USER MOD reduce.3.24.130724 H: found=0, std=0, add=590, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 498 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 81 HIS : no HE2:sc= -1.92 X(o=-1.9,f=-2.2) USER MOD Single : A 85 SER OG : rot 104:sc= 0.179 USER MOD Single : A 87 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 TYR OH : rot -176:sc= 0.824 USER MOD Single : A 94 THR OG1 : rot 116:sc= 1.12 USER MOD Single : A 96 SER OG : rot 180:sc= -0.0219 USER MOD Single : A 100 LYS NZ :NH3+ -167:sc=-0.00153 (180deg=-0.129) USER MOD Single : A 107 GLN : amide:sc= -0.871 K(o=-0.87,f=-1.8!) USER MOD Single : A 108 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0167) USER MOD Single : A 110 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 CYS SG : rot 152:sc= -0.896! USER MOD Single : A 121 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 124 MET CE :methyl -145:sc= -0.339 (180deg=-1.2) USER MOD Single : A 125 ASN : amide:sc= 0.592 K(o=0.59,f=0) USER MOD Single : A 126 GLN : amide:sc= -0.29 K(o=-0.29,f=-2.7!) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 134 THR OG1 : rot 180:sc= 0 USER MOD Single : A 136 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00127) USER MOD Single : A 142 SER OG : rot 59:sc= 1.18 USER MOD Single : A 144 GLN : amide:sc= -0.292 K(o=-0.29,f=-2.4!) USER MOD ----------------------------------------------------------------- ATOM 130 N HIS A 81 -5.491 7.873 2.498 1.00 1.00 N ATOM 131 CA HIS A 81 -5.639 6.803 3.469 1.00 1.00 C ATOM 132 C HIS A 81 -4.317 6.043 3.601 1.00 1.00 C ATOM 133 O HIS A 81 -3.756 5.587 2.606 1.00 1.00 O ATOM 134 CB HIS A 81 -6.811 5.891 3.099 1.00 1.00 C ATOM 135 CG HIS A 81 -6.599 4.440 3.460 1.00 1.00 C ATOM 136 ND1 HIS A 81 -6.875 3.932 4.717 1.00 1.00 N ATOM 137 CD2 HIS A 81 -6.136 3.395 2.715 1.00 1.00 C ATOM 138 CE1 HIS A 81 -6.587 2.639 4.718 1.00 1.00 C ATOM 139 NE2 HIS A 81 -6.128 2.309 3.477 1.00 1.00 N ATOM 0 HA HIS A 81 -5.876 7.225 4.446 1.00 1.00 H new ATOM 0 HB2 HIS A 81 -7.710 6.251 3.599 1.00 1.00 H new ATOM 0 HB3 HIS A 81 -6.991 5.965 2.027 1.00 1.00 H new ATOM 0 HD1 HIS A 81 -7.238 4.463 5.508 1.00 1.00 H new ATOM 0 HD2 HIS A 81 -5.828 3.444 1.681 1.00 1.00 H new ATOM 0 HE1 HIS A 81 -6.696 1.965 5.555 1.00 1.00 H new ATOM 146 N ILE A 82 -3.857 5.930 4.839 1.00 1.00 N ATOM 147 CA ILE A 82 -2.612 5.236 5.115 1.00 1.00 C ATOM 148 C ILE A 82 -2.910 3.766 5.418 1.00 1.00 C ATOM 149 O ILE A 82 -3.768 3.461 6.245 1.00 1.00 O ATOM 150 CB ILE A 82 -1.834 5.946 6.223 1.00 1.00 C ATOM 151 CG1 ILE A 82 -1.475 7.376 5.811 1.00 1.00 C ATOM 152 CG2 ILE A 82 -0.599 5.141 6.631 1.00 1.00 C ATOM 153 CD1 ILE A 82 -2.531 8.369 6.301 1.00 1.00 C ATOM 0 H ILE A 82 -4.326 6.308 5.662 1.00 1.00 H new ATOM 0 HA ILE A 82 -1.963 5.258 4.240 1.00 1.00 H new ATOM 0 HB ILE A 82 -2.477 6.014 7.100 1.00 1.00 H new ATOM 0 HG12 ILE A 82 -0.501 7.643 6.222 1.00 1.00 H new ATOM 0 HG13 ILE A 82 -1.391 7.435 4.726 1.00 1.00 H new ATOM 0 HG21 ILE A 82 -0.065 5.670 7.420 1.00 1.00 H new ATOM 0 HG22 ILE A 82 -0.907 4.161 6.995 1.00 1.00 H new ATOM 0 HG23 ILE A 82 0.056 5.018 5.769 1.00 1.00 H new ATOM 0 HD11 ILE A 82 -2.252 9.377 5.995 1.00 1.00 H new ATOM 0 HD12 ILE A 82 -3.499 8.114 5.869 1.00 1.00 H new ATOM 0 HD13 ILE A 82 -2.596 8.324 7.388 1.00 1.00 H new ATOM 164 N VAL A 83 -2.185 2.894 4.733 1.00 1.00 N ATOM 165 CA VAL A 83 -2.361 1.464 4.919 1.00 1.00 C ATOM 166 C VAL A 83 -1.541 1.006 6.128 1.00 1.00 C ATOM 167 O VAL A 83 -0.323 1.173 6.155 1.00 1.00 O ATOM 168 CB VAL A 83 -1.997 0.719 3.633 1.00 1.00 C ATOM 169 CG1 VAL A 83 -1.929 -0.790 3.874 1.00 1.00 C ATOM 170 CG2 VAL A 83 -2.981 1.051 2.510 1.00 1.00 C ATOM 0 H VAL A 83 -1.474 3.151 4.048 1.00 1.00 H new ATOM 0 HA VAL A 83 -3.405 1.232 5.128 1.00 1.00 H new ATOM 0 HB VAL A 83 -1.007 1.053 3.321 1.00 1.00 H new ATOM 0 HG11 VAL A 83 -1.669 -1.296 2.944 1.00 1.00 H new ATOM 0 HG12 VAL A 83 -1.172 -1.004 4.628 1.00 1.00 H new ATOM 0 HG13 VAL A 83 -2.898 -1.147 4.222 1.00 1.00 H new ATOM 0 HG21 VAL A 83 -2.700 0.509 1.607 1.00 1.00 H new ATOM 0 HG22 VAL A 83 -3.987 0.759 2.810 1.00 1.00 H new ATOM 0 HG23 VAL A 83 -2.958 2.122 2.311 1.00 1.00 H new ATOM 180 N ARG A 84 -2.243 0.438 7.098 1.00 1.00 N ATOM 181 CA ARG A 84 -1.594 -0.045 8.305 1.00 1.00 C ATOM 182 C ARG A 84 -1.384 -1.559 8.226 1.00 1.00 C ATOM 183 O ARG A 84 -2.331 -2.311 8.004 1.00 1.00 O ATOM 184 CB ARG A 84 -2.428 0.282 9.546 1.00 1.00 C ATOM 185 CG ARG A 84 -2.549 1.795 9.741 1.00 1.00 C ATOM 186 CD ARG A 84 -3.673 2.132 10.724 1.00 1.00 C ATOM 187 NE ARG A 84 -4.438 3.301 10.236 1.00 1.00 N ATOM 188 CZ ARG A 84 -5.500 3.217 9.405 1.00 1.00 C ATOM 189 NH1 ARG A 84 -5.930 2.016 8.963 1.00 1.00 N ATOM 190 NH2 ARG A 84 -6.108 4.327 9.032 1.00 1.00 N ATOM 0 H ARG A 84 -3.254 0.302 7.073 1.00 1.00 H new ATOM 0 HA ARG A 84 -0.629 0.455 8.386 1.00 1.00 H new ATOM 0 HB2 ARG A 84 -3.421 -0.156 9.447 1.00 1.00 H new ATOM 0 HB3 ARG A 84 -1.968 -0.166 10.427 1.00 1.00 H new ATOM 0 HG2 ARG A 84 -1.605 2.194 10.111 1.00 1.00 H new ATOM 0 HG3 ARG A 84 -2.744 2.275 8.782 1.00 1.00 H new ATOM 0 HD2 ARG A 84 -4.336 1.275 10.838 1.00 1.00 H new ATOM 0 HD3 ARG A 84 -3.255 2.345 11.708 1.00 1.00 H new ATOM 0 HE ARG A 84 -4.145 4.228 10.546 1.00 1.00 H new ATOM 0 HH11 ARG A 84 -5.452 1.164 9.256 1.00 1.00 H new ATOM 0 HH12 ARG A 84 -6.733 1.961 8.336 1.00 1.00 H new ATOM 0 HH21 ARG A 84 -5.775 5.230 9.371 1.00 1.00 H new ATOM 0 HH22 ARG A 84 -6.911 4.283 8.405 1.00 1.00 H new ATOM 199 N SER A 85 -0.134 -1.961 8.411 1.00 1.00 N ATOM 200 CA SER A 85 0.213 -3.370 8.362 1.00 1.00 C ATOM 201 C SER A 85 -0.775 -4.182 9.203 1.00 1.00 C ATOM 202 O SER A 85 -0.710 -4.165 10.431 1.00 1.00 O ATOM 203 CB SER A 85 1.644 -3.602 8.854 1.00 1.00 C ATOM 204 OG SER A 85 2.156 -2.474 9.558 1.00 1.00 O ATOM 0 H SER A 85 0.650 -1.335 8.595 1.00 1.00 H new ATOM 0 HA SER A 85 0.155 -3.701 7.325 1.00 1.00 H new ATOM 0 HB2 SER A 85 1.666 -4.476 9.505 1.00 1.00 H new ATOM 0 HB3 SER A 85 2.289 -3.822 8.003 1.00 1.00 H new ATOM 0 HG SER A 85 2.151 -2.659 10.520 1.00 1.00 H new ATOM 209 N PRO A 86 -1.690 -4.890 8.489 1.00 1.00 N ATOM 210 CA PRO A 86 -2.690 -5.707 9.156 1.00 1.00 C ATOM 211 C PRO A 86 -2.071 -6.993 9.705 1.00 1.00 C ATOM 212 O PRO A 86 -2.766 -7.817 10.298 1.00 1.00 O ATOM 213 CB PRO A 86 -3.755 -5.963 8.102 1.00 1.00 C ATOM 214 CG PRO A 86 -3.095 -5.677 6.764 1.00 1.00 C ATOM 215 CD PRO A 86 -1.797 -4.934 7.034 1.00 1.00 C ATOM 0 HA PRO A 86 -3.121 -5.215 10.028 1.00 1.00 H new ATOM 0 HB2 PRO A 86 -4.112 -6.992 8.149 1.00 1.00 H new ATOM 0 HB3 PRO A 86 -4.620 -5.318 8.256 1.00 1.00 H new ATOM 0 HG2 PRO A 86 -2.899 -6.606 6.229 1.00 1.00 H new ATOM 0 HG3 PRO A 86 -3.753 -5.079 6.134 1.00 1.00 H new ATOM 0 HD2 PRO A 86 -0.946 -5.450 6.590 1.00 1.00 H new ATOM 0 HD3 PRO A 86 -1.819 -3.931 6.608 1.00 1.00 H new ATOM 220 N MET A 87 -0.771 -7.126 9.488 1.00 1.00 N ATOM 221 CA MET A 87 -0.050 -8.298 9.954 1.00 1.00 C ATOM 222 C MET A 87 1.452 -8.020 10.038 1.00 1.00 C ATOM 223 O MET A 87 2.002 -7.301 9.206 1.00 1.00 O ATOM 224 CB MET A 87 -0.301 -9.465 8.996 1.00 1.00 C ATOM 225 CG MET A 87 -0.577 -10.757 9.767 1.00 1.00 C ATOM 226 SD MET A 87 -2.099 -10.606 10.685 1.00 1.00 S ATOM 227 CE MET A 87 -2.318 -12.301 11.204 1.00 1.00 C ATOM 0 H MET A 87 -0.198 -6.441 8.995 1.00 1.00 H new ATOM 0 HA MET A 87 -0.410 -8.551 10.951 1.00 1.00 H new ATOM 0 HB2 MET A 87 -1.148 -9.234 8.350 1.00 1.00 H new ATOM 0 HB3 MET A 87 0.565 -9.602 8.349 1.00 1.00 H new ATOM 0 HG2 MET A 87 -0.642 -11.597 9.075 1.00 1.00 H new ATOM 0 HG3 MET A 87 0.248 -10.968 10.447 1.00 1.00 H new ATOM 0 HE1 MET A 87 -3.231 -12.386 11.794 1.00 1.00 H new ATOM 0 HE2 MET A 87 -2.392 -12.943 10.327 1.00 1.00 H new ATOM 0 HE3 MET A 87 -1.465 -12.609 11.809 1.00 1.00 H new ATOM 235 N VAL A 88 2.074 -8.605 11.052 1.00 1.00 N ATOM 236 CA VAL A 88 3.502 -8.429 11.256 1.00 1.00 C ATOM 237 C VAL A 88 4.266 -9.352 10.305 1.00 1.00 C ATOM 238 O VAL A 88 3.876 -10.502 10.104 1.00 1.00 O ATOM 239 CB VAL A 88 3.852 -8.665 12.728 1.00 1.00 C ATOM 240 CG1 VAL A 88 5.267 -8.171 13.039 1.00 1.00 C ATOM 241 CG2 VAL A 88 2.825 -8.002 13.648 1.00 1.00 C ATOM 0 H VAL A 88 1.615 -9.201 11.741 1.00 1.00 H new ATOM 0 HA VAL A 88 3.798 -7.406 11.024 1.00 1.00 H new ATOM 0 HB VAL A 88 3.823 -9.739 12.913 1.00 1.00 H new ATOM 0 HG11 VAL A 88 5.492 -8.350 14.090 1.00 1.00 H new ATOM 0 HG12 VAL A 88 5.984 -8.708 12.418 1.00 1.00 H new ATOM 0 HG13 VAL A 88 5.334 -7.103 12.830 1.00 1.00 H new ATOM 0 HG21 VAL A 88 3.097 -8.185 14.688 1.00 1.00 H new ATOM 0 HG22 VAL A 88 2.808 -6.928 13.460 1.00 1.00 H new ATOM 0 HG23 VAL A 88 1.838 -8.420 13.452 1.00 1.00 H new ATOM 251 N GLY A 89 5.339 -8.815 9.746 1.00 1.00 N ATOM 252 CA GLY A 89 6.162 -9.575 8.821 1.00 1.00 C ATOM 253 C GLY A 89 7.005 -8.645 7.945 1.00 1.00 C ATOM 254 O GLY A 89 7.787 -7.845 8.456 1.00 1.00 O ATOM 0 H GLY A 89 5.658 -7.861 9.916 1.00 1.00 H new ATOM 0 HA2 GLY A 89 6.815 -10.247 9.378 1.00 1.00 H new ATOM 0 HA3 GLY A 89 5.527 -10.197 8.191 1.00 1.00 H new ATOM 258 N THR A 90 6.818 -8.783 6.641 1.00 1.00 N ATOM 259 CA THR A 90 7.551 -7.965 5.690 1.00 1.00 C ATOM 260 C THR A 90 6.587 -7.289 4.713 1.00 1.00 C ATOM 261 O THR A 90 5.402 -7.616 4.678 1.00 1.00 O ATOM 262 CB THR A 90 8.586 -8.856 5.000 1.00 1.00 C ATOM 263 OG1 THR A 90 9.416 -9.312 6.066 1.00 1.00 O ATOM 264 CG2 THR A 90 9.537 -8.062 4.101 1.00 1.00 C ATOM 0 H THR A 90 6.170 -9.449 6.221 1.00 1.00 H new ATOM 0 HA THR A 90 8.079 -7.154 6.191 1.00 1.00 H new ATOM 0 HB THR A 90 8.075 -9.614 4.407 1.00 1.00 H new ATOM 0 HG1 THR A 90 10.115 -9.899 5.708 1.00 1.00 H new ATOM 0 HG21 THR A 90 10.251 -8.742 3.636 1.00 1.00 H new ATOM 0 HG22 THR A 90 8.964 -7.552 3.327 1.00 1.00 H new ATOM 0 HG23 THR A 90 10.074 -7.326 4.699 1.00 1.00 H new ATOM 272 N PHE A 91 7.131 -6.355 3.945 1.00 1.00 N ATOM 273 CA PHE A 91 6.334 -5.629 2.972 1.00 1.00 C ATOM 274 C PHE A 91 7.113 -5.421 1.671 1.00 1.00 C ATOM 275 O PHE A 91 8.311 -5.148 1.698 1.00 1.00 O ATOM 276 CB PHE A 91 6.014 -4.264 3.584 1.00 1.00 C ATOM 277 CG PHE A 91 5.388 -3.272 2.601 1.00 1.00 C ATOM 278 CD1 PHE A 91 6.138 -2.746 1.595 1.00 1.00 C ATOM 279 CD2 PHE A 91 4.082 -2.916 2.734 1.00 1.00 C ATOM 280 CE1 PHE A 91 5.557 -1.826 0.684 1.00 1.00 C ATOM 281 CE2 PHE A 91 3.501 -1.996 1.822 1.00 1.00 C ATOM 282 CZ PHE A 91 4.251 -1.470 0.816 1.00 1.00 C ATOM 0 H PHE A 91 8.114 -6.085 3.978 1.00 1.00 H new ATOM 0 HA PHE A 91 5.430 -6.192 2.738 1.00 1.00 H new ATOM 0 HB2 PHE A 91 5.334 -4.405 4.425 1.00 1.00 H new ATOM 0 HB3 PHE A 91 6.931 -3.833 3.985 1.00 1.00 H new ATOM 0 HD1 PHE A 91 7.175 -3.029 1.490 1.00 1.00 H new ATOM 0 HD2 PHE A 91 3.487 -3.333 3.533 1.00 1.00 H new ATOM 0 HE1 PHE A 91 6.152 -1.408 -0.115 1.00 1.00 H new ATOM 0 HE2 PHE A 91 2.464 -1.714 1.927 1.00 1.00 H new ATOM 0 HZ PHE A 91 3.809 -0.770 0.122 1.00 1.00 H new ATOM 291 N TYR A 92 6.399 -5.559 0.563 1.00 1.00 N ATOM 292 CA TYR A 92 7.007 -5.390 -0.745 1.00 1.00 C ATOM 293 C TYR A 92 6.138 -4.512 -1.646 1.00 1.00 C ATOM 294 O TYR A 92 4.915 -4.490 -1.505 1.00 1.00 O ATOM 295 CB TYR A 92 7.098 -6.792 -1.353 1.00 1.00 C ATOM 296 CG TYR A 92 8.119 -7.702 -0.669 1.00 1.00 C ATOM 297 CD1 TYR A 92 9.469 -7.496 -0.866 1.00 1.00 C ATOM 298 CD2 TYR A 92 7.689 -8.730 0.146 1.00 1.00 C ATOM 299 CE1 TYR A 92 10.430 -8.353 -0.223 1.00 1.00 C ATOM 300 CE2 TYR A 92 8.651 -9.588 0.790 1.00 1.00 C ATOM 301 CZ TYR A 92 9.973 -9.357 0.574 1.00 1.00 C ATOM 302 OH TYR A 92 10.881 -10.167 1.183 1.00 1.00 O ATOM 0 H TYR A 92 5.405 -5.786 0.545 1.00 1.00 H new ATOM 0 HA TYR A 92 7.981 -4.909 -0.655 1.00 1.00 H new ATOM 0 HB2 TYR A 92 6.116 -7.263 -1.303 1.00 1.00 H new ATOM 0 HB3 TYR A 92 7.356 -6.703 -2.408 1.00 1.00 H new ATOM 0 HD1 TYR A 92 9.805 -6.691 -1.503 1.00 1.00 H new ATOM 0 HD2 TYR A 92 6.632 -8.891 0.301 1.00 1.00 H new ATOM 0 HE1 TYR A 92 11.489 -8.203 -0.370 1.00 1.00 H new ATOM 0 HE2 TYR A 92 8.329 -10.396 1.430 1.00 1.00 H new ATOM 0 HH TYR A 92 10.412 -10.877 1.670 1.00 1.00 H new ATOM 311 N ARG A 93 6.801 -3.807 -2.551 1.00 1.00 N ATOM 312 CA ARG A 93 6.103 -2.929 -3.474 1.00 1.00 C ATOM 313 C ARG A 93 5.831 -3.654 -4.794 1.00 1.00 C ATOM 314 O ARG A 93 4.973 -3.236 -5.570 1.00 1.00 O ATOM 315 CB ARG A 93 6.918 -1.664 -3.754 1.00 1.00 C ATOM 316 CG ARG A 93 7.124 -0.851 -2.474 1.00 1.00 C ATOM 317 CD ARG A 93 5.850 -0.090 -2.097 1.00 1.00 C ATOM 318 NE ARG A 93 5.590 0.982 -3.083 1.00 1.00 N ATOM 319 CZ ARG A 93 4.820 0.830 -4.182 1.00 1.00 C ATOM 320 NH1 ARG A 93 4.228 -0.354 -4.444 1.00 1.00 N ATOM 321 NH2 ARG A 93 4.657 1.856 -4.995 1.00 1.00 N ATOM 0 H ARG A 93 7.814 -3.826 -2.665 1.00 1.00 H new ATOM 0 HA ARG A 93 5.159 -2.644 -3.010 1.00 1.00 H new ATOM 0 HB2 ARG A 93 7.885 -1.936 -4.176 1.00 1.00 H new ATOM 0 HB3 ARG A 93 6.406 -1.054 -4.498 1.00 1.00 H new ATOM 0 HG2 ARG A 93 7.410 -1.516 -1.659 1.00 1.00 H new ATOM 0 HG3 ARG A 93 7.944 -0.147 -2.614 1.00 1.00 H new ATOM 0 HD2 ARG A 93 5.004 -0.776 -2.062 1.00 1.00 H new ATOM 0 HD3 ARG A 93 5.954 0.339 -1.100 1.00 1.00 H new ATOM 0 HE ARG A 93 6.019 1.893 -2.923 1.00 1.00 H new ATOM 0 HH11 ARG A 93 4.361 -1.142 -3.810 1.00 1.00 H new ATOM 0 HH12 ARG A 93 3.648 -0.461 -5.276 1.00 1.00 H new ATOM 0 HH21 ARG A 93 5.109 2.747 -4.789 1.00 1.00 H new ATOM 0 HH22 ARG A 93 4.079 1.759 -5.830 1.00 1.00 H new ATOM 330 N THR A 94 6.578 -4.727 -5.007 1.00 1.00 N ATOM 331 CA THR A 94 6.428 -5.514 -6.219 1.00 1.00 C ATOM 332 C THR A 94 6.264 -6.996 -5.876 1.00 1.00 C ATOM 333 O THR A 94 6.702 -7.444 -4.818 1.00 1.00 O ATOM 334 CB THR A 94 7.632 -5.228 -7.120 1.00 1.00 C ATOM 335 OG1 THR A 94 8.737 -5.773 -6.405 1.00 1.00 O ATOM 336 CG2 THR A 94 7.950 -3.735 -7.217 1.00 1.00 C ATOM 0 H THR A 94 7.289 -5.070 -4.361 1.00 1.00 H new ATOM 0 HA THR A 94 5.524 -5.237 -6.762 1.00 1.00 H new ATOM 0 HB THR A 94 7.441 -5.623 -8.118 1.00 1.00 H new ATOM 0 HG1 THR A 94 9.129 -6.509 -6.920 1.00 1.00 H new ATOM 0 HG21 THR A 94 8.812 -3.588 -7.868 1.00 1.00 H new ATOM 0 HG22 THR A 94 7.090 -3.206 -7.628 1.00 1.00 H new ATOM 0 HG23 THR A 94 8.175 -3.346 -6.224 1.00 1.00 H new ATOM 344 N PRO A 95 5.615 -7.734 -6.815 1.00 1.00 N ATOM 345 CA PRO A 95 5.387 -9.157 -6.623 1.00 1.00 C ATOM 346 C PRO A 95 6.676 -9.953 -6.839 1.00 1.00 C ATOM 347 O PRO A 95 6.860 -11.015 -6.247 1.00 1.00 O ATOM 348 CB PRO A 95 4.293 -9.518 -7.615 1.00 1.00 C ATOM 349 CG PRO A 95 4.275 -8.398 -8.643 1.00 1.00 C ATOM 350 CD PRO A 95 5.082 -7.238 -8.081 1.00 1.00 C ATOM 0 HA PRO A 95 5.080 -9.400 -5.606 1.00 1.00 H new ATOM 0 HB2 PRO A 95 4.496 -10.479 -8.088 1.00 1.00 H new ATOM 0 HB3 PRO A 95 3.328 -9.606 -7.117 1.00 1.00 H new ATOM 0 HG2 PRO A 95 4.702 -8.739 -9.586 1.00 1.00 H new ATOM 0 HG3 PRO A 95 3.251 -8.086 -8.850 1.00 1.00 H new ATOM 0 HD2 PRO A 95 5.883 -6.947 -8.761 1.00 1.00 H new ATOM 0 HD3 PRO A 95 4.457 -6.358 -7.930 1.00 1.00 H new ATOM 355 N SER A 96 7.535 -9.407 -7.688 1.00 1.00 N ATOM 356 CA SER A 96 8.801 -10.052 -7.988 1.00 1.00 C ATOM 357 C SER A 96 9.904 -9.002 -8.131 1.00 1.00 C ATOM 358 O SER A 96 9.634 -7.803 -8.082 1.00 1.00 O ATOM 359 CB SER A 96 8.701 -10.894 -9.263 1.00 1.00 C ATOM 360 OG SER A 96 7.351 -11.066 -9.685 1.00 1.00 O ATOM 0 H SER A 96 7.379 -8.526 -8.177 1.00 1.00 H new ATOM 0 HA SER A 96 9.049 -10.719 -7.162 1.00 1.00 H new ATOM 0 HB2 SER A 96 9.271 -10.415 -10.059 1.00 1.00 H new ATOM 0 HB3 SER A 96 9.154 -11.870 -9.089 1.00 1.00 H new ATOM 0 HG SER A 96 7.330 -11.607 -10.502 1.00 1.00 H new ATOM 365 N PRO A 97 11.156 -9.503 -8.309 1.00 1.00 N ATOM 366 CA PRO A 97 12.300 -8.620 -8.459 1.00 1.00 C ATOM 367 C PRO A 97 12.321 -7.979 -9.848 1.00 1.00 C ATOM 368 O PRO A 97 12.558 -6.780 -9.980 1.00 1.00 O ATOM 369 CB PRO A 97 13.512 -9.498 -8.191 1.00 1.00 C ATOM 370 CG PRO A 97 13.033 -10.931 -8.360 1.00 1.00 C ATOM 371 CD PRO A 97 11.513 -10.916 -8.373 1.00 1.00 C ATOM 0 HA PRO A 97 12.274 -7.777 -7.768 1.00 1.00 H new ATOM 0 HB2 PRO A 97 14.320 -9.272 -8.887 1.00 1.00 H new ATOM 0 HB3 PRO A 97 13.900 -9.332 -7.186 1.00 1.00 H new ATOM 0 HG2 PRO A 97 13.418 -11.356 -9.287 1.00 1.00 H new ATOM 0 HG3 PRO A 97 13.402 -11.555 -7.546 1.00 1.00 H new ATOM 0 HD2 PRO A 97 11.120 -11.383 -9.276 1.00 1.00 H new ATOM 0 HD3 PRO A 97 11.104 -11.466 -7.526 1.00 1.00 H new ATOM 376 N ASP A 98 12.070 -8.809 -10.850 1.00 1.00 N ATOM 377 CA ASP A 98 12.056 -8.340 -12.226 1.00 1.00 C ATOM 378 C ASP A 98 10.630 -7.945 -12.611 1.00 1.00 C ATOM 379 O ASP A 98 10.279 -7.943 -13.790 1.00 1.00 O ATOM 380 CB ASP A 98 12.519 -9.436 -13.187 1.00 1.00 C ATOM 381 CG ASP A 98 13.900 -9.212 -13.807 1.00 1.00 C ATOM 382 OD1 ASP A 98 14.740 -10.123 -13.844 1.00 1.00 O ATOM 383 OD2 ASP A 98 14.101 -8.026 -14.274 1.00 1.00 O ATOM 0 H ASP A 98 11.875 -9.804 -10.737 1.00 1.00 H new ATOM 0 HA ASP A 98 12.732 -7.488 -12.298 1.00 1.00 H new ATOM 0 HB2 ASP A 98 12.527 -10.386 -12.653 1.00 1.00 H new ATOM 0 HB3 ASP A 98 11.787 -9.527 -13.990 1.00 1.00 H new ATOM 388 N ALA A 99 9.845 -7.619 -11.594 1.00 1.00 N ATOM 389 CA ALA A 99 8.463 -7.223 -11.813 1.00 1.00 C ATOM 390 C ALA A 99 8.300 -5.744 -11.457 1.00 1.00 C ATOM 391 O ALA A 99 8.845 -5.278 -10.457 1.00 1.00 O ATOM 392 CB ALA A 99 7.538 -8.126 -10.995 1.00 1.00 C ATOM 0 H ALA A 99 10.139 -7.621 -10.617 1.00 1.00 H new ATOM 0 HA ALA A 99 8.190 -7.342 -12.862 1.00 1.00 H new ATOM 0 HB1 ALA A 99 6.502 -7.830 -11.159 1.00 1.00 H new ATOM 0 HB2 ALA A 99 7.673 -9.162 -11.306 1.00 1.00 H new ATOM 0 HB3 ALA A 99 7.780 -8.031 -9.936 1.00 1.00 H new ATOM 398 N LYS A 100 7.545 -5.047 -12.293 1.00 1.00 N ATOM 399 CA LYS A 100 7.302 -3.630 -12.079 1.00 1.00 C ATOM 400 C LYS A 100 6.683 -3.427 -10.694 1.00 1.00 C ATOM 401 O LYS A 100 6.443 -4.392 -9.970 1.00 1.00 O ATOM 402 CB LYS A 100 6.462 -3.052 -13.220 1.00 1.00 C ATOM 403 CG LYS A 100 6.916 -3.608 -14.571 1.00 1.00 C ATOM 404 CD LYS A 100 6.533 -2.660 -15.710 1.00 1.00 C ATOM 405 CE LYS A 100 5.032 -2.728 -15.998 1.00 1.00 C ATOM 406 NZ LYS A 100 4.694 -3.989 -16.695 1.00 1.00 N ATOM 0 H LYS A 100 7.093 -5.437 -13.120 1.00 1.00 H new ATOM 0 HA LYS A 100 8.240 -3.076 -12.093 1.00 1.00 H new ATOM 0 HB2 LYS A 100 5.411 -3.291 -13.059 1.00 1.00 H new ATOM 0 HB3 LYS A 100 6.545 -1.965 -13.223 1.00 1.00 H new ATOM 0 HG2 LYS A 100 7.996 -3.756 -14.563 1.00 1.00 H new ATOM 0 HG3 LYS A 100 6.462 -4.585 -14.738 1.00 1.00 H new ATOM 0 HD2 LYS A 100 6.811 -1.639 -15.447 1.00 1.00 H new ATOM 0 HD3 LYS A 100 7.092 -2.921 -16.609 1.00 1.00 H new ATOM 0 HE2 LYS A 100 4.473 -2.661 -15.064 1.00 1.00 H new ATOM 0 HE3 LYS A 100 4.734 -1.876 -16.610 1.00 1.00 H new ATOM 0 HZ1 LYS A 100 3.729 -3.927 -17.077 1.00 1.00 H new ATOM 0 HZ2 LYS A 100 5.365 -4.146 -17.474 1.00 1.00 H new ATOM 0 HZ3 LYS A 100 4.751 -4.782 -16.025 1.00 1.00 H new ATOM 415 N ALA A 101 6.441 -2.166 -10.369 1.00 1.00 N ATOM 416 CA ALA A 101 5.854 -1.824 -9.085 1.00 1.00 C ATOM 417 C ALA A 101 4.330 -1.922 -9.183 1.00 1.00 C ATOM 418 O ALA A 101 3.732 -1.416 -10.132 1.00 1.00 O ATOM 419 CB ALA A 101 6.322 -0.429 -8.664 1.00 1.00 C ATOM 0 H ALA A 101 6.641 -1.369 -10.973 1.00 1.00 H new ATOM 0 HA ALA A 101 6.181 -2.524 -8.316 1.00 1.00 H new ATOM 0 HB1 ALA A 101 5.881 -0.173 -7.701 1.00 1.00 H new ATOM 0 HB2 ALA A 101 7.409 -0.420 -8.580 1.00 1.00 H new ATOM 0 HB3 ALA A 101 6.010 0.300 -9.411 1.00 1.00 H new ATOM 425 N PHE A 102 3.746 -2.576 -8.190 1.00 1.00 N ATOM 426 CA PHE A 102 2.303 -2.746 -8.152 1.00 1.00 C ATOM 427 C PHE A 102 1.588 -1.413 -8.376 1.00 1.00 C ATOM 428 O PHE A 102 0.602 -1.349 -9.109 1.00 1.00 O ATOM 429 CB PHE A 102 1.951 -3.274 -6.760 1.00 1.00 C ATOM 430 CG PHE A 102 1.853 -4.798 -6.678 1.00 1.00 C ATOM 431 CD1 PHE A 102 0.807 -5.444 -7.260 1.00 1.00 C ATOM 432 CD2 PHE A 102 2.811 -5.508 -6.025 1.00 1.00 C ATOM 433 CE1 PHE A 102 0.715 -6.860 -7.183 1.00 1.00 C ATOM 434 CE2 PHE A 102 2.720 -6.923 -5.949 1.00 1.00 C ATOM 435 CZ PHE A 102 1.673 -7.569 -6.530 1.00 1.00 C ATOM 0 H PHE A 102 4.246 -2.995 -7.405 1.00 1.00 H new ATOM 0 HA PHE A 102 1.988 -3.432 -8.938 1.00 1.00 H new ATOM 0 HB2 PHE A 102 2.704 -2.930 -6.051 1.00 1.00 H new ATOM 0 HB3 PHE A 102 1.000 -2.842 -6.449 1.00 1.00 H new ATOM 0 HD1 PHE A 102 0.047 -4.881 -7.781 1.00 1.00 H new ATOM 0 HD2 PHE A 102 3.642 -4.995 -5.564 1.00 1.00 H new ATOM 0 HE1 PHE A 102 -0.116 -7.373 -7.644 1.00 1.00 H new ATOM 0 HE2 PHE A 102 3.482 -7.486 -5.430 1.00 1.00 H new ATOM 0 HZ PHE A 102 1.603 -8.645 -6.472 1.00 1.00 H new ATOM 444 N ILE A 103 2.112 -0.381 -7.731 1.00 1.00 N ATOM 445 CA ILE A 103 1.534 0.947 -7.851 1.00 1.00 C ATOM 446 C ILE A 103 2.638 1.948 -8.199 1.00 1.00 C ATOM 447 O ILE A 103 3.609 2.089 -7.458 1.00 1.00 O ATOM 448 CB ILE A 103 0.755 1.308 -6.584 1.00 1.00 C ATOM 449 CG1 ILE A 103 -0.603 0.602 -6.556 1.00 1.00 C ATOM 450 CG2 ILE A 103 0.614 2.825 -6.442 1.00 1.00 C ATOM 451 CD1 ILE A 103 -1.402 0.998 -5.313 1.00 1.00 C ATOM 0 H ILE A 103 2.930 -0.437 -7.124 1.00 1.00 H new ATOM 0 HA ILE A 103 0.808 0.975 -8.664 1.00 1.00 H new ATOM 0 HB ILE A 103 1.321 0.954 -5.722 1.00 1.00 H new ATOM 0 HG12 ILE A 103 -1.168 0.857 -7.452 1.00 1.00 H new ATOM 0 HG13 ILE A 103 -0.456 -0.478 -6.569 1.00 1.00 H new ATOM 0 HG21 ILE A 103 0.057 3.055 -5.534 1.00 1.00 H new ATOM 0 HG22 ILE A 103 1.603 3.279 -6.385 1.00 1.00 H new ATOM 0 HG23 ILE A 103 0.081 3.223 -7.305 1.00 1.00 H new ATOM 0 HD11 ILE A 103 -2.362 0.482 -5.318 1.00 1.00 H new ATOM 0 HD12 ILE A 103 -0.845 0.719 -4.418 1.00 1.00 H new ATOM 0 HD13 ILE A 103 -1.569 2.075 -5.316 1.00 1.00 H new ATOM 462 N GLU A 104 2.451 2.616 -9.328 1.00 1.00 N ATOM 463 CA GLU A 104 3.419 3.600 -9.784 1.00 1.00 C ATOM 464 C GLU A 104 3.068 4.984 -9.234 1.00 1.00 C ATOM 465 O GLU A 104 2.049 5.563 -9.608 1.00 1.00 O ATOM 466 CB GLU A 104 3.500 3.621 -11.312 1.00 1.00 C ATOM 467 CG GLU A 104 4.945 3.446 -11.785 1.00 1.00 C ATOM 468 CD GLU A 104 5.302 4.487 -12.849 1.00 1.00 C ATOM 469 OE1 GLU A 104 6.024 5.451 -12.555 1.00 1.00 O ATOM 470 OE2 GLU A 104 4.803 4.265 -14.017 1.00 1.00 O ATOM 0 H GLU A 104 1.644 2.495 -9.940 1.00 1.00 H new ATOM 0 HA GLU A 104 4.401 3.319 -9.405 1.00 1.00 H new ATOM 0 HB2 GLU A 104 2.879 2.825 -11.724 1.00 1.00 H new ATOM 0 HB3 GLU A 104 3.102 4.563 -11.688 1.00 1.00 H new ATOM 0 HG2 GLU A 104 5.623 3.540 -10.937 1.00 1.00 H new ATOM 0 HG3 GLU A 104 5.080 2.444 -12.192 1.00 1.00 H new ATOM 476 N VAL A 105 3.931 5.474 -8.357 1.00 1.00 N ATOM 477 CA VAL A 105 3.725 6.779 -7.752 1.00 1.00 C ATOM 478 C VAL A 105 3.203 7.750 -8.813 1.00 1.00 C ATOM 479 O VAL A 105 3.898 8.048 -9.783 1.00 1.00 O ATOM 480 CB VAL A 105 5.017 7.258 -7.088 1.00 1.00 C ATOM 481 CG1 VAL A 105 4.812 8.609 -6.401 1.00 1.00 C ATOM 482 CG2 VAL A 105 5.544 6.215 -6.100 1.00 1.00 C ATOM 0 H VAL A 105 4.775 4.991 -8.050 1.00 1.00 H new ATOM 0 HA VAL A 105 2.973 6.721 -6.965 1.00 1.00 H new ATOM 0 HB VAL A 105 5.766 7.390 -7.869 1.00 1.00 H new ATOM 0 HG11 VAL A 105 5.746 8.927 -5.937 1.00 1.00 H new ATOM 0 HG12 VAL A 105 4.503 9.349 -7.139 1.00 1.00 H new ATOM 0 HG13 VAL A 105 4.041 8.515 -5.637 1.00 1.00 H new ATOM 0 HG21 VAL A 105 6.463 6.580 -5.642 1.00 1.00 H new ATOM 0 HG22 VAL A 105 4.798 6.038 -5.326 1.00 1.00 H new ATOM 0 HG23 VAL A 105 5.747 5.283 -6.628 1.00 1.00 H new ATOM 492 N GLY A 106 1.984 8.219 -8.591 1.00 1.00 N ATOM 493 CA GLY A 106 1.360 9.150 -9.516 1.00 1.00 C ATOM 494 C GLY A 106 0.322 8.444 -10.390 1.00 1.00 C ATOM 495 O GLY A 106 0.056 8.872 -11.512 1.00 1.00 O ATOM 0 H GLY A 106 1.412 7.972 -7.784 1.00 1.00 H new ATOM 0 HA2 GLY A 106 0.883 9.957 -8.959 1.00 1.00 H new ATOM 0 HA3 GLY A 106 2.122 9.606 -10.148 1.00 1.00 H new ATOM 499 N GLN A 107 -0.236 7.374 -9.843 1.00 1.00 N ATOM 500 CA GLN A 107 -1.238 6.604 -10.560 1.00 1.00 C ATOM 501 C GLN A 107 -2.523 6.507 -9.733 1.00 1.00 C ATOM 502 O GLN A 107 -2.507 6.735 -8.525 1.00 1.00 O ATOM 503 CB GLN A 107 -0.710 5.213 -10.916 1.00 1.00 C ATOM 504 CG GLN A 107 -1.314 4.718 -12.232 1.00 1.00 C ATOM 505 CD GLN A 107 -1.941 3.333 -12.061 1.00 1.00 C ATOM 506 OE1 GLN A 107 -3.150 3.168 -12.042 1.00 1.00 O ATOM 507 NE2 GLN A 107 -1.055 2.349 -11.936 1.00 1.00 N ATOM 0 H GLN A 107 -0.013 7.022 -8.912 1.00 1.00 H new ATOM 0 HA GLN A 107 -1.466 7.120 -11.493 1.00 1.00 H new ATOM 0 HB2 GLN A 107 0.376 5.243 -10.999 1.00 1.00 H new ATOM 0 HB3 GLN A 107 -0.950 4.513 -10.116 1.00 1.00 H new ATOM 0 HG2 GLN A 107 -2.070 5.423 -12.577 1.00 1.00 H new ATOM 0 HG3 GLN A 107 -0.541 4.679 -12.999 1.00 1.00 H new ATOM 0 HE21 GLN A 107 -0.056 2.556 -11.961 1.00 1.00 H new ATOM 0 HE22 GLN A 107 -1.374 1.388 -11.816 1.00 1.00 H new ATOM 514 N LYS A 108 -3.605 6.171 -10.420 1.00 1.00 N ATOM 515 CA LYS A 108 -4.896 6.042 -9.765 1.00 1.00 C ATOM 516 C LYS A 108 -5.166 4.566 -9.466 1.00 1.00 C ATOM 517 O LYS A 108 -4.839 3.696 -10.271 1.00 1.00 O ATOM 518 CB LYS A 108 -5.990 6.710 -10.601 1.00 1.00 C ATOM 519 CG LYS A 108 -7.372 6.472 -9.987 1.00 1.00 C ATOM 520 CD LYS A 108 -8.454 7.223 -10.766 1.00 1.00 C ATOM 521 CE LYS A 108 -8.379 8.727 -10.496 1.00 1.00 C ATOM 522 NZ LYS A 108 -8.980 9.048 -9.182 1.00 1.00 N ATOM 0 H LYS A 108 -3.614 5.984 -11.423 1.00 1.00 H new ATOM 0 HA LYS A 108 -4.892 6.566 -8.809 1.00 1.00 H new ATOM 0 HB2 LYS A 108 -5.798 7.781 -10.669 1.00 1.00 H new ATOM 0 HB3 LYS A 108 -5.967 6.317 -11.617 1.00 1.00 H new ATOM 0 HG2 LYS A 108 -7.594 5.405 -9.985 1.00 1.00 H new ATOM 0 HG3 LYS A 108 -7.374 6.800 -8.947 1.00 1.00 H new ATOM 0 HD2 LYS A 108 -8.336 7.035 -11.833 1.00 1.00 H new ATOM 0 HD3 LYS A 108 -9.438 6.848 -10.483 1.00 1.00 H new ATOM 0 HE2 LYS A 108 -7.340 9.055 -10.517 1.00 1.00 H new ATOM 0 HE3 LYS A 108 -8.901 9.270 -11.284 1.00 1.00 H new ATOM 0 HZ1 LYS A 108 -9.029 10.080 -9.066 1.00 1.00 H new ATOM 0 HZ2 LYS A 108 -9.939 8.648 -9.132 1.00 1.00 H new ATOM 0 HZ3 LYS A 108 -8.395 8.641 -8.424 1.00 1.00 H new ATOM 531 N VAL A 109 -5.760 4.330 -8.305 1.00 1.00 N ATOM 532 CA VAL A 109 -6.077 2.975 -7.889 1.00 1.00 C ATOM 533 C VAL A 109 -7.463 2.956 -7.241 1.00 1.00 C ATOM 534 O VAL A 109 -7.751 3.763 -6.358 1.00 1.00 O ATOM 535 CB VAL A 109 -4.980 2.440 -6.967 1.00 1.00 C ATOM 536 CG1 VAL A 109 -3.674 2.225 -7.736 1.00 1.00 C ATOM 537 CG2 VAL A 109 -4.765 3.370 -5.772 1.00 1.00 C ATOM 0 H VAL A 109 -6.030 5.055 -7.640 1.00 1.00 H new ATOM 0 HA VAL A 109 -6.112 2.310 -8.752 1.00 1.00 H new ATOM 0 HB VAL A 109 -5.307 1.473 -6.584 1.00 1.00 H new ATOM 0 HG11 VAL A 109 -2.911 1.844 -7.057 1.00 1.00 H new ATOM 0 HG12 VAL A 109 -3.838 1.505 -8.538 1.00 1.00 H new ATOM 0 HG13 VAL A 109 -3.342 3.172 -8.161 1.00 1.00 H new ATOM 0 HG21 VAL A 109 -3.980 2.966 -5.133 1.00 1.00 H new ATOM 0 HG22 VAL A 109 -4.471 4.357 -6.128 1.00 1.00 H new ATOM 0 HG23 VAL A 109 -5.691 3.450 -5.202 1.00 1.00 H new ATOM 547 N ASN A 110 -8.285 2.026 -7.706 1.00 1.00 N ATOM 548 CA ASN A 110 -9.635 1.892 -7.182 1.00 1.00 C ATOM 549 C ASN A 110 -9.824 0.477 -6.630 1.00 1.00 C ATOM 550 O ASN A 110 -9.141 -0.454 -7.053 1.00 1.00 O ATOM 551 CB ASN A 110 -10.677 2.114 -8.280 1.00 1.00 C ATOM 552 CG ASN A 110 -11.022 3.599 -8.415 1.00 1.00 C ATOM 553 OD1 ASN A 110 -11.799 4.153 -7.656 1.00 1.00 O ATOM 554 ND2 ASN A 110 -10.402 4.209 -9.421 1.00 1.00 N ATOM 0 H ASN A 110 -8.043 1.359 -8.439 1.00 1.00 H new ATOM 0 HA ASN A 110 -9.770 2.640 -6.401 1.00 1.00 H new ATOM 0 HB2 ASN A 110 -10.296 1.737 -9.229 1.00 1.00 H new ATOM 0 HB3 ASN A 110 -11.579 1.547 -8.051 1.00 1.00 H new ATOM 0 HD21 ASN A 110 -10.565 5.201 -9.594 1.00 1.00 H new ATOM 0 HD22 ASN A 110 -9.763 3.685 -10.019 1.00 1.00 H new ATOM 560 N VAL A 111 -10.756 0.361 -5.696 1.00 1.00 N ATOM 561 CA VAL A 111 -11.045 -0.924 -5.082 1.00 1.00 C ATOM 562 C VAL A 111 -11.016 -2.014 -6.155 1.00 1.00 C ATOM 563 O VAL A 111 -11.868 -2.040 -7.041 1.00 1.00 O ATOM 564 CB VAL A 111 -12.376 -0.858 -4.331 1.00 1.00 C ATOM 565 CG1 VAL A 111 -12.813 -2.249 -3.867 1.00 1.00 C ATOM 566 CG2 VAL A 111 -12.294 0.114 -3.153 1.00 1.00 C ATOM 0 H VAL A 111 -11.321 1.136 -5.349 1.00 1.00 H new ATOM 0 HA VAL A 111 -10.284 -1.175 -4.343 1.00 1.00 H new ATOM 0 HB VAL A 111 -13.132 -0.483 -5.021 1.00 1.00 H new ATOM 0 HG11 VAL A 111 -13.762 -2.174 -3.336 1.00 1.00 H new ATOM 0 HG12 VAL A 111 -12.932 -2.901 -4.733 1.00 1.00 H new ATOM 0 HG13 VAL A 111 -12.057 -2.665 -3.201 1.00 1.00 H new ATOM 0 HG21 VAL A 111 -13.254 0.142 -2.637 1.00 1.00 H new ATOM 0 HG22 VAL A 111 -11.519 -0.217 -2.461 1.00 1.00 H new ATOM 0 HG23 VAL A 111 -12.051 1.111 -3.520 1.00 1.00 H new ATOM 576 N GLY A 112 -10.026 -2.887 -6.039 1.00 1.00 N ATOM 577 CA GLY A 112 -9.875 -3.977 -6.988 1.00 1.00 C ATOM 578 C GLY A 112 -8.430 -4.079 -7.480 1.00 1.00 C ATOM 579 O GLY A 112 -7.993 -5.143 -7.921 1.00 1.00 O ATOM 0 H GLY A 112 -9.321 -2.862 -5.303 1.00 1.00 H new ATOM 0 HA2 GLY A 112 -10.170 -4.916 -6.519 1.00 1.00 H new ATOM 0 HA3 GLY A 112 -10.542 -3.821 -7.836 1.00 1.00 H new ATOM 583 N ASP A 113 -7.726 -2.960 -7.388 1.00 1.00 N ATOM 584 CA ASP A 113 -6.340 -2.911 -7.818 1.00 1.00 C ATOM 585 C ASP A 113 -5.427 -3.145 -6.612 1.00 1.00 C ATOM 586 O ASP A 113 -5.643 -2.572 -5.546 1.00 1.00 O ATOM 587 CB ASP A 113 -5.995 -1.544 -8.413 1.00 1.00 C ATOM 588 CG ASP A 113 -6.029 -1.477 -9.940 1.00 1.00 C ATOM 589 OD1 ASP A 113 -4.984 -1.352 -10.597 1.00 1.00 O ATOM 590 OD2 ASP A 113 -7.205 -1.559 -10.464 1.00 1.00 O ATOM 0 H ASP A 113 -8.090 -2.080 -7.022 1.00 1.00 H new ATOM 0 HA ASP A 113 -6.195 -3.681 -8.576 1.00 1.00 H new ATOM 0 HB2 ASP A 113 -6.692 -0.806 -8.016 1.00 1.00 H new ATOM 0 HB3 ASP A 113 -5.000 -1.258 -8.074 1.00 1.00 H new ATOM 595 N THR A 114 -4.427 -3.989 -6.821 1.00 1.00 N ATOM 596 CA THR A 114 -3.481 -4.305 -5.764 1.00 1.00 C ATOM 597 C THR A 114 -2.924 -3.022 -5.145 1.00 1.00 C ATOM 598 O THR A 114 -3.205 -1.925 -5.626 1.00 1.00 O ATOM 599 CB THR A 114 -2.401 -5.215 -6.354 1.00 1.00 C ATOM 600 OG1 THR A 114 -3.120 -6.357 -6.810 1.00 1.00 O ATOM 601 CG2 THR A 114 -1.457 -5.770 -5.286 1.00 1.00 C ATOM 0 H THR A 114 -4.251 -4.464 -7.707 1.00 1.00 H new ATOM 0 HA THR A 114 -3.965 -4.838 -4.946 1.00 1.00 H new ATOM 0 HB THR A 114 -1.825 -4.661 -7.096 1.00 1.00 H new ATOM 0 HG1 THR A 114 -2.496 -6.999 -7.209 1.00 1.00 H new ATOM 0 HG21 THR A 114 -0.710 -6.409 -5.757 1.00 1.00 H new ATOM 0 HG22 THR A 114 -0.959 -4.945 -4.776 1.00 1.00 H new ATOM 0 HG23 THR A 114 -2.028 -6.352 -4.563 1.00 1.00 H new ATOM 609 N LEU A 115 -2.145 -3.202 -4.089 1.00 1.00 N ATOM 610 CA LEU A 115 -1.546 -2.072 -3.399 1.00 1.00 C ATOM 611 C LEU A 115 -0.088 -2.396 -3.070 1.00 1.00 C ATOM 612 O LEU A 115 0.800 -1.578 -3.301 1.00 1.00 O ATOM 613 CB LEU A 115 -2.381 -1.688 -2.175 1.00 1.00 C ATOM 614 CG LEU A 115 -2.778 -0.213 -2.071 1.00 1.00 C ATOM 615 CD1 LEU A 115 -1.542 0.688 -2.079 1.00 1.00 C ATOM 616 CD2 LEU A 115 -3.772 0.166 -3.170 1.00 1.00 C ATOM 0 H LEU A 115 -1.915 -4.114 -3.694 1.00 1.00 H new ATOM 0 HA LEU A 115 -1.541 -1.192 -4.042 1.00 1.00 H new ATOM 0 HB2 LEU A 115 -3.290 -2.289 -2.176 1.00 1.00 H new ATOM 0 HB3 LEU A 115 -1.822 -1.958 -1.279 1.00 1.00 H new ATOM 0 HG LEU A 115 -3.281 -0.060 -1.116 1.00 1.00 H new ATOM 0 HD11 LEU A 115 -1.851 1.731 -2.004 1.00 1.00 H new ATOM 0 HD12 LEU A 115 -0.903 0.437 -1.232 1.00 1.00 H new ATOM 0 HD13 LEU A 115 -0.989 0.539 -3.007 1.00 1.00 H new ATOM 0 HD21 LEU A 115 -4.037 1.219 -3.073 1.00 1.00 H new ATOM 0 HD22 LEU A 115 -3.318 -0.006 -4.146 1.00 1.00 H new ATOM 0 HD23 LEU A 115 -4.670 -0.445 -3.075 1.00 1.00 H new ATOM 627 N CYS A 116 0.114 -3.592 -2.537 1.00 1.00 N ATOM 628 CA CYS A 116 1.450 -4.033 -2.175 1.00 1.00 C ATOM 629 C CYS A 116 1.374 -5.504 -1.757 1.00 1.00 C ATOM 630 O CYS A 116 0.380 -6.177 -2.023 1.00 1.00 O ATOM 631 CB CYS A 116 2.057 -3.159 -1.076 1.00 1.00 C ATOM 632 SG CYS A 116 1.320 -3.586 0.543 1.00 1.00 S ATOM 0 H CYS A 116 -0.625 -4.269 -2.347 1.00 1.00 H new ATOM 0 HA CYS A 116 2.113 -3.934 -3.034 1.00 1.00 H new ATOM 0 HB2 CYS A 116 3.137 -3.301 -1.042 1.00 1.00 H new ATOM 0 HB3 CYS A 116 1.881 -2.107 -1.298 1.00 1.00 H new ATOM 0 HG CYS A 116 2.173 -3.329 1.489 1.00 1.00 H new ATOM 637 N ILE A 117 2.436 -5.957 -1.108 1.00 1.00 N ATOM 638 CA ILE A 117 2.502 -7.335 -0.651 1.00 1.00 C ATOM 639 C ILE A 117 3.076 -7.371 0.767 1.00 1.00 C ATOM 640 O ILE A 117 3.836 -6.484 1.155 1.00 1.00 O ATOM 641 CB ILE A 117 3.277 -8.196 -1.650 1.00 1.00 C ATOM 642 CG1 ILE A 117 2.617 -8.162 -3.031 1.00 1.00 C ATOM 643 CG2 ILE A 117 3.445 -9.624 -1.129 1.00 1.00 C ATOM 644 CD1 ILE A 117 3.072 -9.347 -3.884 1.00 1.00 C ATOM 0 H ILE A 117 3.258 -5.395 -0.888 1.00 1.00 H new ATOM 0 HA ILE A 117 1.503 -7.767 -0.602 1.00 1.00 H new ATOM 0 HB ILE A 117 4.276 -7.775 -1.761 1.00 1.00 H new ATOM 0 HG12 ILE A 117 1.533 -8.184 -2.921 1.00 1.00 H new ATOM 0 HG13 ILE A 117 2.868 -7.229 -3.535 1.00 1.00 H new ATOM 0 HG21 ILE A 117 3.999 -10.215 -1.858 1.00 1.00 H new ATOM 0 HG22 ILE A 117 3.992 -9.605 -0.186 1.00 1.00 H new ATOM 0 HG23 ILE A 117 2.464 -10.071 -0.970 1.00 1.00 H new ATOM 0 HD11 ILE A 117 2.589 -9.300 -4.860 1.00 1.00 H new ATOM 0 HD12 ILE A 117 4.154 -9.309 -4.012 1.00 1.00 H new ATOM 0 HD13 ILE A 117 2.798 -10.278 -3.388 1.00 1.00 H new ATOM 655 N VAL A 118 2.691 -8.403 1.502 1.00 1.00 N ATOM 656 CA VAL A 118 3.159 -8.566 2.868 1.00 1.00 C ATOM 657 C VAL A 118 3.569 -10.023 3.092 1.00 1.00 C ATOM 658 O VAL A 118 2.804 -10.939 2.798 1.00 1.00 O ATOM 659 CB VAL A 118 2.084 -8.090 3.849 1.00 1.00 C ATOM 660 CG1 VAL A 118 2.443 -8.478 5.284 1.00 1.00 C ATOM 661 CG2 VAL A 118 1.861 -6.581 3.727 1.00 1.00 C ATOM 0 H VAL A 118 2.060 -9.135 1.177 1.00 1.00 H new ATOM 0 HA VAL A 118 4.040 -7.949 3.046 1.00 1.00 H new ATOM 0 HB VAL A 118 1.149 -8.588 3.591 1.00 1.00 H new ATOM 0 HG11 VAL A 118 1.664 -8.128 5.961 1.00 1.00 H new ATOM 0 HG12 VAL A 118 2.528 -9.562 5.357 1.00 1.00 H new ATOM 0 HG13 VAL A 118 3.394 -8.020 5.558 1.00 1.00 H new ATOM 0 HG21 VAL A 118 1.093 -6.268 4.434 1.00 1.00 H new ATOM 0 HG22 VAL A 118 2.791 -6.057 3.946 1.00 1.00 H new ATOM 0 HG23 VAL A 118 1.540 -6.341 2.713 1.00 1.00 H new ATOM 671 N GLU A 119 4.777 -10.190 3.611 1.00 1.00 N ATOM 672 CA GLU A 119 5.299 -11.519 3.877 1.00 1.00 C ATOM 673 C GLU A 119 4.970 -11.941 5.311 1.00 1.00 C ATOM 674 O GLU A 119 5.237 -11.200 6.256 1.00 1.00 O ATOM 675 CB GLU A 119 6.806 -11.579 3.620 1.00 1.00 C ATOM 676 CG GLU A 119 7.191 -12.879 2.912 1.00 1.00 C ATOM 677 CD GLU A 119 8.478 -12.703 2.104 1.00 1.00 C ATOM 678 OE1 GLU A 119 9.485 -12.220 2.640 1.00 1.00 O ATOM 679 OE2 GLU A 119 8.407 -13.090 0.875 1.00 1.00 O ATOM 0 H GLU A 119 5.409 -9.427 3.854 1.00 1.00 H new ATOM 0 HA GLU A 119 4.820 -12.220 3.193 1.00 1.00 H new ATOM 0 HB2 GLU A 119 7.109 -10.726 3.012 1.00 1.00 H new ATOM 0 HB3 GLU A 119 7.343 -11.503 4.566 1.00 1.00 H new ATOM 0 HG2 GLU A 119 7.325 -13.672 3.648 1.00 1.00 H new ATOM 0 HG3 GLU A 119 6.382 -13.191 2.251 1.00 1.00 H new ATOM 685 N ALA A 120 4.396 -13.129 5.427 1.00 1.00 N ATOM 686 CA ALA A 120 4.027 -13.658 6.730 1.00 1.00 C ATOM 687 C ALA A 120 3.784 -15.164 6.614 1.00 1.00 C ATOM 688 O ALA A 120 3.399 -15.654 5.554 1.00 1.00 O ATOM 689 CB ALA A 120 2.803 -12.908 7.258 1.00 1.00 C ATOM 0 H ALA A 120 4.177 -13.741 4.641 1.00 1.00 H new ATOM 0 HA ALA A 120 4.834 -13.509 7.447 1.00 1.00 H new ATOM 0 HB1 ALA A 120 2.527 -13.305 8.235 1.00 1.00 H new ATOM 0 HB2 ALA A 120 3.038 -11.848 7.350 1.00 1.00 H new ATOM 0 HB3 ALA A 120 1.971 -13.036 6.566 1.00 1.00 H new ATOM 695 N MET A 121 4.018 -15.856 7.719 1.00 1.00 N ATOM 696 CA MET A 121 3.829 -17.296 7.754 1.00 1.00 C ATOM 697 C MET A 121 4.602 -17.979 6.625 1.00 1.00 C ATOM 698 O MET A 121 4.283 -19.103 6.241 1.00 1.00 O ATOM 699 CB MET A 121 2.339 -17.619 7.620 1.00 1.00 C ATOM 700 CG MET A 121 1.564 -17.155 8.856 1.00 1.00 C ATOM 701 SD MET A 121 0.519 -18.473 9.451 1.00 1.00 S ATOM 702 CE MET A 121 1.719 -19.435 10.357 1.00 1.00 C ATOM 0 H MET A 121 4.337 -15.446 8.597 1.00 1.00 H new ATOM 0 HA MET A 121 4.207 -17.669 8.706 1.00 1.00 H new ATOM 0 HB2 MET A 121 1.937 -17.134 6.731 1.00 1.00 H new ATOM 0 HB3 MET A 121 2.207 -18.692 7.485 1.00 1.00 H new ATOM 0 HG2 MET A 121 2.259 -16.850 9.638 1.00 1.00 H new ATOM 0 HG3 MET A 121 0.959 -16.283 8.610 1.00 1.00 H new ATOM 0 HE1 MET A 121 1.231 -20.304 10.798 1.00 1.00 H new ATOM 0 HE2 MET A 121 2.506 -19.766 9.680 1.00 1.00 H new ATOM 0 HE3 MET A 121 2.154 -18.823 11.148 1.00 1.00 H new ATOM 710 N LYS A 122 5.605 -17.271 6.125 1.00 1.00 N ATOM 711 CA LYS A 122 6.425 -17.795 5.047 1.00 1.00 C ATOM 712 C LYS A 122 5.601 -17.842 3.760 1.00 1.00 C ATOM 713 O LYS A 122 5.690 -18.803 2.996 1.00 1.00 O ATOM 714 CB LYS A 122 7.030 -19.144 5.441 1.00 1.00 C ATOM 715 CG LYS A 122 8.519 -19.006 5.763 1.00 1.00 C ATOM 716 CD LYS A 122 9.374 -19.234 4.515 1.00 1.00 C ATOM 717 CE LYS A 122 10.130 -17.961 4.128 1.00 1.00 C ATOM 718 NZ LYS A 122 11.254 -18.282 3.221 1.00 1.00 N ATOM 0 H LYS A 122 5.868 -16.339 6.447 1.00 1.00 H new ATOM 0 HA LYS A 122 7.272 -17.135 4.858 1.00 1.00 H new ATOM 0 HB2 LYS A 122 6.503 -19.544 6.307 1.00 1.00 H new ATOM 0 HB3 LYS A 122 6.895 -19.858 4.629 1.00 1.00 H new ATOM 0 HG2 LYS A 122 8.717 -18.013 6.167 1.00 1.00 H new ATOM 0 HG3 LYS A 122 8.796 -19.725 6.534 1.00 1.00 H new ATOM 0 HD2 LYS A 122 10.083 -20.041 4.698 1.00 1.00 H new ATOM 0 HD3 LYS A 122 8.739 -19.550 3.687 1.00 1.00 H new ATOM 0 HE2 LYS A 122 9.451 -17.261 3.641 1.00 1.00 H new ATOM 0 HE3 LYS A 122 10.507 -17.468 5.024 1.00 1.00 H new ATOM 0 HZ1 LYS A 122 11.757 -17.407 2.968 1.00 1.00 H new ATOM 0 HZ2 LYS A 122 11.910 -18.933 3.698 1.00 1.00 H new ATOM 0 HZ3 LYS A 122 10.886 -18.732 2.358 1.00 1.00 H new ATOM 727 N MET A 123 4.817 -16.793 3.558 1.00 1.00 N ATOM 728 CA MET A 123 3.976 -16.704 2.375 1.00 1.00 C ATOM 729 C MET A 123 3.782 -15.247 1.951 1.00 1.00 C ATOM 730 O MET A 123 3.840 -14.341 2.781 1.00 1.00 O ATOM 731 CB MET A 123 2.615 -17.337 2.668 1.00 1.00 C ATOM 732 CG MET A 123 2.406 -18.600 1.830 1.00 1.00 C ATOM 733 SD MET A 123 2.304 -18.175 0.099 1.00 1.00 S ATOM 734 CE MET A 123 0.628 -18.682 -0.246 1.00 1.00 C ATOM 0 H MET A 123 4.746 -15.998 4.193 1.00 1.00 H new ATOM 0 HA MET A 123 4.466 -17.238 1.561 1.00 1.00 H new ATOM 0 HB2 MET A 123 2.545 -17.584 3.727 1.00 1.00 H new ATOM 0 HB3 MET A 123 1.823 -16.619 2.455 1.00 1.00 H new ATOM 0 HG2 MET A 123 3.229 -19.296 1.994 1.00 1.00 H new ATOM 0 HG3 MET A 123 1.493 -19.107 2.143 1.00 1.00 H new ATOM 0 HE1 MET A 123 0.397 -18.486 -1.293 1.00 1.00 H new ATOM 0 HE2 MET A 123 0.522 -19.748 -0.045 1.00 1.00 H new ATOM 0 HE3 MET A 123 -0.059 -18.123 0.389 1.00 1.00 H new ATOM 742 N MET A 124 3.553 -15.066 0.658 1.00 1.00 N ATOM 743 CA MET A 124 3.349 -13.735 0.113 1.00 1.00 C ATOM 744 C MET A 124 1.862 -13.381 0.072 1.00 1.00 C ATOM 745 O MET A 124 1.132 -13.851 -0.800 1.00 1.00 O ATOM 746 CB MET A 124 3.930 -13.668 -1.301 1.00 1.00 C ATOM 747 CG MET A 124 3.436 -14.840 -2.152 1.00 1.00 C ATOM 748 SD MET A 124 4.716 -16.075 -2.292 1.00 1.00 S ATOM 749 CE MET A 124 5.936 -15.155 -3.216 1.00 1.00 C ATOM 0 H MET A 124 3.504 -15.820 -0.028 1.00 1.00 H new ATOM 0 HA MET A 124 3.856 -13.017 0.758 1.00 1.00 H new ATOM 0 HB2 MET A 124 3.645 -12.727 -1.771 1.00 1.00 H new ATOM 0 HB3 MET A 124 5.019 -13.683 -1.252 1.00 1.00 H new ATOM 0 HG2 MET A 124 2.545 -15.277 -1.701 1.00 1.00 H new ATOM 0 HG3 MET A 124 3.151 -14.486 -3.143 1.00 1.00 H new ATOM 0 HE1 MET A 124 6.457 -15.826 -3.899 1.00 1.00 H new ATOM 0 HE2 MET A 124 5.443 -14.368 -3.787 1.00 1.00 H new ATOM 0 HE3 MET A 124 6.653 -14.709 -2.527 1.00 1.00 H new ATOM 757 N ASN A 125 1.456 -12.556 1.027 1.00 1.00 N ATOM 758 CA ASN A 125 0.068 -12.134 1.110 1.00 1.00 C ATOM 759 C ASN A 125 -0.096 -10.790 0.398 1.00 1.00 C ATOM 760 O ASN A 125 0.429 -9.774 0.853 1.00 1.00 O ATOM 761 CB ASN A 125 -0.367 -11.953 2.566 1.00 1.00 C ATOM 762 CG ASN A 125 0.024 -13.169 3.409 1.00 1.00 C ATOM 763 OD1 ASN A 125 -0.750 -14.092 3.610 1.00 1.00 O ATOM 764 ND2 ASN A 125 1.262 -13.120 3.890 1.00 1.00 N ATOM 0 H ASN A 125 2.064 -12.169 1.749 1.00 1.00 H new ATOM 0 HA ASN A 125 -0.546 -12.904 0.643 1.00 1.00 H new ATOM 0 HB2 ASN A 125 0.095 -11.056 2.979 1.00 1.00 H new ATOM 0 HB3 ASN A 125 -1.446 -11.806 2.612 1.00 1.00 H new ATOM 0 HD21 ASN A 125 1.616 -13.884 4.465 1.00 1.00 H new ATOM 0 HD22 ASN A 125 1.858 -12.318 3.684 1.00 1.00 H new ATOM 770 N GLN A 126 -0.826 -10.826 -0.707 1.00 1.00 N ATOM 771 CA GLN A 126 -1.066 -9.624 -1.486 1.00 1.00 C ATOM 772 C GLN A 126 -2.071 -8.720 -0.771 1.00 1.00 C ATOM 773 O GLN A 126 -3.010 -9.205 -0.142 1.00 1.00 O ATOM 774 CB GLN A 126 -1.546 -9.971 -2.897 1.00 1.00 C ATOM 775 CG GLN A 126 -0.368 -10.333 -3.804 1.00 1.00 C ATOM 776 CD GLN A 126 -0.742 -11.465 -4.763 1.00 1.00 C ATOM 777 OE1 GLN A 126 -1.737 -12.150 -4.597 1.00 1.00 O ATOM 778 NE2 GLN A 126 0.110 -11.622 -5.772 1.00 1.00 N ATOM 0 H GLN A 126 -1.259 -11.670 -1.081 1.00 1.00 H new ATOM 0 HA GLN A 126 -0.125 -9.083 -1.582 1.00 1.00 H new ATOM 0 HB2 GLN A 126 -2.245 -10.806 -2.852 1.00 1.00 H new ATOM 0 HB3 GLN A 126 -2.088 -9.125 -3.319 1.00 1.00 H new ATOM 0 HG2 GLN A 126 -0.060 -9.456 -4.373 1.00 1.00 H new ATOM 0 HG3 GLN A 126 0.485 -10.634 -3.196 1.00 1.00 H new ATOM 0 HE21 GLN A 126 0.924 -11.013 -5.851 1.00 1.00 H new ATOM 0 HE22 GLN A 126 -0.051 -12.351 -6.467 1.00 1.00 H new ATOM 785 N ILE A 127 -1.841 -7.420 -0.893 1.00 1.00 N ATOM 786 CA ILE A 127 -2.715 -6.444 -0.266 1.00 1.00 C ATOM 787 C ILE A 127 -3.484 -5.685 -1.349 1.00 1.00 C ATOM 788 O ILE A 127 -2.888 -4.973 -2.156 1.00 1.00 O ATOM 789 CB ILE A 127 -1.918 -5.536 0.673 1.00 1.00 C ATOM 790 CG1 ILE A 127 -1.029 -6.359 1.607 1.00 1.00 C ATOM 791 CG2 ILE A 127 -2.847 -4.597 1.446 1.00 1.00 C ATOM 792 CD1 ILE A 127 -1.778 -6.735 2.887 1.00 1.00 C ATOM 0 H ILE A 127 -1.062 -7.021 -1.417 1.00 1.00 H new ATOM 0 HA ILE A 127 -3.454 -6.942 0.361 1.00 1.00 H new ATOM 0 HB ILE A 127 -1.260 -4.912 0.068 1.00 1.00 H new ATOM 0 HG12 ILE A 127 -0.698 -7.263 1.096 1.00 1.00 H new ATOM 0 HG13 ILE A 127 -0.134 -5.789 1.859 1.00 1.00 H new ATOM 0 HG21 ILE A 127 -2.256 -3.962 2.106 1.00 1.00 H new ATOM 0 HG22 ILE A 127 -3.401 -3.974 0.744 1.00 1.00 H new ATOM 0 HG23 ILE A 127 -3.547 -5.185 2.039 1.00 1.00 H new ATOM 0 HD11 ILE A 127 -1.123 -7.320 3.533 1.00 1.00 H new ATOM 0 HD12 ILE A 127 -2.087 -5.828 3.408 1.00 1.00 H new ATOM 0 HD13 ILE A 127 -2.659 -7.325 2.633 1.00 1.00 H new ATOM 803 N GLU A 128 -4.798 -5.862 -1.332 1.00 1.00 N ATOM 804 CA GLU A 128 -5.655 -5.203 -2.303 1.00 1.00 C ATOM 805 C GLU A 128 -6.108 -3.841 -1.773 1.00 1.00 C ATOM 806 O GLU A 128 -6.479 -3.718 -0.607 1.00 1.00 O ATOM 807 CB GLU A 128 -6.855 -6.080 -2.659 1.00 1.00 C ATOM 808 CG GLU A 128 -7.618 -5.507 -3.856 1.00 1.00 C ATOM 809 CD GLU A 128 -8.666 -4.489 -3.400 1.00 1.00 C ATOM 810 OE1 GLU A 128 -8.695 -3.359 -3.912 1.00 1.00 O ATOM 811 OE2 GLU A 128 -9.471 -4.908 -2.483 1.00 1.00 O ATOM 0 H GLU A 128 -5.289 -6.452 -0.661 1.00 1.00 H new ATOM 0 HA GLU A 128 -5.081 -5.043 -3.216 1.00 1.00 H new ATOM 0 HB2 GLU A 128 -6.516 -7.090 -2.889 1.00 1.00 H new ATOM 0 HB3 GLU A 128 -7.522 -6.155 -1.800 1.00 1.00 H new ATOM 0 HG2 GLU A 128 -6.919 -5.032 -4.544 1.00 1.00 H new ATOM 0 HG3 GLU A 128 -8.104 -6.315 -4.403 1.00 1.00 H new ATOM 817 N ALA A 129 -6.063 -2.854 -2.655 1.00 1.00 N ATOM 818 CA ALA A 129 -6.464 -1.505 -2.290 1.00 1.00 C ATOM 819 C ALA A 129 -7.709 -1.572 -1.402 1.00 1.00 C ATOM 820 O ALA A 129 -8.662 -2.285 -1.713 1.00 1.00 O ATOM 821 CB ALA A 129 -6.696 -0.681 -3.558 1.00 1.00 C ATOM 0 H ALA A 129 -5.755 -2.961 -3.622 1.00 1.00 H new ATOM 0 HA ALA A 129 -5.677 -1.011 -1.720 1.00 1.00 H new ATOM 0 HB1 ALA A 129 -6.997 0.330 -3.285 1.00 1.00 H new ATOM 0 HB2 ALA A 129 -5.775 -0.641 -4.140 1.00 1.00 H new ATOM 0 HB3 ALA A 129 -7.482 -1.144 -4.154 1.00 1.00 H new ATOM 827 N ASP A 130 -7.660 -0.818 -0.313 1.00 1.00 N ATOM 828 CA ASP A 130 -8.773 -0.782 0.622 1.00 1.00 C ATOM 829 C ASP A 130 -9.300 0.651 0.725 1.00 1.00 C ATOM 830 O ASP A 130 -10.042 0.977 1.651 1.00 1.00 O ATOM 831 CB ASP A 130 -8.332 -1.225 2.019 1.00 1.00 C ATOM 832 CG ASP A 130 -9.427 -1.185 3.085 1.00 1.00 C ATOM 833 OD1 ASP A 130 -10.626 -1.218 2.771 1.00 1.00 O ATOM 834 OD2 ASP A 130 -9.002 -1.115 4.301 1.00 1.00 O ATOM 0 H ASP A 130 -6.868 -0.228 -0.057 1.00 1.00 H new ATOM 0 HA ASP A 130 -9.545 -1.459 0.255 1.00 1.00 H new ATOM 0 HB2 ASP A 130 -7.944 -2.242 1.956 1.00 1.00 H new ATOM 0 HB3 ASP A 130 -7.508 -0.589 2.342 1.00 1.00 H new ATOM 839 N LYS A 131 -8.898 1.466 -0.238 1.00 1.00 N ATOM 840 CA LYS A 131 -9.320 2.856 -0.268 1.00 1.00 C ATOM 841 C LYS A 131 -8.710 3.545 -1.490 1.00 1.00 C ATOM 842 O LYS A 131 -7.604 4.079 -1.417 1.00 1.00 O ATOM 843 CB LYS A 131 -8.989 3.545 1.057 1.00 1.00 C ATOM 844 CG LYS A 131 -10.264 3.897 1.826 1.00 1.00 C ATOM 845 CD LYS A 131 -9.931 4.563 3.163 1.00 1.00 C ATOM 846 CE LYS A 131 -11.189 4.734 4.018 1.00 1.00 C ATOM 847 NZ LYS A 131 -11.292 3.643 5.013 1.00 1.00 N ATOM 0 H LYS A 131 -8.284 1.190 -1.004 1.00 1.00 H new ATOM 0 HA LYS A 131 -10.403 2.923 -0.373 1.00 1.00 H new ATOM 0 HB2 LYS A 131 -8.363 2.891 1.664 1.00 1.00 H new ATOM 0 HB3 LYS A 131 -8.414 4.451 0.866 1.00 1.00 H new ATOM 0 HG2 LYS A 131 -10.882 4.565 1.226 1.00 1.00 H new ATOM 0 HG3 LYS A 131 -10.849 2.994 2.001 1.00 1.00 H new ATOM 0 HD2 LYS A 131 -9.200 3.960 3.702 1.00 1.00 H new ATOM 0 HD3 LYS A 131 -9.473 5.536 2.985 1.00 1.00 H new ATOM 0 HE2 LYS A 131 -11.161 5.697 4.527 1.00 1.00 H new ATOM 0 HE3 LYS A 131 -12.072 4.736 3.379 1.00 1.00 H new ATOM 0 HZ1 LYS A 131 -12.151 3.774 5.585 1.00 1.00 H new ATOM 0 HZ2 LYS A 131 -11.340 2.728 4.521 1.00 1.00 H new ATOM 0 HZ3 LYS A 131 -10.458 3.659 5.633 1.00 1.00 H new ATOM 856 N SER A 132 -9.456 3.510 -2.584 1.00 1.00 N ATOM 857 CA SER A 132 -9.002 4.124 -3.820 1.00 1.00 C ATOM 858 C SER A 132 -8.291 5.445 -3.517 1.00 1.00 C ATOM 859 O SER A 132 -8.617 6.120 -2.542 1.00 1.00 O ATOM 860 CB SER A 132 -10.169 4.359 -4.780 1.00 1.00 C ATOM 861 OG SER A 132 -11.001 5.436 -4.358 1.00 1.00 O ATOM 0 H SER A 132 -10.372 3.066 -2.640 1.00 1.00 H new ATOM 0 HA SER A 132 -8.301 3.443 -4.303 1.00 1.00 H new ATOM 0 HB2 SER A 132 -9.781 4.570 -5.777 1.00 1.00 H new ATOM 0 HB3 SER A 132 -10.765 3.449 -4.856 1.00 1.00 H new ATOM 0 HG SER A 132 -11.733 5.554 -4.999 1.00 1.00 H new ATOM 866 N GLY A 133 -7.332 5.773 -4.371 1.00 1.00 N ATOM 867 CA GLY A 133 -6.571 7.001 -4.206 1.00 1.00 C ATOM 868 C GLY A 133 -5.512 7.140 -5.301 1.00 1.00 C ATOM 869 O GLY A 133 -5.471 6.341 -6.236 1.00 1.00 O ATOM 0 H GLY A 133 -7.065 5.210 -5.179 1.00 1.00 H new ATOM 0 HA2 GLY A 133 -7.245 7.857 -4.236 1.00 1.00 H new ATOM 0 HA3 GLY A 133 -6.091 7.007 -3.228 1.00 1.00 H new ATOM 873 N THR A 134 -4.680 8.160 -5.149 1.00 1.00 N ATOM 874 CA THR A 134 -3.623 8.413 -6.113 1.00 1.00 C ATOM 875 C THR A 134 -2.274 8.547 -5.402 1.00 1.00 C ATOM 876 O THR A 134 -1.668 9.618 -5.409 1.00 1.00 O ATOM 877 CB THR A 134 -4.009 9.654 -6.921 1.00 1.00 C ATOM 878 OG1 THR A 134 -5.155 9.242 -7.662 1.00 1.00 O ATOM 879 CG2 THR A 134 -2.974 9.998 -7.996 1.00 1.00 C ATOM 0 H THR A 134 -4.717 8.821 -4.373 1.00 1.00 H new ATOM 0 HA THR A 134 -3.509 7.578 -6.805 1.00 1.00 H new ATOM 0 HB THR A 134 -4.129 10.503 -6.248 1.00 1.00 H new ATOM 0 HG1 THR A 134 -5.473 9.987 -8.213 1.00 1.00 H new ATOM 0 HG21 THR A 134 -3.296 10.886 -8.540 1.00 1.00 H new ATOM 0 HG22 THR A 134 -2.010 10.191 -7.525 1.00 1.00 H new ATOM 0 HG23 THR A 134 -2.878 9.162 -8.689 1.00 1.00 H new ATOM 887 N VAL A 135 -1.844 7.446 -4.806 1.00 1.00 N ATOM 888 CA VAL A 135 -0.579 7.425 -4.092 1.00 1.00 C ATOM 889 C VAL A 135 -0.531 8.603 -3.116 1.00 1.00 C ATOM 890 O VAL A 135 -1.461 9.405 -3.059 1.00 1.00 O ATOM 891 CB VAL A 135 0.583 7.425 -5.087 1.00 1.00 C ATOM 892 CG1 VAL A 135 0.766 8.808 -5.716 1.00 1.00 C ATOM 893 CG2 VAL A 135 1.876 6.950 -4.421 1.00 1.00 C ATOM 0 H VAL A 135 -2.350 6.560 -4.803 1.00 1.00 H new ATOM 0 HA VAL A 135 -0.486 6.512 -3.505 1.00 1.00 H new ATOM 0 HB VAL A 135 0.340 6.723 -5.885 1.00 1.00 H new ATOM 0 HG11 VAL A 135 1.598 8.781 -6.419 1.00 1.00 H new ATOM 0 HG12 VAL A 135 -0.145 9.092 -6.243 1.00 1.00 H new ATOM 0 HG13 VAL A 135 0.975 9.538 -4.934 1.00 1.00 H new ATOM 0 HG21 VAL A 135 2.686 6.960 -5.151 1.00 1.00 H new ATOM 0 HG22 VAL A 135 2.125 7.615 -3.594 1.00 1.00 H new ATOM 0 HG23 VAL A 135 1.740 5.937 -4.043 1.00 1.00 H new ATOM 903 N LYS A 136 0.565 8.670 -2.374 1.00 1.00 N ATOM 904 CA LYS A 136 0.747 9.736 -1.403 1.00 1.00 C ATOM 905 C LYS A 136 2.207 9.759 -0.946 1.00 1.00 C ATOM 906 O LYS A 136 2.836 10.815 -0.918 1.00 1.00 O ATOM 907 CB LYS A 136 -0.254 9.593 -0.256 1.00 1.00 C ATOM 908 CG LYS A 136 -1.017 10.901 -0.028 1.00 1.00 C ATOM 909 CD LYS A 136 -0.311 11.773 1.011 1.00 1.00 C ATOM 910 CE LYS A 136 -1.158 11.914 2.277 1.00 1.00 C ATOM 911 NZ LYS A 136 -0.332 12.405 3.402 1.00 1.00 N ATOM 0 H LYS A 136 1.336 8.004 -2.426 1.00 1.00 H new ATOM 0 HA LYS A 136 0.539 10.705 -1.857 1.00 1.00 H new ATOM 0 HB2 LYS A 136 -0.958 8.792 -0.480 1.00 1.00 H new ATOM 0 HB3 LYS A 136 0.271 9.310 0.656 1.00 1.00 H new ATOM 0 HG2 LYS A 136 -1.101 11.446 -0.968 1.00 1.00 H new ATOM 0 HG3 LYS A 136 -2.031 10.681 0.305 1.00 1.00 H new ATOM 0 HD2 LYS A 136 0.655 11.335 1.263 1.00 1.00 H new ATOM 0 HD3 LYS A 136 -0.114 12.759 0.590 1.00 1.00 H new ATOM 0 HE2 LYS A 136 -1.982 12.604 2.095 1.00 1.00 H new ATOM 0 HE3 LYS A 136 -1.599 10.951 2.535 1.00 1.00 H new ATOM 0 HZ1 LYS A 136 -0.919 12.479 4.257 1.00 1.00 H new ATOM 0 HZ2 LYS A 136 0.450 11.741 3.575 1.00 1.00 H new ATOM 0 HZ3 LYS A 136 0.055 13.341 3.166 1.00 1.00 H new ATOM 920 N ALA A 137 2.703 8.580 -0.597 1.00 1.00 N ATOM 921 CA ALA A 137 4.076 8.452 -0.142 1.00 1.00 C ATOM 922 C ALA A 137 4.279 7.064 0.469 1.00 1.00 C ATOM 923 O ALA A 137 3.459 6.605 1.263 1.00 1.00 O ATOM 924 CB ALA A 137 4.394 9.576 0.846 1.00 1.00 C ATOM 0 H ALA A 137 2.178 7.706 -0.621 1.00 1.00 H new ATOM 0 HA ALA A 137 4.768 8.548 -0.979 1.00 1.00 H new ATOM 0 HB1 ALA A 137 5.425 9.480 1.187 1.00 1.00 H new ATOM 0 HB2 ALA A 137 4.263 10.540 0.355 1.00 1.00 H new ATOM 0 HB3 ALA A 137 3.721 9.510 1.701 1.00 1.00 H new ATOM 930 N ILE A 138 5.378 6.434 0.078 1.00 1.00 N ATOM 931 CA ILE A 138 5.698 5.108 0.577 1.00 1.00 C ATOM 932 C ILE A 138 6.684 5.231 1.741 1.00 1.00 C ATOM 933 O ILE A 138 7.757 5.811 1.591 1.00 1.00 O ATOM 934 CB ILE A 138 6.197 4.214 -0.559 1.00 1.00 C ATOM 935 CG1 ILE A 138 5.558 4.612 -1.891 1.00 1.00 C ATOM 936 CG2 ILE A 138 5.972 2.736 -0.234 1.00 1.00 C ATOM 937 CD1 ILE A 138 4.031 4.577 -1.799 1.00 1.00 C ATOM 0 H ILE A 138 6.058 6.818 -0.579 1.00 1.00 H new ATOM 0 HA ILE A 138 4.804 4.621 0.965 1.00 1.00 H new ATOM 0 HB ILE A 138 7.272 4.360 -0.661 1.00 1.00 H new ATOM 0 HG12 ILE A 138 5.886 5.613 -2.171 1.00 1.00 H new ATOM 0 HG13 ILE A 138 5.894 3.935 -2.676 1.00 1.00 H new ATOM 0 HG21 ILE A 138 6.336 2.123 -1.058 1.00 1.00 H new ATOM 0 HG22 ILE A 138 6.512 2.477 0.677 1.00 1.00 H new ATOM 0 HG23 ILE A 138 4.907 2.553 -0.088 1.00 1.00 H new ATOM 0 HD11 ILE A 138 3.602 4.864 -2.759 1.00 1.00 H new ATOM 0 HD12 ILE A 138 3.705 3.569 -1.543 1.00 1.00 H new ATOM 0 HD13 ILE A 138 3.697 5.273 -1.030 1.00 1.00 H new ATOM 948 N LEU A 139 6.283 4.674 2.875 1.00 1.00 N ATOM 949 CA LEU A 139 7.117 4.714 4.064 1.00 1.00 C ATOM 950 C LEU A 139 7.968 3.444 4.127 1.00 1.00 C ATOM 951 O LEU A 139 9.162 3.506 4.416 1.00 1.00 O ATOM 952 CB LEU A 139 6.262 4.943 5.311 1.00 1.00 C ATOM 953 CG LEU A 139 4.839 5.450 5.065 1.00 1.00 C ATOM 954 CD1 LEU A 139 4.100 5.671 6.386 1.00 1.00 C ATOM 955 CD2 LEU A 139 4.848 6.708 4.195 1.00 1.00 C ATOM 0 H LEU A 139 5.392 4.193 2.995 1.00 1.00 H new ATOM 0 HA LEU A 139 7.805 5.558 4.018 1.00 1.00 H new ATOM 0 HB2 LEU A 139 6.202 4.005 5.863 1.00 1.00 H new ATOM 0 HB3 LEU A 139 6.776 5.659 5.953 1.00 1.00 H new ATOM 0 HG LEU A 139 4.293 4.683 4.515 1.00 1.00 H new ATOM 0 HD11 LEU A 139 3.091 6.031 6.183 1.00 1.00 H new ATOM 0 HD12 LEU A 139 4.046 4.731 6.934 1.00 1.00 H new ATOM 0 HD13 LEU A 139 4.635 6.409 6.983 1.00 1.00 H new ATOM 0 HD21 LEU A 139 3.825 7.047 4.035 1.00 1.00 H new ATOM 0 HD22 LEU A 139 5.417 7.492 4.695 1.00 1.00 H new ATOM 0 HD23 LEU A 139 5.309 6.482 3.234 1.00 1.00 H new ATOM 966 N VAL A 140 7.321 2.322 3.851 1.00 1.00 N ATOM 967 CA VAL A 140 8.003 1.040 3.873 1.00 1.00 C ATOM 968 C VAL A 140 8.641 0.782 2.506 1.00 1.00 C ATOM 969 O VAL A 140 8.080 1.153 1.476 1.00 1.00 O ATOM 970 CB VAL A 140 7.031 -0.063 4.296 1.00 1.00 C ATOM 971 CG1 VAL A 140 5.866 -0.175 3.310 1.00 1.00 C ATOM 972 CG2 VAL A 140 7.754 -1.404 4.445 1.00 1.00 C ATOM 0 H VAL A 140 6.331 2.274 3.611 1.00 1.00 H new ATOM 0 HA VAL A 140 8.806 1.048 4.610 1.00 1.00 H new ATOM 0 HB VAL A 140 6.621 0.207 5.269 1.00 1.00 H new ATOM 0 HG11 VAL A 140 5.190 -0.966 3.634 1.00 1.00 H new ATOM 0 HG12 VAL A 140 5.327 0.772 3.275 1.00 1.00 H new ATOM 0 HG13 VAL A 140 6.251 -0.410 2.318 1.00 1.00 H new ATOM 0 HG21 VAL A 140 7.040 -2.171 4.746 1.00 1.00 H new ATOM 0 HG22 VAL A 140 8.205 -1.682 3.492 1.00 1.00 H new ATOM 0 HG23 VAL A 140 8.533 -1.315 5.203 1.00 1.00 H new ATOM 982 N GLU A 141 9.805 0.149 2.541 1.00 1.00 N ATOM 983 CA GLU A 141 10.524 -0.161 1.318 1.00 1.00 C ATOM 984 C GLU A 141 10.196 -1.583 0.855 1.00 1.00 C ATOM 985 O GLU A 141 9.601 -2.359 1.599 1.00 1.00 O ATOM 986 CB GLU A 141 12.031 0.020 1.507 1.00 1.00 C ATOM 987 CG GLU A 141 12.632 0.848 0.369 1.00 1.00 C ATOM 988 CD GLU A 141 13.145 2.194 0.881 1.00 1.00 C ATOM 989 OE1 GLU A 141 12.753 2.633 1.972 1.00 1.00 O ATOM 990 OE2 GLU A 141 13.982 2.791 0.102 1.00 1.00 O ATOM 0 H GLU A 141 10.267 -0.157 3.397 1.00 1.00 H new ATOM 0 HA GLU A 141 10.202 0.536 0.544 1.00 1.00 H new ATOM 0 HB2 GLU A 141 12.225 0.511 2.460 1.00 1.00 H new ATOM 0 HB3 GLU A 141 12.516 -0.955 1.547 1.00 1.00 H new ATOM 0 HG2 GLU A 141 13.450 0.296 -0.094 1.00 1.00 H new ATOM 0 HG3 GLU A 141 11.880 1.011 -0.403 1.00 1.00 H new ATOM 996 N SER A 142 10.599 -1.879 -0.372 1.00 1.00 N ATOM 997 CA SER A 142 10.356 -3.193 -0.942 1.00 1.00 C ATOM 998 C SER A 142 11.341 -4.207 -0.358 1.00 1.00 C ATOM 999 O SER A 142 12.427 -4.407 -0.901 1.00 1.00 O ATOM 1000 CB SER A 142 10.470 -3.161 -2.467 1.00 1.00 C ATOM 1001 OG SER A 142 11.819 -3.005 -2.900 1.00 1.00 O ATOM 0 H SER A 142 11.092 -1.232 -0.987 1.00 1.00 H new ATOM 0 HA SER A 142 9.340 -3.494 -0.686 1.00 1.00 H new ATOM 0 HB2 SER A 142 10.061 -4.083 -2.880 1.00 1.00 H new ATOM 0 HB3 SER A 142 9.867 -2.342 -2.858 1.00 1.00 H new ATOM 0 HG SER A 142 12.361 -3.744 -2.553 1.00 1.00 H new ATOM 1006 N GLY A 143 10.927 -4.821 0.741 1.00 1.00 N ATOM 1007 CA GLY A 143 11.759 -5.811 1.405 1.00 1.00 C ATOM 1008 C GLY A 143 11.931 -5.476 2.887 1.00 1.00 C ATOM 1009 O GLY A 143 12.521 -6.251 3.638 1.00 1.00 O ATOM 0 H GLY A 143 10.026 -4.652 1.188 1.00 1.00 H new ATOM 0 HA2 GLY A 143 11.309 -6.798 1.301 1.00 1.00 H new ATOM 0 HA3 GLY A 143 12.735 -5.854 0.922 1.00 1.00 H new ATOM 1013 N GLN A 144 11.405 -4.319 3.265 1.00 1.00 N ATOM 1014 CA GLN A 144 11.493 -3.872 4.645 1.00 1.00 C ATOM 1015 C GLN A 144 10.439 -4.579 5.500 1.00 1.00 C ATOM 1016 O GLN A 144 9.373 -4.939 5.005 1.00 1.00 O ATOM 1017 CB GLN A 144 11.347 -2.353 4.739 1.00 1.00 C ATOM 1018 CG GLN A 144 12.708 -1.663 4.628 1.00 1.00 C ATOM 1019 CD GLN A 144 12.802 -0.477 5.590 1.00 1.00 C ATOM 1020 OE1 GLN A 144 12.066 -0.369 6.556 1.00 1.00 O ATOM 1021 NE2 GLN A 144 13.748 0.404 5.271 1.00 1.00 N ATOM 0 H GLN A 144 10.917 -3.678 2.639 1.00 1.00 H new ATOM 0 HA GLN A 144 12.479 -4.133 5.029 1.00 1.00 H new ATOM 0 HB2 GLN A 144 10.689 -1.998 3.946 1.00 1.00 H new ATOM 0 HB3 GLN A 144 10.877 -2.087 5.686 1.00 1.00 H new ATOM 0 HG2 GLN A 144 13.501 -2.378 4.848 1.00 1.00 H new ATOM 0 HG3 GLN A 144 12.863 -1.319 3.605 1.00 1.00 H new ATOM 0 HE21 GLN A 144 14.330 0.252 4.447 1.00 1.00 H new ATOM 0 HE22 GLN A 144 13.891 1.231 5.851 1.00 1.00 H new ATOM 1028 N PRO A 145 10.784 -4.762 6.804 1.00 1.00 N ATOM 1029 CA PRO A 145 9.880 -5.418 7.732 1.00 1.00 C ATOM 1030 C PRO A 145 8.732 -4.489 8.130 1.00 1.00 C ATOM 1031 O PRO A 145 8.828 -3.273 7.967 1.00 1.00 O ATOM 1032 CB PRO A 145 10.752 -5.823 8.909 1.00 1.00 C ATOM 1033 CG PRO A 145 12.009 -4.974 8.809 1.00 1.00 C ATOM 1034 CD PRO A 145 12.039 -4.349 7.425 1.00 1.00 C ATOM 0 HA PRO A 145 9.390 -6.289 7.297 1.00 1.00 H new ATOM 0 HB2 PRO A 145 10.238 -5.649 9.854 1.00 1.00 H new ATOM 0 HB3 PRO A 145 10.994 -6.885 8.868 1.00 1.00 H new ATOM 0 HG2 PRO A 145 12.010 -4.201 9.577 1.00 1.00 H new ATOM 0 HG3 PRO A 145 12.897 -5.585 8.971 1.00 1.00 H new ATOM 0 HD2 PRO A 145 12.114 -3.263 7.483 1.00 1.00 H new ATOM 0 HD3 PRO A 145 12.898 -4.698 6.852 1.00 1.00 H new ATOM 1039 N VAL A 146 7.672 -5.095 8.643 1.00 1.00 N ATOM 1040 CA VAL A 146 6.507 -4.337 9.066 1.00 1.00 C ATOM 1041 C VAL A 146 5.957 -4.936 10.363 1.00 1.00 C ATOM 1042 O VAL A 146 6.202 -6.102 10.664 1.00 1.00 O ATOM 1043 CB VAL A 146 5.472 -4.298 7.940 1.00 1.00 C ATOM 1044 CG1 VAL A 146 6.099 -3.801 6.635 1.00 1.00 C ATOM 1045 CG2 VAL A 146 4.820 -5.668 7.747 1.00 1.00 C ATOM 0 H VAL A 146 7.595 -6.103 8.775 1.00 1.00 H new ATOM 0 HA VAL A 146 6.780 -3.303 9.276 1.00 1.00 H new ATOM 0 HB VAL A 146 4.692 -3.593 8.227 1.00 1.00 H new ATOM 0 HG11 VAL A 146 5.342 -3.783 5.851 1.00 1.00 H new ATOM 0 HG12 VAL A 146 6.494 -2.796 6.781 1.00 1.00 H new ATOM 0 HG13 VAL A 146 6.908 -4.470 6.342 1.00 1.00 H new ATOM 0 HG21 VAL A 146 4.088 -5.612 6.941 1.00 1.00 H new ATOM 0 HG22 VAL A 146 5.585 -6.402 7.493 1.00 1.00 H new ATOM 0 HG23 VAL A 146 4.322 -5.967 8.669 1.00 1.00 H new ATOM 1055 N GLU A 147 5.226 -4.108 11.094 1.00 1.00 N ATOM 1056 CA GLU A 147 4.640 -4.540 12.352 1.00 1.00 C ATOM 1057 C GLU A 147 3.170 -4.121 12.424 1.00 1.00 C ATOM 1058 O GLU A 147 2.763 -3.158 11.777 1.00 1.00 O ATOM 1059 CB GLU A 147 5.427 -3.988 13.542 1.00 1.00 C ATOM 1060 CG GLU A 147 6.023 -5.122 14.379 1.00 1.00 C ATOM 1061 CD GLU A 147 6.794 -4.570 15.579 1.00 1.00 C ATOM 1062 OE1 GLU A 147 6.193 -3.957 16.473 1.00 1.00 O ATOM 1063 OE2 GLU A 147 8.063 -4.798 15.562 1.00 1.00 O ATOM 0 H GLU A 147 5.026 -3.141 10.840 1.00 1.00 H new ATOM 0 HA GLU A 147 4.690 -5.628 12.399 1.00 1.00 H new ATOM 0 HB2 GLU A 147 6.225 -3.337 13.184 1.00 1.00 H new ATOM 0 HB3 GLU A 147 4.772 -3.378 14.164 1.00 1.00 H new ATOM 0 HG2 GLU A 147 5.227 -5.780 14.726 1.00 1.00 H new ATOM 0 HG3 GLU A 147 6.688 -5.725 13.761 1.00 1.00 H new ATOM 1069 N PHE A 148 2.413 -4.866 13.217 1.00 1.00 N ATOM 1070 CA PHE A 148 0.998 -4.584 13.382 1.00 1.00 C ATOM 1071 C PHE A 148 0.783 -3.203 14.004 1.00 1.00 C ATOM 1072 O PHE A 148 1.457 -2.840 14.966 1.00 1.00 O ATOM 1073 CB PHE A 148 0.437 -5.648 14.328 1.00 1.00 C ATOM 1074 CG PHE A 148 -1.002 -5.387 14.776 1.00 1.00 C ATOM 1075 CD1 PHE A 148 -1.251 -4.496 15.774 1.00 1.00 C ATOM 1076 CD2 PHE A 148 -2.031 -6.043 14.177 1.00 1.00 C ATOM 1077 CE1 PHE A 148 -2.587 -4.253 16.191 1.00 1.00 C ATOM 1078 CE2 PHE A 148 -3.367 -5.799 14.594 1.00 1.00 C ATOM 1079 CZ PHE A 148 -3.616 -4.909 15.592 1.00 1.00 C ATOM 0 H PHE A 148 2.754 -5.665 13.752 1.00 1.00 H new ATOM 0 HA PHE A 148 0.501 -4.598 12.412 1.00 1.00 H new ATOM 0 HB2 PHE A 148 0.482 -6.619 13.834 1.00 1.00 H new ATOM 0 HB3 PHE A 148 1.076 -5.709 15.209 1.00 1.00 H new ATOM 0 HD1 PHE A 148 -0.433 -3.974 16.249 1.00 1.00 H new ATOM 0 HD2 PHE A 148 -1.833 -6.749 13.384 1.00 1.00 H new ATOM 0 HE1 PHE A 148 -2.785 -3.547 16.984 1.00 1.00 H new ATOM 0 HE2 PHE A 148 -4.185 -6.320 14.119 1.00 1.00 H new ATOM 0 HZ PHE A 148 -4.632 -4.723 15.909 1.00 1.00 H new ATOM 1088 N ASP A 149 -0.159 -2.470 13.428 1.00 1.00 N ATOM 1089 CA ASP A 149 -0.472 -1.137 13.914 1.00 1.00 C ATOM 1090 C ASP A 149 0.516 -0.136 13.313 1.00 1.00 C ATOM 1091 O ASP A 149 0.380 1.071 13.509 1.00 1.00 O ATOM 1092 CB ASP A 149 -0.352 -1.064 15.438 1.00 1.00 C ATOM 1093 CG ASP A 149 -1.182 0.037 16.099 1.00 1.00 C ATOM 1094 OD1 ASP A 149 -0.683 1.141 16.367 1.00 1.00 O ATOM 1095 OD2 ASP A 149 -2.409 -0.277 16.344 1.00 1.00 O ATOM 0 H ASP A 149 -0.716 -2.774 12.629 1.00 1.00 H new ATOM 0 HA ASP A 149 -1.496 -0.903 13.622 1.00 1.00 H new ATOM 0 HB2 ASP A 149 -0.651 -2.025 15.857 1.00 1.00 H new ATOM 0 HB3 ASP A 149 0.696 -0.914 15.698 1.00 1.00 H new ATOM 1100 N GLU A 150 1.491 -0.673 12.593 1.00 1.00 N ATOM 1101 CA GLU A 150 2.502 0.158 11.963 1.00 1.00 C ATOM 1102 C GLU A 150 2.045 0.580 10.564 1.00 1.00 C ATOM 1103 O GLU A 150 1.304 -0.146 9.904 1.00 1.00 O ATOM 1104 CB GLU A 150 3.848 -0.565 11.905 1.00 1.00 C ATOM 1105 CG GLU A 150 4.196 -1.183 13.261 1.00 1.00 C ATOM 1106 CD GLU A 150 4.144 -0.133 14.372 1.00 1.00 C ATOM 1107 OE1 GLU A 150 3.084 0.075 14.980 1.00 1.00 O ATOM 1108 OE2 GLU A 150 5.258 0.478 14.597 1.00 1.00 O ATOM 0 H GLU A 150 1.602 -1.674 12.432 1.00 1.00 H new ATOM 0 HA GLU A 150 2.635 1.055 12.567 1.00 1.00 H new ATOM 0 HB2 GLU A 150 3.814 -1.344 11.144 1.00 1.00 H new ATOM 0 HB3 GLU A 150 4.629 0.135 11.609 1.00 1.00 H new ATOM 0 HG2 GLU A 150 3.499 -1.990 13.486 1.00 1.00 H new ATOM 0 HG3 GLU A 150 5.192 -1.624 13.219 1.00 1.00 H new ATOM 1114 N PRO A 151 2.520 1.782 10.143 1.00 1.00 N ATOM 1115 CA PRO A 151 2.169 2.310 8.835 1.00 1.00 C ATOM 1116 C PRO A 151 2.933 1.581 7.728 1.00 1.00 C ATOM 1117 O PRO A 151 4.008 1.031 7.968 1.00 1.00 O ATOM 1118 CB PRO A 151 2.496 3.792 8.907 1.00 1.00 C ATOM 1119 CG PRO A 151 3.446 3.953 10.083 1.00 1.00 C ATOM 1120 CD PRO A 151 3.399 2.670 10.898 1.00 1.00 C ATOM 0 HA PRO A 151 1.118 2.161 8.589 1.00 1.00 H new ATOM 0 HB2 PRO A 151 2.958 4.135 7.982 1.00 1.00 H new ATOM 0 HB3 PRO A 151 1.593 4.385 9.051 1.00 1.00 H new ATOM 0 HG2 PRO A 151 4.460 4.145 9.732 1.00 1.00 H new ATOM 0 HG3 PRO A 151 3.154 4.806 10.696 1.00 1.00 H new ATOM 0 HD2 PRO A 151 4.393 2.238 11.014 1.00 1.00 H new ATOM 0 HD3 PRO A 151 3.012 2.852 11.900 1.00 1.00 H new ATOM 1125 N LEU A 152 2.350 1.602 6.538 1.00 1.00 N ATOM 1126 CA LEU A 152 2.963 0.950 5.393 1.00 1.00 C ATOM 1127 C LEU A 152 3.124 1.965 4.261 1.00 1.00 C ATOM 1128 O LEU A 152 4.202 2.527 4.074 1.00 1.00 O ATOM 1129 CB LEU A 152 2.167 -0.295 4.995 1.00 1.00 C ATOM 1130 CG LEU A 152 2.107 -1.414 6.037 1.00 1.00 C ATOM 1131 CD1 LEU A 152 1.341 -2.624 5.498 1.00 1.00 C ATOM 1132 CD2 LEU A 152 3.509 -1.791 6.517 1.00 1.00 C ATOM 0 H LEU A 152 1.460 2.060 6.342 1.00 1.00 H new ATOM 0 HA LEU A 152 3.961 0.593 5.647 1.00 1.00 H new ATOM 0 HB2 LEU A 152 1.147 0.010 4.759 1.00 1.00 H new ATOM 0 HB3 LEU A 152 2.598 -0.701 4.080 1.00 1.00 H new ATOM 0 HG LEU A 152 1.558 -1.045 6.904 1.00 1.00 H new ATOM 0 HD11 LEU A 152 1.313 -3.405 6.258 1.00 1.00 H new ATOM 0 HD12 LEU A 152 0.323 -2.327 5.245 1.00 1.00 H new ATOM 0 HD13 LEU A 152 1.840 -3.003 4.606 1.00 1.00 H new ATOM 0 HD21 LEU A 152 3.438 -2.588 7.257 1.00 1.00 H new ATOM 0 HD22 LEU A 152 4.104 -2.134 5.670 1.00 1.00 H new ATOM 0 HD23 LEU A 152 3.986 -0.920 6.967 1.00 1.00 H new ATOM 1143 N VAL A 153 2.035 2.169 3.532 1.00 1.00 N ATOM 1144 CA VAL A 153 2.043 3.107 2.422 1.00 1.00 C ATOM 1145 C VAL A 153 0.947 4.153 2.638 1.00 1.00 C ATOM 1146 O VAL A 153 -0.059 3.879 3.290 1.00 1.00 O ATOM 1147 CB VAL A 153 1.898 2.353 1.100 1.00 1.00 C ATOM 1148 CG1 VAL A 153 1.774 3.326 -0.076 1.00 1.00 C ATOM 1149 CG2 VAL A 153 3.062 1.384 0.889 1.00 1.00 C ATOM 0 H VAL A 153 1.142 1.701 3.689 1.00 1.00 H new ATOM 0 HA VAL A 153 2.994 3.637 2.375 1.00 1.00 H new ATOM 0 HB VAL A 153 0.980 1.767 1.149 1.00 1.00 H new ATOM 0 HG11 VAL A 153 1.672 2.764 -1.004 1.00 1.00 H new ATOM 0 HG12 VAL A 153 0.896 3.957 0.065 1.00 1.00 H new ATOM 0 HG13 VAL A 153 2.665 3.951 -0.127 1.00 1.00 H new ATOM 0 HG21 VAL A 153 2.933 0.861 -0.059 1.00 1.00 H new ATOM 0 HG22 VAL A 153 4.000 1.940 0.872 1.00 1.00 H new ATOM 0 HG23 VAL A 153 3.084 0.659 1.703 1.00 1.00 H new ATOM 1159 N VAL A 154 1.181 5.331 2.078 1.00 1.00 N ATOM 1160 CA VAL A 154 0.227 6.420 2.200 1.00 1.00 C ATOM 1161 C VAL A 154 -0.366 6.731 0.825 1.00 1.00 C ATOM 1162 O VAL A 154 0.362 7.073 -0.107 1.00 1.00 O ATOM 1163 CB VAL A 154 0.898 7.633 2.849 1.00 1.00 C ATOM 1164 CG1 VAL A 154 -0.126 8.729 3.150 1.00 1.00 C ATOM 1165 CG2 VAL A 154 1.655 7.228 4.115 1.00 1.00 C ATOM 0 H VAL A 154 2.017 5.555 1.539 1.00 1.00 H new ATOM 0 HA VAL A 154 -0.598 6.133 2.852 1.00 1.00 H new ATOM 0 HB VAL A 154 1.622 8.035 2.140 1.00 1.00 H new ATOM 0 HG11 VAL A 154 0.376 9.580 3.611 1.00 1.00 H new ATOM 0 HG12 VAL A 154 -0.602 9.047 2.222 1.00 1.00 H new ATOM 0 HG13 VAL A 154 -0.883 8.342 3.832 1.00 1.00 H new ATOM 0 HG21 VAL A 154 2.123 8.108 4.557 1.00 1.00 H new ATOM 0 HG22 VAL A 154 0.959 6.789 4.830 1.00 1.00 H new ATOM 0 HG23 VAL A 154 2.423 6.498 3.862 1.00 1.00 H new ATOM 1175 N ILE A 155 -1.682 6.600 0.739 1.00 1.00 N ATOM 1176 CA ILE A 155 -2.381 6.861 -0.507 1.00 1.00 C ATOM 1177 C ILE A 155 -3.252 8.108 -0.346 1.00 1.00 C ATOM 1178 O ILE A 155 -3.524 8.539 0.774 1.00 1.00 O ATOM 1179 CB ILE A 155 -3.157 5.622 -0.957 1.00 1.00 C ATOM 1180 CG1 ILE A 155 -2.217 4.570 -1.548 1.00 1.00 C ATOM 1181 CG2 ILE A 155 -4.278 6.000 -1.927 1.00 1.00 C ATOM 1182 CD1 ILE A 155 -1.856 3.509 -0.507 1.00 1.00 C ATOM 0 H ILE A 155 -2.283 6.316 1.513 1.00 1.00 H new ATOM 0 HA ILE A 155 -1.670 7.069 -1.306 1.00 1.00 H new ATOM 0 HB ILE A 155 -3.627 5.176 -0.080 1.00 1.00 H new ATOM 0 HG12 ILE A 155 -2.691 4.095 -2.407 1.00 1.00 H new ATOM 0 HG13 ILE A 155 -1.309 5.052 -1.911 1.00 1.00 H new ATOM 0 HG21 ILE A 155 -4.814 5.101 -2.232 1.00 1.00 H new ATOM 0 HG22 ILE A 155 -4.969 6.685 -1.436 1.00 1.00 H new ATOM 0 HG23 ILE A 155 -3.851 6.483 -2.806 1.00 1.00 H new ATOM 0 HD11 ILE A 155 -1.187 2.774 -0.954 1.00 1.00 H new ATOM 0 HD12 ILE A 155 -1.360 3.984 0.340 1.00 1.00 H new ATOM 0 HD13 ILE A 155 -2.764 3.012 -0.164 1.00 1.00 H new ATOM 1193 N GLU A 156 -3.665 8.654 -1.481 1.00 1.00 N ATOM 1194 CA GLU A 156 -4.501 9.842 -1.479 1.00 1.00 C ATOM 1195 C GLU A 156 -5.962 9.464 -1.728 1.00 1.00 C ATOM 1196 O GLU A 156 -6.498 9.716 -2.807 1.00 1.00 O ATOM 1197 CB GLU A 156 -4.012 10.856 -2.516 1.00 1.00 C ATOM 1198 CG GLU A 156 -4.730 12.198 -2.351 1.00 1.00 C ATOM 1199 CD GLU A 156 -3.746 13.364 -2.464 1.00 1.00 C ATOM 1200 OE1 GLU A 156 -2.680 13.217 -3.081 1.00 1.00 O ATOM 1201 OE2 GLU A 156 -4.122 14.452 -1.883 1.00 1.00 O ATOM 0 H GLU A 156 -3.436 8.295 -2.408 1.00 1.00 H new ATOM 0 HA GLU A 156 -4.431 10.311 -0.498 1.00 1.00 H new ATOM 0 HB2 GLU A 156 -2.937 10.999 -2.411 1.00 1.00 H new ATOM 0 HB3 GLU A 156 -4.185 10.468 -3.520 1.00 1.00 H new ATOM 0 HG2 GLU A 156 -5.504 12.296 -3.112 1.00 1.00 H new ATOM 0 HG3 GLU A 156 -5.229 12.231 -1.382 1.00 1.00 H new