97 0.448 -9.147 14.280 1.00 0.00 O ATOM 1445 CB SER A 97 -0.406 -11.330 11.813 1.00 0.00 C ATOM 1446 OG SER A 97 -1.164 -12.488 11.509 1.00 0.00 O ATOM 0 H SER A 97 -0.960 -8.587 12.392 1.00 0.00 H new ATOM 0 HA SER A 97 -1.760 -11.209 13.477 1.00 0.00 H new ATOM 0 HB2 SER A 97 -0.382 -10.670 10.946 1.00 0.00 H new ATOM 0 HB3 SER A 97 0.625 -11.612 12.028 1.00 0.00 H new ATOM 0 HG SER A 97 -0.767 -12.946 10.738 1.00 0.00 H new ATOM 1452 N PRO A 98 0.638 -11.354 14.679 1.00 0.00 N ATOM 1453 CA PRO A 98 1.688 -11.206 15.690 1.00 0.00 C ATOM 1454 C PRO A 98 3.045 -10.872 15.077 1.00 0.00 C ATOM 1455 O PRO A 98 3.910 -11.739 14.949 1.00 0.00 O ATOM 1456 CB PRO A 98 1.724 -12.581 16.353 1.00 0.00 C ATOM 1457 CG PRO A 98 1.284 -13.520 15.286 1.00 0.00 C ATOM 1458 CD PRO A 98 0.273 -12.768 14.462 1.00 0.00 C ATOM 0 HA PRO A 98 1.483 -10.386 16.379 1.00 0.00 H new ATOM 0 HB2 PRO A 98 2.725 -12.825 16.708 1.00 0.00 H new ATOM 0 HB3 PRO A 98 1.061 -12.623 17.217 1.00 0.00 H new ATOM 0 HG2 PRO A 98 2.128 -13.838 14.674 1.00 0.00 H new ATOM 0 HG3 PRO A 98 0.845 -14.421 15.715 1.00 0.00 H new ATOM 0 HD2 PRO A 98 0.331 -13.041 13.408 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -0.746 -12.975 14.789 1.00 0.00 H new ATOM 1466 N GLY A 99 3.227 -9.609 14.706 1.00 0.00 N ATOM 1467 CA GLY A 99 4.485 -9.183 14.116 1.00 0.00 C ATOM 1468 C GLY A 99 4.346 -8.789 12.658 1.00 0.00 C ATOM 1469 O GLY A 99 5.172 -9.165 11.827 1.00 0.00 O ATOM 0 H GLY A 99 2.528 -8.873 14.803 1.00 0.00 H new ATOM 0 HA2 GLY A 99 4.878 -8.337 14.680 1.00 0.00 H new ATOM 0 HA3 GLY A 99 5.213 -9.990 14.202 1.00 0.00 H new ATOM 1473 N ALA A 100 3.301 -8.030 12.346 1.00 0.00 N ATOM 1474 CA ALA A 100 3.064 -7.586 10.977 1.00 0.00 C ATOM 1475 C ALA A 100 2.446 -6.192 10.944 1.00 0.00 C ATOM 1476 O ALA A 100 1.609 -5.896 10.092 1.00 0.00 O ATOM 1477 CB ALA A 100 2.169 -8.579 10.250 1.00 0.00 C ATOM 0 H ALA A 100 2.606 -7.710 13.021 1.00 0.00 H new ATOM 0 HA ALA A 100 4.027 -7.536 10.468 1.00 0.00 H new ATOM 0 HB1 ALA A 100 1.999 -8.236 9.229 1.00 0.00 H new ATOM 0 HB2 ALA A 100 2.651 -9.556 10.229 1.00 0.00 H new ATOM 0 HB3 ALA A 100 1.214 -8.657 10.770 1.00 0.00 H new ATOM 1483 N HIS A 101 2.863 -5.339 11.874 1.00 0.00 N ATOM 1484 CA HIS A 101 2.345 -3.975 11.945 1.00 0.00 C ATOM 1485 C HIS A 101 3.090 -3.059 10.982 1.00 0.00 C ATOM 1486 O HIS A 101 2.495 -2.184 10.353 1.00 0.00 O ATOM 1487 CB HIS A 101 2.460 -3.435 13.373 1.00 0.00 C ATOM 1488 CG HIS A 101 1.624 -2.219 13.621 1.00 0.00 C ATOM 1489 ND1 HIS A 101 1.732 -1.450 14.761 1.00 0.00 N ATOM 1490 CD2 HIS A 101 0.660 -1.636 12.868 1.00 0.00 C ATOM 1491 CE1 HIS A 101 0.873 -0.450 14.700 1.00 0.00 C ATOM 1492 NE2 HIS A 101 0.210 -0.539 13.562 1.00 0.00 N ATOM 0 H HIS A 101 3.556 -5.566 12.587 1.00 0.00 H new ATOM 0 HA HIS A 101 1.294 -3.998 11.657 1.00 0.00 H new ATOM 0 HB2 HIS A 101 2.166 -4.217 14.073 1.00 0.00 H new ATOM 0 HB3 HIS A 101 3.503 -3.197 13.580 1.00 0.00 H new ATOM 0 HD1 HIS A 101 2.376 -1.627 15.532 1.00 0.00 H new ATOM 0 HD2 HIS A 101 0.311 -1.971 11.903 1.00 0.00 H new ATOM 0 HE1 HIS A 101 0.736 0.312 15.453 1.00 0.00 H new ATOM 1501 N GLN A 102 4.397 -3.269 10.870 1.00 0.00 N ATOM 1502 CA GLN A 102 5.228 -2.465 9.980 1.00 0.00 C ATOM 1503 C GLN A 102 6.237 -3.343 9.247 1.00 0.00 C ATOM 1504 O GLN A 102 7.353 -2.912 8.955 1.00 0.00 O ATOM 1505 CB GLN A 102 5.959 -1.380 10.774 1.00 0.00 C ATOM 1506 CG GLN A 102 6.572 -1.882 12.070 1.00 0.00 C ATOM 1507 CD GLN A 102 7.592 -0.918 12.644 1.00 0.00 C ATOM 1508 OE1 GLN A 102 8.270 -0.202 11.906 1.00 0.00 O ATOM 1509 NE2 GLN A 102 7.707 -0.896 13.966 1.00 0.00 N ATOM 0 H GLN A 102 4.904 -3.989 11.384 1.00 0.00 H new ATOM 0 HA GLN A 102 4.580 -1.990 9.243 1.00 0.00 H new ATOM 0 HB2 GLN A 102 6.746 -0.954 10.151 1.00 0.00 H new ATOM 0 HB3 GLN A 102 5.260 -0.575 11.001 1.00 0.00 H new ATOM 0 HG2 GLN A 102 5.781 -2.047 12.802 1.00 0.00 H new ATOM 0 HG3 GLN A 102 7.048 -2.846 11.893 1.00 0.00 H new ATOM 0 HE21 GLN A 102 7.125 -1.507 14.539 1.00 0.00 H new ATOM 0 HE22 GLN A 102 8.378 -0.268 14.409 1.00 0.00 H new ATOM 1518 N LYS A 103 5.838 -4.577 8.959 1.00 0.00 N ATOM 1519 CA LYS A 103 6.706 -5.520 8.268 1.00 0.00 C ATOM 1520 C LYS A 103 6.207 -5.792 6.852 1.00 0.00 C ATOM 1521 O LYS A 103 6.989 -6.113 5.958 1.00 0.00 O ATOM 1522 CB LYS A 103 6.785 -6.832 9.049 1.00 0.00 C ATOM 1523 CG LYS A 103 7.936 -6.880 10.041 1.00 0.00 C ATOM 1524 CD LYS A 103 7.792 -5.812 11.115 1.00 0.00 C ATOM 1525 CE LYS A 103 8.121 -6.361 12.494 1.00 0.00 C ATOM 1526 NZ LYS A 103 9.026 -5.452 13.253 1.00 0.00 N ATOM 0 H LYS A 103 4.917 -4.947 9.194 1.00 0.00 H new ATOM 0 HA LYS A 103 7.700 -5.077 8.203 1.00 0.00 H new ATOM 0 HB2 LYS A 103 5.848 -6.984 9.585 1.00 0.00 H new ATOM 0 HB3 LYS A 103 6.887 -7.658 8.346 1.00 0.00 H new ATOM 0 HG2 LYS A 103 7.974 -7.864 10.508 1.00 0.00 H new ATOM 0 HG3 LYS A 103 8.879 -6.741 9.513 1.00 0.00 H new ATOM 0 HD2 LYS A 103 8.453 -4.975 10.888 1.00 0.00 H new ATOM 0 HD3 LYS A 103 6.773 -5.424 11.110 1.00 0.00 H new ATOM 0 HE2 LYS A 103 7.199 -6.507 13.056 1.00 0.00 H new ATOM 0 HE3 LYS A 103 8.591 -7.339 12.393 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 9.226 -5.862 14.187 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 9.917 -5.332 12.729 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 8.568 -4.526 13.372 1.00 0.00 H new ATOM 1540 N ARG A 104 4.897 -5.670 6.653 1.00 0.00 N ATOM 1541 CA ARG A 104 4.299 -5.912 5.345 1.00 0.00 C ATOM 1542 C ARG A 104 3.606 -4.662 4.811 1.00 0.00 C ATOM 1543 O ARG A 104 3.693 -4.356 3.622 1.00 0.00 O ATOM 1544 CB ARG A 104 3.298 -7.066 5.430 1.00 0.00 C ATOM 1545 CG ARG A 104 3.828 -8.277 6.180 1.00 0.00 C ATOM 1546 CD ARG A 104 2.758 -9.342 6.347 1.00 0.00 C ATOM 1547 NE ARG A 104 2.506 -10.067 5.103 1.00 0.00 N ATOM 1548 CZ ARG A 104 1.411 -10.785 4.871 1.00 0.00 C ATOM 1549 NH1 ARG A 104 0.462 -10.878 5.796 1.00 0.00 N ATOM 1550 NH2 ARG A 104 1.261 -11.412 3.712 1.00 0.00 N ATOM 0 H ARG A 104 4.232 -5.406 7.379 1.00 0.00 H new ATOM 0 HA ARG A 104 5.100 -6.177 4.654 1.00 0.00 H new ATOM 0 HB2 ARG A 104 2.391 -6.714 5.921 1.00 0.00 H new ATOM 0 HB3 ARG A 104 3.018 -7.368 4.421 1.00 0.00 H new ATOM 0 HG2 ARG A 104 4.678 -8.696 5.642 1.00 0.00 H new ATOM 0 HG3 ARG A 104 4.192 -7.969 7.160 1.00 0.00 H new ATOM 0 HD2 ARG A 104 3.065 -10.046 7.121 1.00 0.00 H new ATOM 0 HD3 ARG A 104 1.834 -8.876 6.689 1.00 0.00 H new ATOM 0 HE ARG A 104 3.212 -10.019 4.369 1.00 0.00 H new ATOM 0 HH11 ARG A 104 0.571 -10.397 6.689 1.00 0.00 H new ATOM 0 HH12 ARG A 104 -0.376 -11.430 5.613 1.00 0.00 H new ATOM 0 HH21 ARG A 104 1.986 -11.344 2.998 1.00 0.00 H new ATOM 0 HH22 ARG A 104 0.421 -11.963 3.535 1.00 0.00 H new ATOM 1564 N LEU A 105 2.917 -3.944 5.692 1.00 0.00 N ATOM 1565 CA LEU A 105 2.208 -2.732 5.301 1.00 0.00 C ATOM 1566 C LEU A 105 3.021 -1.486 5.639 1.00 0.00 C ATOM 1567 O LEU A 105 3.556 -1.365 6.740 1.00 0.00 O ATOM 1568 CB LEU A 105 0.842 -2.663 5.989 1.00 0.00 C ATOM 1569 CG LEU A 105 0.777 -3.298 7.380 1.00 0.00 C ATOM 1570 CD1 LEU A 105 -0.289 -2.618 8.226 1.00 0.00 C ATOM 1571 CD2 LEU A 105 0.501 -4.789 7.269 1.00 0.00 C ATOM 0 H LEU A 105 2.835 -4.181 6.681 1.00 0.00 H new ATOM 0 HA LEU A 105 2.062 -2.767 4.221 1.00 0.00 H new ATOM 0 HB2 LEU A 105 0.548 -1.617 6.071 1.00 0.00 H new ATOM 0 HB3 LEU A 105 0.107 -3.152 5.350 1.00 0.00 H new ATOM 0 HG LEU A 105 1.742 -3.162 7.869 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -0.322 -3.082 9.212 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -0.050 -1.560 8.331 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -1.260 -2.725 7.742 1.00 0.00 H new ATOM 0 HD21 LEU A 105 0.458 -5.226 8.267 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -0.451 -4.946 6.762 1.00 0.00 H new ATOM 0 HD23 LEU A 105 1.298 -5.265 6.698 1.00 0.00 H new ATOM 1583 N ILE A 106 3.107 -0.564 4.685 1.00 0.00 N ATOM 1584 CA ILE A 106 3.855 0.672 4.888 1.00 0.00 C ATOM 1585 C ILE A 106 3.000 1.904 4.580 1.00 0.00 C ATOM 1586 O ILE A 106 2.417 2.011 3.499 1.00 0.00 O ATOM 1587 CB ILE A 106 5.126 0.717 4.016 1.00 0.00 C ATOM 1588 CG1 ILE A 106 4.819 0.246 2.589 1.00 0.00 C ATOM 1589 CG2 ILE A 106 6.233 -0.120 4.646 1.00 0.00 C ATOM 1590 CD1 ILE A 106 4.914 -1.255 2.396 1.00 0.00 C ATOM 0 H ILE A 106 2.670 -0.649 3.767 1.00 0.00 H new ATOM 0 HA ILE A 106 4.142 0.687 5.940 1.00 0.00 H new ATOM 0 HB ILE A 106 5.473 1.749 3.960 1.00 0.00 H new ATOM 0 HG12 ILE A 106 3.815 0.573 2.319 1.00 0.00 H new ATOM 0 HG13 ILE A 106 5.509 0.734 1.901 1.00 0.00 H new ATOM 0 HG21 ILE A 106 7.123 -0.078 4.018 1.00 0.00 H new ATOM 0 HG22 ILE A 106 6.468 0.273 5.635 1.00 0.00 H new ATOM 0 HG23 ILE A 106 5.901 -1.154 4.736 1.00 0.00 H new ATOM 0 HD11 ILE A 106 4.682 -1.504 1.360 1.00 0.00 H new ATOM 0 HD12 ILE A 106 5.924 -1.589 2.632 1.00 0.00 H new ATOM 0 HD13 ILE A 106 4.204 -1.752 3.056 1.00 0.00 H new ATOM 1602 N PRO A 107 2.912 2.851 5.534 1.00 0.00 N ATOM 1603 CA PRO A 107 2.128 4.085 5.372 1.00 0.00 C ATOM 1604 C PRO A 107 2.805 5.093 4.447 1.00 0.00 C ATOM 1605 O PRO A 107 4.032 5.156 4.373 1.00 0.00 O ATOM 1606 CB PRO A 107 2.061 4.638 6.793 1.00 0.00 C ATOM 1607 CG PRO A 107 3.322 4.164 7.425 1.00 0.00 C ATOM 1608 CD PRO A 107 3.567 2.794 6.856 1.00 0.00 C ATOM 0 HA PRO A 107 1.156 3.893 4.918 1.00 0.00 H new ATOM 0 HB2 PRO A 107 1.998 5.726 6.795 1.00 0.00 H new ATOM 0 HB3 PRO A 107 1.185 4.267 7.324 1.00 0.00 H new ATOM 0 HG2 PRO A 107 4.150 4.836 7.200 1.00 0.00 H new ATOM 0 HG3 PRO A 107 3.227 4.127 8.510 1.00 0.00 H new ATOM 0 HD2 PRO A 107 4.632 2.580 6.768 1.00 0.00 H new ATOM 0 HD3 PRO A 107 3.136 2.015 7.485 1.00 0.00 H new ATOM 1616 N ILE A 108 1.994 5.880 3.746 1.00 0.00 N ATOM 1617 CA ILE A 108 2.506 6.889 2.826 1.00 0.00 C ATOM 1618 C ILE A 108 1.546 8.077 2.729 1.00 0.00 C ATOM 1619 O ILE A 108 0.360 7.954 3.037 1.00 0.00 O ATOM 1620 CB ILE A 108 2.729 6.289 1.419 1.00 0.00 C ATOM 1621 CG1 ILE A 108 3.867 5.270 1.453 1.00 0.00 C ATOM 1622 CG2 ILE A 108 3.024 7.379 0.396 1.00 0.00 C ATOM 1623 CD1 ILE A 108 3.399 3.849 1.672 1.00 0.00 C ATOM 0 H ILE A 108 0.976 5.837 3.798 1.00 0.00 H new ATOM 0 HA ILE A 108 3.461 7.237 3.219 1.00 0.00 H new ATOM 0 HB ILE A 108 1.811 5.784 1.117 1.00 0.00 H new ATOM 0 HG12 ILE A 108 4.418 5.322 0.514 1.00 0.00 H new ATOM 0 HG13 ILE A 108 4.563 5.541 2.247 1.00 0.00 H new ATOM 0 HG21 ILE A 108 3.176 6.927 -0.584 1.00 0.00 H new ATOM 0 HG22 ILE A 108 2.183 8.071 0.349 1.00 0.00 H new ATOM 0 HG23 ILE A 108 3.924 7.920 0.690 1.00 0.00 H new ATOM 0 HD11 ILE A 108 4.260 3.180 1.685 1.00 0.00 H new ATOM 0 HD12 ILE A 108 2.873 3.782 2.624 1.00 0.00 H new ATOM 0 HD13 ILE A 108 2.726 3.559 0.865 1.00 0.00 H new ATOM 1635 N LYS A 109 2.065 9.219 2.286 1.00 0.00 N ATOM 1636 CA LYS A 109 1.255 10.424 2.133 1.00 0.00 C ATOM 1637 C LYS A 109 1.748 11.269 0.968 1.00 0.00 C ATOM 1638 O LYS A 109 2.890 11.138 0.528 1.00 0.00 O ATOM 1639 CB LYS A 109 1.287 11.286 3.399 1.00 0.00 C ATOM 1640 CG LYS A 109 1.098 10.512 4.690 1.00 0.00 C ATOM 1641 CD LYS A 109 2.430 10.204 5.350 1.00 0.00 C ATOM 1642 CE LYS A 109 2.374 10.432 6.853 1.00 0.00 C ATOM 1643 NZ LYS A 109 3.291 11.524 7.283 1.00 0.00 N ATOM 0 H LYS A 109 3.045 9.335 2.026 1.00 0.00 H new ATOM 0 HA LYS A 109 0.234 10.092 1.945 1.00 0.00 H new ATOM 0 HB2 LYS A 109 2.241 11.812 3.441 1.00 0.00 H new ATOM 0 HB3 LYS A 109 0.508 12.044 3.327 1.00 0.00 H new ATOM 0 HG2 LYS A 109 0.476 11.089 5.374 1.00 0.00 H new ATOM 0 HG3 LYS A 109 0.568 9.582 4.484 1.00 0.00 H new ATOM 0 HD2 LYS A 109 2.707 9.169 5.148 1.00 0.00 H new ATOM 0 HD3 LYS A 109 3.207 10.832 4.914 1.00 0.00 H new ATOM 0 HE2 LYS A 109 1.353 10.679 7.145 1.00 0.00 H new ATOM 0 HE3 LYS A 109 2.639 9.510 7.370 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 3.224 11.648 8.313 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 4.268 11.277 7.027 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 3.022 12.410 6.809 1.00 0.00 H new ATOM 1657 N TYR A 110 0.887 12.161 0.502 1.00 0.00 N ATOM 1658 CA TYR A 110 1.230 13.068 -0.583 1.00 0.00 C ATOM 1659 C TYR A 110 1.227 14.504 -0.066 1.00 0.00 C ATOM 1660 O TYR A 110 1.144 15.459 -0.839 1.00 0.00 O ATOM 1661 CB TYR A 110 0.243 12.923 -1.743 1.00 0.00 C ATOM 1662 CG TYR A 110 0.565 13.809 -2.925 1.00 0.00 C ATOM 1663 CD1 TYR A 110 1.765 13.673 -3.611 1.00 0.00 C ATOM 1664 CD2 TYR A 110 -0.328 14.784 -3.352 1.00 0.00 C ATOM 1665 CE1 TYR A 110 2.065 14.484 -4.690 1.00 0.00 C ATOM 1666 CE2 TYR A 110 -0.035 15.597 -4.430 1.00 0.00 C ATOM 1667 CZ TYR A 110 1.162 15.444 -5.095 1.00 0.00 C ATOM 1668 OH TYR A 110 1.459 16.253 -6.169 1.00 0.00 O ATOM 0 H TYR A 110 -0.061 12.276 0.861 1.00 0.00 H new ATOM 0 HA TYR A 110 2.225 12.817 -0.951 1.00 0.00 H new ATOM 0 HB2 TYR A 110 0.231 11.884 -2.071 1.00 0.00 H new ATOM 0 HB3 TYR A 110 -0.760 13.157 -1.387 1.00 0.00 H new ATOM 0 HD1 TYR A 110 2.475 12.922 -3.297 1.00 0.00 H new ATOM 0 HD2 TYR A 110 -1.267 14.908 -2.833 1.00 0.00 H new ATOM 0 HE1 TYR A 110 3.002 14.366 -5.213 1.00 0.00 H new ATOM 0 HE2 TYR A 110 -0.741 16.349 -4.750 1.00 0.00 H new ATOM 0 HH TYR A 110 0.718 16.875 -6.325 1.00 0.00 H new ATOM 1678 N LYS A 111 1.308 14.641 1.260 1.00 0.00 N ATOM 1679 CA LYS A 111 1.306 15.945 1.912 1.00 0.00 C ATOM 1680 C LYS A 111 1.195 15.768 3.424 1.00 0.00 C ATOM 1681 O LYS A 111 1.307 14.654 3.932 1.00 0.00 O ATOM 1682 CB LYS A 111 0.144 16.799 1.393 1.00 0.00 C ATOM 1683 CG LYS A 111 -1.174 16.045 1.312 1.00 0.00 C ATOM 1684 CD LYS A 111 -2.134 16.477 2.407 1.00 0.00 C ATOM 1685 CE LYS A 111 -3.127 17.511 1.902 1.00 0.00 C ATOM 1686 NZ LYS A 111 -4.011 16.958 0.837 1.00 0.00 N ATOM 0 H LYS A 111 1.376 13.854 1.905 1.00 0.00 H new ATOM 0 HA LYS A 111 2.241 16.456 1.681 1.00 0.00 H new ATOM 0 HB2 LYS A 111 0.019 17.664 2.045 1.00 0.00 H new ATOM 0 HB3 LYS A 111 0.397 17.180 0.404 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -1.632 16.216 0.338 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -0.987 14.974 1.393 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -2.673 15.608 2.784 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -1.571 16.890 3.244 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -3.737 17.865 2.733 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -2.587 18.374 1.513 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -4.922 17.459 0.848 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -3.558 17.084 -0.090 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -4.171 15.945 1.010 1.00 0.00 H new ATOM 1700 N ALA A 112 0.975 16.864 4.141 1.00 0.00 N ATOM 1701 CA ALA A 112 0.853 16.807 5.591 1.00 0.00 C ATOM 1702 C ALA A 112 -0.609 16.707 6.023 1.00 0.00 C ATOM 1703 O ALA A 112 -1.488 17.326 5.423 1.00 0.00 O ATOM 1704 CB ALA A 112 1.507 18.027 6.223 1.00 0.00 C ATOM 0 H ALA A 112 0.878 17.798 3.743 1.00 0.00 H new ATOM 0 HA ALA A 112 1.366 15.909 5.936 1.00 0.00 H new ATOM 0 HB1 ALA A 112 1.409 17.972 7.307 1.00 0.00 H new ATOM 0 HB2 ALA A 112 2.563 18.053 5.955 1.00 0.00 H new ATOM 0 HB3 ALA A 112 1.018 18.931 5.860 1.00 0.00 H new ATOM 1710 N MET A 113 -0.858 15.927 7.071 1.00 0.00 N ATOM 1711 CA MET A 113 -2.208 15.747 7.591 1.00 0.00 C ATOM 1712 C MET A 113 -2.568 16.877 8.551 1.00 0.00 C ATOM 1713 O MET A 113 -1.957 17.025 9.609 1.00 0.00 O ATOM 1714 CB MET A 113 -2.322 14.399 8.306 1.00 0.00 C ATOM 1715 CG MET A 113 -2.154 13.203 7.382 1.00 0.00 C ATOM 1716 SD MET A 113 -1.083 11.930 8.079 1.00 0.00 S ATOM 1717 CE MET A 113 -1.742 11.803 9.740 1.00 0.00 C ATOM 0 H MET A 113 -0.140 15.409 7.577 1.00 0.00 H new ATOM 0 HA MET A 113 -2.905 15.766 6.753 1.00 0.00 H new ATOM 0 HB2 MET A 113 -1.568 14.349 9.092 1.00 0.00 H new ATOM 0 HB3 MET A 113 -3.295 14.337 8.793 1.00 0.00 H new ATOM 0 HG2 MET A 113 -3.133 12.773 7.170 1.00 0.00 H new ATOM 0 HG3 MET A 113 -1.741 13.539 6.431 1.00 0.00 H new ATOM 0 HE1 MET A 113 -1.865 10.752 10.003 1.00 0.00 H new ATOM 0 HE2 MET A 113 -1.054 12.274 10.442 1.00 0.00 H new ATOM 0 HE3 MET A 113 -2.708 12.305 9.787 1.00 0.00 H new ATOM 1727 N LYS A 114 -3.558 17.677 8.167 1.00 0.00 N ATOM 1728 CA LYS A 114 -3.999 18.804 8.983 1.00 0.00 C ATOM 1729 C LYS A 114 -4.552 18.341 10.329 1.00 0.00 C ATOM 1730 O LYS A 114 -4.689 19.140 11.257 1.00 0.00 O ATOM 1731 CB LYS A 114 -5.060 19.614 8.237 1.00 0.00 C ATOM 1732 CG LYS A 114 -4.487 20.749 7.405 1.00 0.00 C ATOM 1733 CD LYS A 114 -4.294 20.336 5.955 1.00 0.00 C ATOM 1734 CE LYS A 114 -2.871 19.873 5.691 1.00 0.00 C ATOM 1735 NZ LYS A 114 -2.042 20.949 5.077 1.00 0.00 N ATOM 0 H LYS A 114 -4.072 17.565 7.293 1.00 0.00 H new ATOM 0 HA LYS A 114 -3.130 19.433 9.174 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -5.623 18.946 7.586 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -5.766 20.025 8.959 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -5.154 21.609 7.453 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -3.531 21.063 7.825 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -4.990 19.534 5.709 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -4.531 21.176 5.302 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -2.414 19.552 6.627 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -2.888 19.006 5.031 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -1.078 20.594 4.913 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -2.464 21.238 4.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -2.005 21.767 5.718 1.00 0.00 H new ATOM 1749 N LYS A 115 -4.868 17.053 10.438 1.00 0.00 N ATOM 1750 CA LYS A 115 -5.404 16.510 11.683 1.00 0.00 C ATOM 1751 C LYS A 115 -4.381 15.599 12.365 1.00 0.00 C ATOM 1752 O LYS A 115 -3.182 15.709 12.107 1.00 0.00 O ATOM 1753 CB LYS A 115 -6.736 15.789 11.437 1.00 0.00 C ATOM 1754 CG LYS A 115 -6.824 15.101 10.094 1.00 0.00 C ATOM 1755 CD LYS A 115 -6.034 13.812 10.097 1.00 0.00 C ATOM 1756 CE LYS A 115 -6.638 12.801 11.060 1.00 0.00 C ATOM 1757 NZ LYS A 115 -8.098 12.622 10.832 1.00 0.00 N ATOM 0 H LYS A 115 -4.763 16.371 9.687 1.00 0.00 H new ATOM 0 HA LYS A 115 -5.604 17.339 12.361 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -6.888 15.049 12.223 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -7.549 16.511 11.518 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -7.867 14.893 9.855 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -6.445 15.763 9.316 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -6.013 13.393 9.091 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -5.001 14.016 10.379 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -6.132 11.842 10.945 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -6.468 13.130 12.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -8.390 11.683 11.170 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -8.623 13.355 11.351 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -8.303 12.703 9.816 1.00 0.00 H new ATOM 1771 N GLU A 116 -4.845 14.722 13.251 1.00 0.00 N ATOM 1772 CA GLU A 116 -3.953 13.834 13.980 1.00 0.00 C ATOM 1773 C GLU A 116 -3.612 12.586 13.180 1.00 0.00 C ATOM 1774 O GLU A 116 -4.177 12.335 12.116 1.00 0.00 O ATOM 1775 CB GLU A 116 -4.592 13.436 15.307 1.00 0.00 C ATOM 1776 CG GLU A 116 -4.657 14.569 16.318 1.00 0.00 C ATOM 1777 CD GLU A 116 -4.344 14.111 17.729 1.00 0.00 C ATOM 1778 OE1 GLU A 116 -4.426 12.892 17.991 1.00 0.00 O ATOM 1779 OE2 GLU A 116 -4.018 14.971 18.575 1.00 0.00 O ATOM 0 H GLU A 116 -5.833 14.610 13.479 1.00 0.00 H new ATOM 0 HA GLU A 116 -3.024 14.375 14.161 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -5.601 13.070 15.119 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -4.028 12.608 15.738 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -3.953 15.350 16.029 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -5.652 15.013 16.297 1.00 0.00 H new ATOM 1786 N PHE A 117 -2.684 11.802 13.716 1.00 0.00 N ATOM 1787 CA PHE A 117 -2.251 10.565 13.084 1.00 0.00 C ATOM 1788 C PHE A 117 -2.744 9.364 13.881 1.00 0.00 C ATOM 1789 O PHE A 117 -2.888 9.434 15.101 1.00 0.00 O ATOM 1790 CB PHE A 117 -0.725 10.517 12.962 1.00 0.00 C ATOM 1791 CG PHE A 117 -0.001 11.334 13.998 1.00 0.00 C ATOM 1792 CD1 PHE A 117 0.235 10.821 15.263 1.00 0.00 C ATOM 1793 CD2 PHE A 117 0.441 12.614 13.704 1.00 0.00 C ATOM 1794 CE1 PHE A 117 0.900 11.569 16.216 1.00 0.00 C ATOM 1795 CE2 PHE A 117 1.105 13.368 14.653 1.00 0.00 C ATOM 1796 CZ PHE A 117 1.334 12.844 15.911 1.00 0.00 C ATOM 0 H PHE A 117 -2.213 12.006 14.597 1.00 0.00 H new ATOM 0 HA PHE A 117 -2.679 10.530 12.082 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -0.397 9.480 13.038 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -0.439 10.870 11.971 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -0.105 9.825 15.507 1.00 0.00 H new ATOM 0 HD2 PHE A 117 0.265 13.027 12.722 1.00 0.00 H new ATOM 0 HE1 PHE A 117 1.080 11.157 17.198 1.00 0.00 H new ATOM 0 HE2 PHE A 117 1.444 14.365 14.412 1.00 0.00 H new ATOM 0 HZ PHE A 117 1.852 13.431 16.655 1.00 0.00 H new ATOM 1806 N PRO A 118 -3.008 8.245 13.197 1.00 0.00 N ATOM 1807 CA PRO A 118 -3.483 7.026 13.836 1.00 0.00 C ATOM 1808 C PRO A 118 -2.354 6.202 14.420 1.00 0.00 C ATOM 1809 O PRO A 118 -1.245 6.204 13.889 1.00 0.00 O ATOM 1810 CB PRO A 118 -4.153 6.283 12.688 1.00 0.00 C ATOM 1811 CG PRO A 118 -3.389 6.693 11.476 1.00 0.00 C ATOM 1812 CD PRO A 118 -2.860 8.080 11.740 1.00 0.00 C ATOM 0 HA PRO A 118 -4.143 7.229 14.679 1.00 0.00 H new ATOM 0 HB2 PRO A 118 -4.111 5.204 12.836 1.00 0.00 H new ATOM 0 HB3 PRO A 118 -5.206 6.552 12.603 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -2.572 5.999 11.282 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -4.030 6.686 10.595 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -1.819 8.176 11.431 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -3.426 8.834 11.193 1.00 0.00 H new ATOM 1820 N SER A 119 -2.648 5.478 15.498 1.00 0.00 N ATOM 1821 CA SER A 119 -1.651 4.614 16.125 1.00 0.00 C ATOM 1822 C SER A 119 -1.328 3.513 15.135 1.00 0.00 C ATOM 1823 O SER A 119 -1.728 2.361 15.300 1.00 0.00 O ATOM 1824 CB SER A 119 -2.182 4.023 17.432 1.00 0.00 C ATOM 1825 OG SER A 119 -1.131 3.799 18.355 1.00 0.00 O ATOM 0 H SER A 119 -3.561 5.472 15.952 1.00 0.00 H new ATOM 0 HA SER A 119 -0.757 5.185 16.375 1.00 0.00 H new ATOM 0 HB2 SER A 119 -2.916 4.700 17.869 1.00 0.00 H new ATOM 0 HB3 SER A 119 -2.697 3.084 17.227 1.00 0.00 H new ATOM 0 HG SER A 119 -1.497 3.423 19.183 1.00 0.00 H new ATOM 1831 N ILE A 120 -0.666 3.914 14.064 1.00 0.00 N ATOM 1832 CA ILE A 120 -0.349 3.023 12.975 1.00 0.00 C ATOM 1833 C ILE A 120 0.960 3.429 12.301 1.00 0.00 C ATOM 1834 O ILE A 120 1.809 2.588 12.007 1.00 0.00 O ATOM 1835 CB ILE A 120 -1.516 3.082 11.969 1.00 0.00 C ATOM 1836 CG1 ILE A 120 -2.770 2.482 12.598 1.00 0.00 C ATOM 1837 CG2 ILE A 120 -1.183 2.383 10.672 1.00 0.00 C ATOM 1838 CD1 ILE A 120 -3.939 2.388 11.648 1.00 0.00 C ATOM 0 H ILE A 120 -0.335 4.869 13.930 1.00 0.00 H new ATOM 0 HA ILE A 120 -0.217 2.007 13.348 1.00 0.00 H new ATOM 0 HB ILE A 120 -1.698 4.129 11.728 1.00 0.00 H new ATOM 0 HG12 ILE A 120 -2.537 1.485 12.973 1.00 0.00 H new ATOM 0 HG13 ILE A 120 -3.059 3.086 13.458 1.00 0.00 H new ATOM 0 HG21 ILE A 120 -2.034 2.450 9.994 1.00 0.00 H new ATOM 0 HG22 ILE A 120 -0.316 2.859 10.214 1.00 0.00 H new ATOM 0 HG23 ILE A 120 -0.959 1.335 10.871 1.00 0.00 H new ATOM 0 HD11 ILE A 120 -4.794 1.952 12.165 1.00 0.00 H new ATOM 0 HD12 ILE A 120 -4.200 3.385 11.292 1.00 0.00 H new ATOM 0 HD13 ILE A 120 -3.669 1.759 10.800 1.00 0.00 H new ATOM 1850 N LEU A 121 1.115 4.728 12.071 1.00 0.00 N ATOM 1851 CA LEU A 121 2.320 5.261 11.449 1.00 0.00 C ATOM 1852 C LEU A 121 3.017 6.246 12.384 1.00 0.00 C ATOM 1853 O LEU A 121 3.648 7.206 11.940 1.00 0.00 O ATOM 1854 CB LEU A 121 1.997 5.937 10.105 1.00 0.00 C ATOM 1855 CG LEU A 121 0.773 6.866 10.079 1.00 0.00 C ATOM 1856 CD1 LEU A 121 -0.514 6.065 9.955 1.00 0.00 C ATOM 1857 CD2 LEU A 121 0.733 7.765 11.309 1.00 0.00 C ATOM 0 H LEU A 121 0.417 5.434 12.307 1.00 0.00 H new ATOM 0 HA LEU A 121 2.994 4.426 11.256 1.00 0.00 H new ATOM 0 HB2 LEU A 121 2.869 6.513 9.795 1.00 0.00 H new ATOM 0 HB3 LEU A 121 1.849 5.157 9.358 1.00 0.00 H new ATOM 0 HG LEU A 121 0.863 7.506 9.201 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -1.366 6.745 9.939 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -0.495 5.486 9.032 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -0.605 5.389 10.805 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -0.145 8.410 11.260 1.00 0.00 H new ATOM 0 HD22 LEU A 121 0.682 7.150 12.208 1.00 0.00 H new ATOM 0 HD23 LEU A 121 1.633 8.379 11.340 1.00 0.00 H new ATOM 1869 N ARG A 122 2.882 6.001 13.683 1.00 0.00 N ATOM 1870 CA ARG A 122 3.477 6.858 14.703 1.00 0.00 C ATOM 1871 C ARG A 122 4.952 7.140 14.431 1.00 0.00 C ATOM 1872 O ARG A 122 5.411 8.271 14.588 1.00 0.00 O ATOM 1873 CB ARG A 122 3.317 6.221 16.085 1.00 0.00 C ATOM 1874 CG ARG A 122 3.758 4.768 16.143 1.00 0.00 C ATOM 1875 CD ARG A 122 3.111 4.036 17.306 1.00 0.00 C ATOM 1876 NE ARG A 122 3.974 2.986 17.843 1.00 0.00 N ATOM 1877 CZ ARG A 122 5.130 3.220 18.457 1.00 0.00 C ATOM 1878 NH1 ARG A 122 5.568 4.464 18.616 1.00 0.00 N ATOM 1879 NH2 ARG A 122 5.854 2.208 18.916 1.00 0.00 N ATOM 0 H ARG A 122 2.361 5.208 14.057 1.00 0.00 H new ATOM 0 HA ARG A 122 2.949 7.811 14.673 1.00 0.00 H new ATOM 0 HB2 ARG A 122 3.894 6.796 16.809 1.00 0.00 H new ATOM 0 HB3 ARG A 122 2.272 6.286 16.387 1.00 0.00 H new ATOM 0 HG2 ARG A 122 3.498 4.270 15.209 1.00 0.00 H new ATOM 0 HG3 ARG A 122 4.843 4.719 16.239 1.00 0.00 H new ATOM 0 HD2 ARG A 122 2.874 4.749 18.096 1.00 0.00 H new ATOM 0 HD3 ARG A 122 2.168 3.598 16.979 1.00 0.00 H new ATOM 0 HE ARG A 122 3.672 2.017 17.741 1.00 0.00 H new ATOM 0 HH11 ARG A 122 5.017 5.247 18.266 1.00 0.00 H new ATOM 0 HH12 ARG A 122 6.456 4.636 19.088 1.00 0.00 H new ATOM 0 HH21 ARG A 122 5.524 1.250 18.798 1.00 0.00 H new ATOM 0 HH22 ARG A 122 6.741 2.388 19.387 1.00 0.00 H new ATOM 1893 N PHE A 123 5.696 6.113 14.038 1.00 0.00 N ATOM 1894 CA PHE A 123 7.122 6.279 13.764 1.00 0.00 C ATOM 1895 C PHE A 123 7.659 5.163 12.875 1.00 0.00 C ATOM 1896 O PHE A 123 8.859 4.887 12.872 1.00 0.00 O ATOM 1897 CB PHE A 123 7.905 6.318 15.078 1.00 0.00 C ATOM 1898 CG PHE A 123 9.029 7.317 15.079 1.00 0.00 C ATOM 1899 CD1 PHE A 123 8.777 8.659 14.856 1.00 0.00 C ATOM 1900 CD2 PHE A 123 10.334 6.910 15.305 1.00 0.00 C ATOM 1901 CE1 PHE A 123 9.808 9.581 14.857 1.00 0.00 C ATOM 1902 CE2 PHE A 123 11.369 7.826 15.308 1.00 0.00 C ATOM 1903 CZ PHE A 123 11.105 9.164 15.084 1.00 0.00 C ATOM 0 H PHE A 123 5.343 5.166 13.902 1.00 0.00 H new ATOM 0 HA PHE A 123 7.250 7.222 13.232 1.00 0.00 H new ATOM 0 HB2 PHE A 123 7.220 6.553 15.893 1.00 0.00 H new ATOM 0 HB3 PHE A 123 8.311 5.327 15.279 1.00 0.00 H new ATOM 0 HD1 PHE A 123 7.764 8.990 14.679 1.00 0.00 H new ATOM 0 HD2 PHE A 123 10.545 5.865 15.481 1.00 0.00 H new ATOM 0 HE1 PHE A 123 9.599 10.626 14.680 1.00 0.00 H new ATOM 0 HE2 PHE A 123 12.382 7.497 15.485 1.00 0.00 H new ATOM 0 HZ PHE A 123 11.912 9.882 15.086 1.00 0.00 H new ATOM 1913 N ILE A 124 6.772 4.522 12.123 1.00 0.00 N ATOM 1914 CA ILE A 124 7.165 3.445 11.239 1.00 0.00 C ATOM 1915 C ILE A 124 7.589 3.988 9.876 1.00 0.00 C ATOM 1916 O ILE A 124 7.542 5.195 9.639 1.00 0.00 O ATOM 1917 CB ILE A 124 6.013 2.436 11.072 1.00 0.00 C ATOM 1918 CG1 ILE A 124 4.952 2.965 10.099 1.00 0.00 C ATOM 1919 CG2 ILE A 124 5.389 2.117 12.424 1.00 0.00 C ATOM 1920 CD1 ILE A 124 3.751 2.053 9.953 1.00 0.00 C ATOM 0 H ILE A 124 5.774 4.734 12.112 1.00 0.00 H new ATOM 0 HA ILE A 124 8.017 2.934 11.687 1.00 0.00 H new ATOM 0 HB ILE A 124 6.424 1.518 10.652 1.00 0.00 H new ATOM 0 HG12 ILE A 124 4.615 3.944 10.440 1.00 0.00 H new ATOM 0 HG13 ILE A 124 5.409 3.109 9.120 1.00 0.00 H new ATOM 0 HG21 ILE A 124 4.576 1.403 12.290 1.00 0.00 H new ATOM 0 HG22 ILE A 124 6.145 1.688 13.081 1.00 0.00 H new ATOM 0 HG23 ILE A 124 4.998 3.032 12.869 1.00 0.00 H new ATOM 0 HD11 ILE A 124 3.044 2.492 9.250 1.00 0.00 H new ATOM 0 HD12 ILE A 124 4.075 1.081 9.582 1.00 0.00 H new ATOM 0 HD13 ILE A 124 3.269 1.929 10.922 1.00 0.00 H new ATOM 1932 N THR A 125 8.004 3.095 8.980 1.00 0.00 N ATOM 1933 CA THR A 125 8.432 3.503 7.644 1.00 0.00 C ATOM 1934 C THR A 125 7.329 4.291 6.946 1.00 0.00 C ATOM 1935 O THR A 125 6.394 3.713 6.394 1.00 0.00 O ATOM 1936 CB THR A 125 8.801 2.278 6.809 1.00 0.00 C ATOM 1937 OG1 THR A 125 9.813 1.520 7.447 1.00 0.00 O ATOM 1938 CG2 THR A 125 9.295 2.626 5.420 1.00 0.00 C ATOM 0 H THR A 125 8.053 2.091 9.153 1.00 0.00 H new ATOM 0 HA THR A 125 9.309 4.142 7.746 1.00 0.00 H new ATOM 0 HB THR A 125 7.878 1.705 6.717 1.00 0.00 H new ATOM 0 HG1 THR A 125 10.033 0.740 6.897 1.00 0.00 H new ATOM 0 HG21 THR A 125 9.540 1.711 4.881 1.00 0.00 H new ATOM 0 HG22 THR A 125 8.517 3.167 4.882 1.00 0.00 H new ATOM 0 HG23 THR A 125 10.185 3.251 5.496 1.00 0.00 H new ATOM 1946 N VAL A 126 7.439 5.615 6.976 1.00 0.00 N ATOM 1947 CA VAL A 126 6.446 6.474 6.352 1.00 0.00 C ATOM 1948 C VAL A 126 7.071 7.381 5.296 1.00 0.00 C ATOM 1949 O VAL A 126 8.088 8.029 5.543 1.00 0.00 O ATOM 1950 CB VAL A 126 5.720 7.333 7.404 1.00 0.00 C ATOM 1951 CG1 VAL A 126 6.631 8.433 7.936 1.00 0.00 C ATOM 1952 CG2 VAL A 126 4.441 7.918 6.827 1.00 0.00 C ATOM 0 H VAL A 126 8.206 6.114 7.426 1.00 0.00 H new ATOM 0 HA VAL A 126 5.723 5.821 5.863 1.00 0.00 H new ATOM 0 HB VAL A 126 5.453 6.689 8.242 1.00 0.00 H new ATOM 0 HG11 VAL A 126 6.093 9.024 8.677 1.00 0.00 H new ATOM 0 HG12 VAL A 126 7.511 7.985 8.398 1.00 0.00 H new ATOM 0 HG13 VAL A 126 6.942 9.077 7.114 1.00 0.00 H new ATOM 0 HG21 VAL A 126 3.942 8.522 7.585 1.00 0.00 H new ATOM 0 HG22 VAL A 126 4.682 8.543 5.967 1.00 0.00 H new ATOM 0 HG23 VAL A 126 3.780 7.110 6.514 1.00 0.00 H new ATOM 1962 N CYS A 127 6.452 7.425 4.122 1.00 0.00 N ATOM 1963 CA CYS A 127 6.942 8.254 3.028 1.00 0.00 C ATOM 1964 C CYS A 127 6.000 9.427 2.771 1.00 0.00 C ATOM 1965 O CYS A 127 4.789 9.246 2.635 1.00 0.00 O ATOM 1966 CB CYS A 127 7.099 7.417 1.757 1.00 0.00 C ATOM 1967 SG CYS A 127 8.782 7.400 1.094 1.00 0.00 S ATOM 0 H CYS A 127 5.608 6.895 3.903 1.00 0.00 H new ATOM 0 HA CYS A 127 7.916 8.652 3.313 1.00 0.00 H new ATOM 0 HB2 CYS A 127 6.792 6.393 1.968 1.00 0.00 H new ATOM 0 HB3 CYS A 127 6.422 7.802 0.994 1.00 0.00 H new ATOM 0 HG CYS A 127 8.762 6.964 -0.131 1.00 0.00 H new ATOM 1973 N ASP A 128 6.563 10.627 2.705 1.00 0.00 N ATOM 1974 CA ASP A 128 5.775 11.831 2.464 1.00 0.00 C ATOM 1975 C ASP A 128 6.445 12.720 1.426 1.00 0.00 C ATOM 1976 O ASP A 128 7.672 12.823 1.384 1.00 0.00 O ATOM 1977 CB ASP A 128 5.577 12.608 3.767 1.00 0.00 C ATOM 1978 CG ASP A 128 4.441 13.608 3.679 1.00 0.00 C ATOM 1979 OD1 ASP A 128 4.051 13.965 2.548 1.00 0.00 O ATOM 1980 OD2 ASP A 128 3.942 14.032 4.742 1.00 0.00 O ATOM 0 H ASP A 128 7.563 10.793 2.815 1.00 0.00 H new ATOM 0 HA ASP A 128 4.801 11.526 2.081 1.00 0.00 H new ATOM 0 HB2 ASP A 128 5.378 11.907 4.578 1.00 0.00 H new ATOM 0 HB3 ASP A 128 6.499 13.132 4.018 1.00 0.00 H new ATOM 1985 N TYR A 129 5.637 13.361 0.588 1.00 0.00 N ATOM 1986 CA TYR A 129 6.165 14.240 -0.446 1.00 0.00 C ATOM 1987 C TYR A 129 6.581 15.578 0.153 1.00 0.00 C ATOM 1988 O TYR A 129 5.829 16.550 0.113 1.00 0.00 O ATOM 1989 CB TYR A 129 5.134 14.463 -1.557 1.00 0.00 C ATOM 1990 CG TYR A 129 4.878 13.241 -2.415 1.00 0.00 C ATOM 1991 CD1 TYR A 129 4.579 12.009 -1.843 1.00 0.00 C ATOM 1992 CD2 TYR A 129 4.935 13.320 -3.801 1.00 0.00 C ATOM 1993 CE1 TYR A 129 4.344 10.895 -2.627 1.00 0.00 C ATOM 1994 CE2 TYR A 129 4.703 12.211 -4.591 1.00 0.00 C ATOM 1995 CZ TYR A 129 4.408 11.002 -4.000 1.00 0.00 C ATOM 1996 OH TYR A 129 4.177 9.895 -4.785 1.00 0.00 O ATOM 0 H TYR A 129 4.620 13.288 0.605 1.00 0.00 H new ATOM 0 HA TYR A 129 7.041 13.758 -0.880 1.00 0.00 H new ATOM 0 HB2 TYR A 129 4.194 14.782 -1.107 1.00 0.00 H new ATOM 0 HB3 TYR A 129 5.474 15.278 -2.196 1.00 0.00 H new ATOM 0 HD1 TYR A 129 4.530 11.921 -0.768 1.00 0.00 H new ATOM 0 HD2 TYR A 129 5.165 14.266 -4.269 1.00 0.00 H new ATOM 0 HE1 TYR A 129 4.112 9.946 -2.167 1.00 0.00 H new ATOM 0 HE2 TYR A 129 4.753 12.291 -5.667 1.00 0.00 H new ATOM 0 HH TYR A 129 4.260 10.141 -5.730 1.00 0.00 H new ATOM 2006 N THR A 130 7.791 15.620 0.694 1.00 0.00 N ATOM 2007 CA THR A 130 8.320 16.842 1.290 1.00 0.00 C ATOM 2008 C THR A 130 8.903 17.730 0.202 1.00 0.00 C ATOM 2009 O THR A 130 8.522 18.892 0.054 1.00 0.00 O ATOM 2010 CB THR A 130 9.392 16.510 2.331 1.00 0.00 C ATOM 2011 OG1 THR A 130 10.534 15.945 1.712 1.00 0.00 O ATOM 2012 CG2 THR A 130 8.917 15.541 3.391 1.00 0.00 C ATOM 0 H THR A 130 8.426 14.823 0.733 1.00 0.00 H new ATOM 0 HA THR A 130 7.509 17.371 1.790 1.00 0.00 H new ATOM 0 HB THR A 130 9.632 17.459 2.811 1.00 0.00 H new ATOM 0 HG1 THR A 130 11.208 15.741 2.393 1.00 0.00 H new ATOM 0 HG21 THR A 130 9.725 15.349 4.097 1.00 0.00 H new ATOM 0 HG22 THR A 130 8.067 15.970 3.921 1.00 0.00 H new ATOM 0 HG23 THR A 130 8.616 14.605 2.920 1.00 0.00 H new ATOM 2020 N ASN A 131 9.812 17.155 -0.572 1.00 0.00 N ATOM 2021 CA ASN A 131 10.445 17.858 -1.676 1.00 0.00 C ATOM 2022 C ASN A 131 10.166 17.108 -2.974 1.00 0.00 C ATOM 2023 O ASN A 131 11.086 16.677 -3.667 1.00 0.00 O ATOM 2024 CB ASN A 131 11.954 17.980 -1.446 1.00 0.00 C ATOM 2025 CG ASN A 131 12.302 19.080 -0.463 1.00 0.00 C ATOM 2026 OD1 ASN A 131 11.422 19.680 0.154 1.00 0.00 O ATOM 2027 ND2 ASN A 131 13.592 19.354 -0.315 1.00 0.00 N ATOM 0 H ASN A 131 10.130 16.193 -0.453 1.00 0.00 H new ATOM 0 HA ASN A 131 10.032 18.865 -1.742 1.00 0.00 H new ATOM 0 HB2 ASN A 131 12.340 17.030 -1.076 1.00 0.00 H new ATOM 0 HB3 ASN A 131 12.449 18.177 -2.397 1.00 0.00 H new ATOM 0 HD21 ASN A 131 13.887 20.087 0.330 1.00 0.00 H new ATOM 0 HD22 ASN A 131 14.289 18.832 -0.847 1.00 0.00 H new ATOM 2034 N PRO A 132 8.874 16.929 -3.308 1.00 0.00 N ATOM 2035 CA PRO A 132 8.450 16.216 -4.510 1.00 0.00 C ATOM 2036 C PRO A 132 9.267 16.604 -5.734 1.00 0.00 C ATOM 2037 O PRO A 132 9.466 15.801 -6.645 1.00 0.00 O ATOM 2038 CB PRO A 132 6.979 16.630 -4.689 1.00 0.00 C ATOM 2039 CG PRO A 132 6.694 17.629 -3.610 1.00 0.00 C ATOM 2040 CD PRO A 132 7.720 17.398 -2.540 1.00 0.00 C ATOM 0 HA PRO A 132 8.587 15.140 -4.406 1.00 0.00 H new ATOM 0 HB2 PRO A 132 6.814 17.064 -5.675 1.00 0.00 H new ATOM 0 HB3 PRO A 132 6.318 15.767 -4.605 1.00 0.00 H new ATOM 0 HG2 PRO A 132 6.757 18.646 -3.996 1.00 0.00 H new ATOM 0 HG3 PRO A 132 5.686 17.499 -3.216 1.00 0.00 H new ATOM 0 HD2 PRO A 132 7.943 18.311 -1.987 1.00 0.00 H new ATOM 0 HD3 PRO A 132 7.388 16.658 -1.812 1.00 0.00 H new ATOM 2048 N CYS A 133 9.742 17.840 -5.739 1.00 0.00 N ATOM 2049 CA CYS A 133 10.548 18.351 -6.843 1.00 0.00 C ATOM 2050 C CYS A 133 11.689 17.394 -7.172 1.00 0.00 C ATOM 2051 O CYS A 133 11.964 17.112 -8.339 1.00 0.00 O ATOM 2052 CB CYS A 133 11.105 19.734 -6.496 1.00 0.00 C ATOM 2053 SG CYS A 133 10.227 21.102 -7.289 1.00 0.00 S ATOM 0 H CYS A 133 9.584 18.512 -4.988 1.00 0.00 H new ATOM 0 HA CYS A 133 9.908 18.436 -7.721 1.00 0.00 H new ATOM 0 HB2 CYS A 133 11.066 19.869 -5.415 1.00 0.00 H new ATOM 0 HB3 CYS A 133 12.155 19.774 -6.785 1.00 0.00 H new ATOM 0 HG CYS A 133 10.768 22.229 -6.934 1.00 0.00 H new ATOM 2059 N THR A 134 12.346 16.895 -6.133 1.00 0.00 N ATOM 2060 CA THR A 134 13.456 15.962 -6.300 1.00 0.00 C ATOM 2061 C THR A 134 13.126 14.602 -5.688 1.00 0.00 C ATOM 2062 O THR A 134 13.693 13.582 -6.079 1.00 0.00 O ATOM 2063 CB THR A 134 14.726 16.530 -5.662 1.00 0.00 C ATOM 2064 OG1 THR A 134 15.843 15.709 -5.951 1.00 0.00 O ATOM 2065 CG2 THR A 134 14.632 16.664 -4.157 1.00 0.00 C ATOM 0 H THR A 134 12.130 17.121 -5.162 1.00 0.00 H new ATOM 0 HA THR A 134 13.624 15.825 -7.368 1.00 0.00 H new ATOM 0 HB THR A 134 14.845 17.524 -6.092 1.00 0.00 H new ATOM 0 HG1 THR A 134 16.645 16.090 -5.536 1.00 0.00 H new ATOM 0 HG21 THR A 134 15.565 17.072 -3.769 1.00 0.00 H new ATOM 0 HG22 THR A 134 13.810 17.333 -3.902 1.00 0.00 H new ATOM 0 HG23 THR A 134 14.453 15.684 -3.715 1.00 0.00 H new ATOM 2073 N LYS A 135 12.204 14.594 -4.727 1.00 0.00 N ATOM 2074 CA LYS A 135 11.796 13.361 -4.064 1.00 0.00 C ATOM 2075 C LYS A 135 10.891 12.518 -4.962 1.00 0.00 C ATOM 2076 O LYS A 135 10.524 11.397 -4.608 1.00 0.00 O ATOM 2077 CB LYS A 135 11.076 13.679 -2.751 1.00 0.00 C ATOM 2078 CG LYS A 135 11.995 13.685 -1.540 1.00 0.00 C ATOM 2079 CD LYS A 135 11.816 12.433 -0.696 1.00 0.00 C ATOM 2080 CE LYS A 135 12.677 11.290 -1.208 1.00 0.00 C ATOM 2081 NZ LYS A 135 12.456 10.039 -0.432 1.00 0.00 N ATOM 0 H LYS A 135 11.726 15.430 -4.391 1.00 0.00 H new ATOM 0 HA LYS A 135 12.696 12.784 -3.852 1.00 0.00 H new ATOM 0 HB2 LYS A 135 10.595 14.653 -2.837 1.00 0.00 H new ATOM 0 HB3 LYS A 135 10.285 12.946 -2.593 1.00 0.00 H new ATOM 0 HG2 LYS A 135 13.032 13.757 -1.869 1.00 0.00 H new ATOM 0 HG3 LYS A 135 11.791 14.567 -0.932 1.00 0.00 H new ATOM 0 HD2 LYS A 135 12.076 12.651 0.340 1.00 0.00 H new ATOM 0 HD3 LYS A 135 10.768 12.133 -0.705 1.00 0.00 H new ATOM 0 HE2 LYS A 135 12.453 11.110 -2.259 1.00 0.00 H new ATOM 0 HE3 LYS A 135 13.728 11.573 -1.150 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 13.061 9.283 -0.812 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 12.694 10.204 0.567 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 11.458 9.755 -0.508 1.00 0.00 H new ATOM 2095 N SER A 136 10.534 13.058 -6.127 1.00 0.00 N ATOM 2096 CA SER A 136 9.674 12.350 -7.071 1.00 0.00 C ATOM 2097 C SER A 136 10.207 10.948 -7.369 1.00 0.00 C ATOM 2098 O SER A 136 9.461 10.076 -7.816 1.00 0.00 O ATOM 2099 CB SER A 136 9.547 13.148 -8.370 1.00 0.00 C ATOM 2100 OG SER A 136 8.632 12.532 -9.260 1.00 0.00 O ATOM 0 H SER A 136 10.828 13.984 -6.438 1.00 0.00 H new ATOM 0 HA SER A 136 8.690 12.247 -6.613 1.00 0.00 H new ATOM 0 HB2 SER A 136 9.215 14.162 -8.147 1.00 0.00 H new ATOM 0 HB3 SER A 136 10.524 13.230 -8.847 1.00 0.00 H new ATOM 0 HG SER A 136 8.568 13.062 -10.082 1.00 0.00 H new ATOM 2106 N TRP A 137 11.497 10.736 -7.116 1.00 0.00 N ATOM 2107 CA TRP A 137 12.119 9.438 -7.354 1.00 0.00 C ATOM 2108 C TRP A 137 11.483 8.351 -6.486 1.00 0.00 C ATOM 2109 O TRP A 137 11.699 7.161 -6.715 1.00 0.00 O ATOM 2110 CB TRP A 137 13.622 9.507 -7.071 1.00 0.00 C ATOM 2111 CG TRP A 137 14.373 10.401 -8.013 1.00 0.00 C ATOM 2112 CD1 TRP A 137 13.970 11.614 -8.494 1.00 0.00 C ATOM 2113 CD2 TRP A 137 15.661 10.152 -8.586 1.00 0.00 C ATOM 2114 NE1 TRP A 137 14.928 12.133 -9.329 1.00 0.00 N ATOM 2115 CE2 TRP A 137 15.976 11.253 -9.401 1.00 0.00 C ATOM 2116 CE3 TRP A 137 16.579 9.102 -8.486 1.00 0.00 C ATOM 2117 CZ2 TRP A 137 17.171 11.336 -10.113 1.00 0.00 C ATOM 2118 CZ3 TRP A 137 17.764 9.185 -9.193 1.00 0.00 C ATOM 2119 CH2 TRP A 137 18.051 10.295 -9.996 1.00 0.00 C ATOM 0 H TRP A 137 12.130 11.446 -6.747 1.00 0.00 H new ATOM 0 HA TRP A 137 11.959 9.182 -8.401 1.00 0.00 H new ATOM 0 HB2 TRP A 137 13.775 9.859 -6.051 1.00 0.00 H new ATOM 0 HB3 TRP A 137 14.040 8.502 -7.127 1.00 0.00 H new ATOM 0 HD1 TRP A 137 13.034 12.095 -8.253 1.00 0.00 H new ATOM 0 HE1 TRP A 137 14.869 13.027 -9.816 1.00 0.00 H new ATOM 0 HE3 TRP A 137 16.366 8.242 -7.868 1.00 0.00 H new ATOM 0 HZ2 TRP A 137 17.394 12.191 -10.734 1.00 0.00 H new ATOM 0 HZ3 TRP A 137 18.480 8.380 -9.125 1.00 0.00 H new ATOM 0 HH2 TRP A 137 18.987 10.330 -10.534 1.00 0.00 H new ATOM 2130 N PHE A 138 10.702 8.768 -5.485 1.00 0.00 N ATOM 2131 CA PHE A 138 10.034 7.837 -4.575 1.00 0.00 C ATOM 2132 C PHE A 138 9.480 6.622 -5.319 1.00 0.00 C ATOM 2133 O PHE A 138 9.434 5.518 -4.775 1.00 0.00 O ATOM 2134 CB PHE A 138 8.903 8.556 -3.830 1.00 0.00 C ATOM 2135 CG PHE A 138 8.054 7.648 -2.984 1.00 0.00 C ATOM 2136 CD1 PHE A 138 8.630 6.628 -2.242 1.00 0.00 C ATOM 2137 CD2 PHE A 138 6.680 7.813 -2.933 1.00 0.00 C ATOM 2138 CE1 PHE A 138 7.851 5.793 -1.465 1.00 0.00 C ATOM 2139 CE2 PHE A 138 5.894 6.980 -2.158 1.00 0.00 C ATOM 2140 CZ PHE A 138 6.482 5.969 -1.424 1.00 0.00 C ATOM 0 H PHE A 138 10.517 9.751 -5.285 1.00 0.00 H new ATOM 0 HA PHE A 138 10.774 7.480 -3.859 1.00 0.00 H new ATOM 0 HB2 PHE A 138 9.335 9.329 -3.195 1.00 0.00 H new ATOM 0 HB3 PHE A 138 8.266 9.060 -4.557 1.00 0.00 H new ATOM 0 HD1 PHE A 138 9.700 6.485 -2.272 1.00 0.00 H new ATOM 0 HD2 PHE A 138 6.216 8.602 -3.506 1.00 0.00 H new ATOM 0 HE1 PHE A 138 8.312 5.003 -0.890 1.00 0.00 H new ATOM 0 HE2 PHE A 138 4.824 7.120 -2.127 1.00 0.00 H new ATOM 0 HZ PHE A 138 5.871 5.316 -0.818 1.00 0.00 H new ATOM 2150 N TRP A 139 9.065 6.829 -6.566 1.00 0.00 N ATOM 2151 CA TRP A 139 8.521 5.745 -7.380 1.00 0.00 C ATOM 2152 C TRP A 139 9.466 4.546 -7.388 1.00 0.00 C ATOM 2153 O TRP A 139 9.030 3.396 -7.423 1.00 0.00 O ATOM 2154 CB TRP A 139 8.280 6.226 -8.813 1.00 0.00 C ATOM 2155 CG TRP A 139 6.990 6.974 -8.986 1.00 0.00 C ATOM 2156 CD1 TRP A 139 6.034 7.197 -8.037 1.00 0.00 C ATOM 2157 CD2 TRP A 139 6.518 7.597 -10.186 1.00 0.00 C ATOM 2158 NE1 TRP A 139 4.997 7.919 -8.574 1.00 0.00 N ATOM 2159 CE2 TRP A 139 5.269 8.177 -9.892 1.00 0.00 C ATOM 2160 CE3 TRP A 139 7.029 7.720 -11.481 1.00 0.00 C ATOM 2161 CZ2 TRP A 139 4.527 8.870 -10.844 1.00 0.00 C ATOM 2162 CZ3 TRP A 139 6.291 8.409 -12.427 1.00 0.00 C ATOM 2163 CH2 TRP A 139 5.052 8.976 -12.104 1.00 0.00 C ATOM 0 H TRP A 139 9.095 7.735 -7.034 1.00 0.00 H new ATOM 0 HA TRP A 139 7.571 5.436 -6.943 1.00 0.00 H new ATOM 0 HB2 TRP A 139 9.107 6.869 -9.116 1.00 0.00 H new ATOM 0 HB3 TRP A 139 8.284 5.365 -9.482 1.00 0.00 H new ATOM 0 HD1 TRP A 139 6.086 6.855 -7.014 1.00 0.00 H new ATOM 0 HE1 TRP A 139 4.160 8.215 -8.073 1.00 0.00 H new ATOM 0 HE3 TRP A 139 7.983 7.285 -11.739 1.00 0.00 H new ATOM 0 HZ2 TRP A 139 3.571 9.308 -10.598 1.00 0.00 H new ATOM 0 HZ3 TRP A 139 6.677 8.511 -13.431 1.00 0.00 H new ATOM 0 HH2 TRP A 139 4.499 9.508 -12.864 1.00 0.00 H new ATOM 2174 N THR A 140 10.764 4.829 -7.346 1.00 0.00 N ATOM 2175 CA THR A 140 11.777 3.780 -7.344 1.00 0.00 C ATOM 2176 C THR A 140 11.922 3.174 -5.951 1.00 0.00 C ATOM 2177 O THR A 140 12.110 1.966 -5.805 1.00 0.00 O ATOM 2178 CB THR A 140 13.120 4.344 -7.814 1.00 0.00 C ATOM 2179 OG1 THR A 140 13.015 4.852 -9.132 1.00 0.00 O ATOM 2180 CG2 THR A 140 14.239 3.324 -7.807 1.00 0.00 C ATOM 0 H THR A 140 11.139 5.777 -7.313 1.00 0.00 H new ATOM 0 HA THR A 140 11.461 2.995 -8.031 1.00 0.00 H new ATOM 0 HB THR A 140 13.365 5.131 -7.101 1.00 0.00 H new ATOM 0 HG1 THR A 140 13.882 5.210 -9.415 1.00 0.00 H new ATOM 0 HG21 THR A 140 15.161 3.793 -8.151 1.00 0.00 H new ATOM 0 HG22 THR A 140 14.380 2.946 -6.794 1.00 0.00 H new ATOM 0 HG23 THR A 140 13.982 2.498 -8.470 1.00 0.00 H new ATOM 2188 N ARG A 141 11.833 4.021 -4.931 1.00 0.00 N ATOM 2189 CA ARG A 141 11.953 3.570 -3.550 1.00 0.00 C ATOM 2190 C ARG A 141 10.869 2.546 -3.220 1.00 0.00 C ATOM 2191 O ARG A 141 11.156 1.471 -2.693 1.00 0.00 O ATOM 2192 CB ARG A 141 11.861 4.759 -2.592 1.00 0.00 C ATOM 2193 CG ARG A 141 13.201 5.173 -2.006 1.00 0.00 C ATOM 2194 CD ARG A 141 13.624 4.253 -0.873 1.00 0.00 C ATOM 2195 NE ARG A 141 15.046 4.382 -0.564 1.00 0.00 N ATOM 2196 CZ ARG A 141 15.559 5.373 0.163 1.00 0.00 C ATOM 2197 NH1 ARG A 141 14.772 6.320 0.655 1.00 0.00 N ATOM 2198 NH2 ARG A 141 16.864 5.415 0.398 1.00 0.00 N ATOM 0 H ARG A 141 11.678 5.024 -5.035 1.00 0.00 H new ATOM 0 HA ARG A 141 12.926 3.095 -3.430 1.00 0.00 H new ATOM 0 HB2 ARG A 141 11.427 5.608 -3.120 1.00 0.00 H new ATOM 0 HB3 ARG A 141 11.180 4.508 -1.779 1.00 0.00 H new ATOM 0 HG2 ARG A 141 13.960 5.161 -2.788 1.00 0.00 H new ATOM 0 HG3 ARG A 141 13.138 6.197 -1.639 1.00 0.00 H new ATOM 0 HD2 ARG A 141 13.038 4.481 0.017 1.00 0.00 H new ATOM 0 HD3 ARG A 141 13.404 3.220 -1.144 1.00 0.00 H new ATOM 0 HE ARG A 141 15.683 3.672 -0.926 1.00 0.00 H new ATOM 0 HH11 ARG A 141 13.768 6.292 0.477 1.00 0.00 H new ATOM 0 HH12 ARG A 141 15.171 7.076 1.211 1.00 0.00 H new ATOM 0 HH21 ARG A 141 17.474 4.689 0.022 1.00 0.00 H new ATOM 0 HH22 ARG A 141 17.258 6.174 0.955 1.00 0.00 H new ATOM 2212 N LEU A 142 9.624 2.888 -3.536 1.00 0.00 N ATOM 2213 CA LEU A 142 8.499 1.999 -3.276 1.00 0.00 C ATOM 2214 C LEU A 142 8.521 0.807 -4.228 1.00 0.00 C ATOM 2215 O LEU A 142 8.103 -0.294 -3.872 1.00 0.00 O ATOM 2216 CB LEU A 142 7.177 2.758 -3.415 1.00 0.00 C ATOM 2217 CG LEU A 142 6.137 2.453 -2.336 1.00 0.00 C ATOM 2218 CD1 LEU A 142 5.632 1.024 -2.471 1.00 0.00 C ATOM 2219 CD2 LEU A 142 6.723 2.687 -0.949 1.00 0.00 C ATOM 0 H LEU A 142 9.370 3.774 -3.972 1.00 0.00 H new ATOM 0 HA LEU A 142 8.587 1.628 -2.255 1.00 0.00 H new ATOM 0 HB2 LEU A 142 7.387 3.828 -3.403 1.00 0.00 H new ATOM 0 HB3 LEU A 142 6.745 2.529 -4.389 1.00 0.00 H new ATOM 0 HG LEU A 142 5.292 3.129 -2.470 1.00 0.00 H new ATOM 0 HD11 LEU A 142 4.893 0.825 -1.695 1.00 0.00 H new ATOM 0 HD12 LEU A 142 5.174 0.891 -3.451 1.00 0.00 H new ATOM 0 HD13 LEU A 142 6.467 0.331 -2.363 1.00 0.00 H new ATOM 0 HD21 LEU A 142 5.969 2.465 -0.193 1.00 0.00 H new ATOM 0 HD22 LEU A 142 7.585 2.036 -0.804 1.00 0.00 H new ATOM 0 HD23 LEU A 142 7.034 3.727 -0.856 1.00 0.00 H new ATOM 2231 N ALA A 143 9.013 1.038 -5.442 1.00 0.00 N ATOM 2232 CA ALA A 143 9.092 -0.016 -6.447 1.00 0.00 C ATOM 2233 C ALA A 143 10.019 -1.137 -5.993 1.00 0.00 C ATOM 2234 O ALA A 143 9.738 -2.315 -6.213 1.00 0.00 O ATOM 2235 CB ALA A 143 9.565 0.558 -7.774 1.00 0.00 C ATOM 0 H ALA A 143 9.362 1.945 -5.753 1.00 0.00 H new ATOM 0 HA ALA A 143 8.095 -0.436 -6.579 1.00 0.00 H new ATOM 0 HB1 ALA A 143 9.620 -0.239 -8.516 1.00 0.00 H new ATOM 0 HB2 ALA A 143 8.863 1.321 -8.111 1.00 0.00 H new ATOM 0 HB3 ALA A 143 10.551 1.004 -7.647 1.00 0.00 H new ATOM 2241 N LYS A 144 11.124 -0.763 -5.359 1.00 0.00 N ATOM 2242 CA LYS A 144 12.096 -1.735 -4.874 1.00 0.00 C ATOM 2243 C LYS A 144 11.754 -2.202 -3.460 1.00 0.00 C ATOM 2244 O LYS A 144 12.208 -3.257 -3.021 1.00 0.00 O ATOM 2245 CB LYS A 144 13.502 -1.135 -4.897 1.00 0.00 C ATOM 2246 CG LYS A 144 13.674 0.051 -3.961 1.00 0.00 C ATOM 2247 CD LYS A 144 14.991 -0.018 -3.203 1.00 0.00 C ATOM 2248 CE LYS A 144 14.855 -0.821 -1.919 1.00 0.00 C ATOM 2249 NZ LYS A 144 15.153 0.004 -0.715 1.00 0.00 N ATOM 0 H LYS A 144 11.369 0.209 -5.169 1.00 0.00 H new ATOM 0 HA LYS A 144 12.063 -2.600 -5.537 1.00 0.00 H new ATOM 0 HB2 LYS A 144 14.222 -1.908 -4.627 1.00 0.00 H new ATOM 0 HB3 LYS A 144 13.737 -0.821 -5.914 1.00 0.00 H new ATOM 0 HG2 LYS A 144 13.632 0.977 -4.535 1.00 0.00 H new ATOM 0 HG3 LYS A 144 12.847 0.078 -3.252 1.00 0.00 H new ATOM 0 HD2 LYS A 144 15.753 -0.471 -3.837 1.00 0.00 H new ATOM 0 HD3 LYS A 144 15.330 0.991 -2.968 1.00 0.00 H new ATOM 0 HE2 LYS A 144 13.843 -1.219 -1.845 1.00 0.00 H new ATOM 0 HE3 LYS A 144 15.532 -1.675 -1.951 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 15.049 -0.579 0.140 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 16.127 0.363 -0.773 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 14.491 0.805 -0.670 1.00 0.00 H new ATOM 2263 N ALA A 145 10.955 -1.409 -2.750 1.00 0.00 N ATOM 2264 CA ALA A 145 10.560 -1.746 -1.387 1.00 0.00 C ATOM 2265 C ALA A 145 9.406 -2.746 -1.376 1.00 0.00 C ATOM 2266 O ALA A 145 9.176 -3.429 -0.379 1.00 0.00 O ATOM 2267 CB ALA A 145 10.176 -0.488 -0.623 1.00 0.00 C ATOM 0 H ALA A 145 10.570 -0.530 -3.096 1.00 0.00 H new ATOM 0 HA ALA A 145 11.413 -2.213 -0.895 1.00 0.00 H new ATOM 0 HB1 ALA A 145 9.883 -0.754 0.393 1.00 0.00 H new ATOM 0 HB2 ALA A 145 11.028 0.191 -0.589 1.00 0.00 H new ATOM 0 HB3 ALA A 145 9.341 0.002 -1.125 1.00 0.00 H new ATOM 2273 N LEU A 146 8.680 -2.823 -2.485 1.00 0.00 N ATOM 2274 CA LEU A 146 7.549 -3.737 -2.592 1.00 0.00 C ATOM 2275 C LEU A 146 8.004 -5.154 -2.937 1.00 0.00 C ATOM 2276 O LEU A 146 7.180 -6.058 -3.081 1.00 0.00 O ATOM 2277 CB LEU A 146 6.562 -3.237 -3.646 1.00 0.00 C ATOM 2278 CG LEU A 146 5.531 -2.227 -3.140 1.00 0.00 C ATOM 2279 CD1 LEU A 146 4.785 -1.598 -4.306 1.00 0.00 C ATOM 2280 CD2 LEU A 146 4.560 -2.895 -2.178 1.00 0.00 C ATOM 0 H LEU A 146 8.854 -2.265 -3.321 1.00 0.00 H new ATOM 0 HA LEU A 146 7.056 -3.768 -1.620 1.00 0.00 H new ATOM 0 HB2 LEU A 146 7.124 -2.782 -4.461 1.00 0.00 H new ATOM 0 HB3 LEU A 146 6.034 -4.094 -4.063 1.00 0.00 H new ATOM 0 HG LEU A 146 6.055 -1.436 -2.603 1.00 0.00 H new ATOM 0 HD11 LEU A 146 4.055 -0.882 -3.927 1.00 0.00 H new ATOM 0 HD12 LEU A 146 5.493 -1.085 -4.957 1.00 0.00 H new ATOM 0 HD13 LEU A 146 4.271 -2.376 -4.871 1.00 0.00 H new ATOM 0 HD21 LEU A 146 3.833 -2.162 -1.827 1.00 0.00 H new ATOM 0 HD22 LEU A 146 4.041 -3.705 -2.690 1.00 0.00 H new ATOM 0 HD23 LEU A 146 5.110 -3.297 -1.327 1.00 0.00 H new ATOM 2292 N SER A 147 9.314 -5.347 -3.073 1.00 0.00 N ATOM 2293 CA SER A 147 9.859 -6.656 -3.405 1.00 0.00 C ATOM 2294 C SER A 147 10.577 -7.277 -2.211 1.00 0.00 C ATOM 2295 O SER A 147 10.568 -8.496 -2.037 1.00 0.00 O ATOM 2296 CB SER A 147 10.822 -6.545 -4.590 1.00 0.00 C ATOM 2297 OG SER A 147 11.608 -7.715 -4.722 1.00 0.00 O ATOM 0 H SER A 147 10.014 -4.614 -2.958 1.00 0.00 H new ATOM 0 HA SER A 147 9.026 -7.304 -3.677 1.00 0.00 H new ATOM 0 HB2 SER A 147 10.257 -6.378 -5.507 1.00 0.00 H new ATOM 0 HB3 SER A 147 11.472 -5.680 -4.454 1.00 0.00 H new ATOM 0 HG SER A 147 12.213 -7.618 -5.487 1.00 0.00 H new