USER MOD reduce.3.24.130724 H: found=0, std=0, add=996, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 996 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 135 THR OG1 : rot 180:sc= -0.0422 USER MOD Set 1.2: A 136 ASN : amide:sc= -2.13! C(o=-2.2!,f=-2.7!) USER MOD Set 2.1: A 12 MET CE :methyl -160:sc= -0.82 (180deg=-2.43!) USER MOD Set 2.2: A 34 THR OG1 : rot 180:sc= -1.48! USER MOD Single : A 10 THR OG1 : rot 141:sc= -3.99! USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 ASN : amide:sc= -0.478 K(o=-0.48,f=-4.2!) USER MOD Single : A 22 SER OG : rot -80:sc= 0.593 USER MOD Single : A 23 MET CE :methyl -124:sc= -0.345 (180deg=-1.41) USER MOD Single : A 29 GLN : amide:sc= -0.0159 K(o=-0.016,f=-1.5!) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 ASN :FLIP amide:sc= -0.693 F(o=-2.8!,f=-0.69) USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot 85:sc= -0.133 USER MOD Single : A 49 THR OG1 : rot 180:sc= -1.37! USER MOD Single : A 50 ASN : amide:sc= -0.353 K(o=-0.35,f=-2.8!) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 ASN : amide:sc= -0.102 K(o=-0.1,f=-1.4!) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 78 HIS : no HE2:sc= -3.05! C(o=-3.1!,f=-5.4!) USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 SER OG : rot -99:sc= 1.2 USER MOD Single : A 99 GLN : amide:sc= 0.991 K(o=0.99,f=-2!) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 ASN : amide:sc= 0 X(o=0,f=-0.0012) USER MOD Single : A 110 ASN : amide:sc= -0.24 K(o=-0.24,f=-1.7!) USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 115 ASN : amide:sc= -6.69! C(o=-6.7!,f=-8!) USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 MET CE :methyl 169:sc= 0 (180deg=-0.24) USER MOD Single : A 127 THR OG1 : rot 180:sc= 0 USER MOD Single : A 128 ASN :FLIP amide:sc= -2.12! C(o=-3.1!,f=-2.1!) USER MOD Single : A 132 HIS : no HD1:sc= -1.97! C(o=-2!,f=-7!) USER MOD Single : A 139 GLN : amide:sc= 0 K(o=0,f=-0.86) USER MOD ----------------------------------------------------------------- ATOM 90 N THR A 10 -8.184 8.758 1.322 1.00 0.00 N ATOM 91 CA THR A 10 -7.437 7.943 2.263 1.00 0.00 C ATOM 92 C THR A 10 -6.717 6.808 1.532 1.00 0.00 C ATOM 93 O THR A 10 -7.166 6.361 0.478 1.00 0.00 O ATOM 94 CB THR A 10 -8.408 7.452 3.339 1.00 0.00 C ATOM 95 OG1 THR A 10 -9.556 7.034 2.606 1.00 0.00 O ATOM 96 CG2 THR A 10 -8.924 8.589 4.224 1.00 0.00 C ATOM 0 HA THR A 10 -6.653 8.522 2.751 1.00 0.00 H new ATOM 0 HB THR A 10 -7.914 6.704 3.960 1.00 0.00 H new ATOM 0 HG1 THR A 10 -9.922 6.219 3.008 1.00 0.00 H new ATOM 0 HG21 THR A 10 -9.609 8.187 4.970 1.00 0.00 H new ATOM 0 HG22 THR A 10 -8.084 9.071 4.724 1.00 0.00 H new ATOM 0 HG23 THR A 10 -9.447 9.321 3.608 1.00 0.00 H new ATOM 104 N VAL A 11 -5.612 6.375 2.120 1.00 0.00 N ATOM 105 CA VAL A 11 -4.825 5.301 1.538 1.00 0.00 C ATOM 106 C VAL A 11 -5.766 4.248 0.948 1.00 0.00 C ATOM 107 O VAL A 11 -5.661 3.907 -0.229 1.00 0.00 O ATOM 108 CB VAL A 11 -3.866 4.728 2.583 1.00 0.00 C ATOM 109 CG1 VAL A 11 -4.452 4.852 3.991 1.00 0.00 C ATOM 110 CG2 VAL A 11 -3.511 3.274 2.264 1.00 0.00 C ATOM 0 H VAL A 11 -5.243 6.749 2.994 1.00 0.00 H new ATOM 0 HA VAL A 11 -4.207 5.679 0.723 1.00 0.00 H new ATOM 0 HB VAL A 11 -2.947 5.312 2.549 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -3.750 4.437 4.715 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -4.631 5.903 4.220 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -5.393 4.304 4.043 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -2.828 2.891 3.023 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -4.419 2.671 2.256 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -3.033 3.222 1.286 1.00 0.00 H new ATOM 120 N MET A 12 -6.663 3.762 1.794 1.00 0.00 N ATOM 121 CA MET A 12 -7.621 2.755 1.372 1.00 0.00 C ATOM 122 C MET A 12 -8.526 3.291 0.261 1.00 0.00 C ATOM 123 O MET A 12 -8.772 2.604 -0.730 1.00 0.00 O ATOM 124 CB MET A 12 -8.476 2.330 2.567 1.00 0.00 C ATOM 125 CG MET A 12 -7.892 1.090 3.246 1.00 0.00 C ATOM 126 SD MET A 12 -7.857 -0.276 2.097 1.00 0.00 S ATOM 127 CE MET A 12 -9.482 -0.115 1.375 1.00 0.00 C ATOM 0 H MET A 12 -6.746 4.047 2.770 1.00 0.00 H new ATOM 0 HA MET A 12 -7.071 1.897 0.985 1.00 0.00 H new ATOM 0 HB2 MET A 12 -8.536 3.148 3.285 1.00 0.00 H new ATOM 0 HB3 MET A 12 -9.493 2.122 2.235 1.00 0.00 H new ATOM 0 HG2 MET A 12 -6.884 1.302 3.603 1.00 0.00 H new ATOM 0 HG3 MET A 12 -8.490 0.827 4.118 1.00 0.00 H new ATOM 0 HE1 MET A 12 -9.770 -1.059 0.914 1.00 0.00 H new ATOM 0 HE2 MET A 12 -10.201 0.144 2.152 1.00 0.00 H new ATOM 0 HE3 MET A 12 -9.468 0.669 0.618 1.00 0.00 H new ATOM 137 N ASP A 13 -8.997 4.512 0.463 1.00 0.00 N ATOM 138 CA ASP A 13 -9.870 5.148 -0.510 1.00 0.00 C ATOM 139 C ASP A 13 -9.151 5.229 -1.858 1.00 0.00 C ATOM 140 O ASP A 13 -9.763 5.024 -2.905 1.00 0.00 O ATOM 141 CB ASP A 13 -10.228 6.572 -0.079 1.00 0.00 C ATOM 142 CG ASP A 13 -11.443 6.681 0.845 1.00 0.00 C ATOM 143 OD1 ASP A 13 -11.670 5.712 1.601 1.00 0.00 O ATOM 144 OD2 ASP A 13 -12.117 7.732 0.774 1.00 0.00 O ATOM 0 H ASP A 13 -8.791 5.078 1.286 1.00 0.00 H new ATOM 0 HA ASP A 13 -10.781 4.554 -0.586 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -9.367 7.011 0.425 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -10.414 7.170 -0.971 1.00 0.00 H new ATOM 149 N VAL A 14 -7.862 5.528 -1.788 1.00 0.00 N ATOM 150 CA VAL A 14 -7.053 5.639 -2.990 1.00 0.00 C ATOM 151 C VAL A 14 -7.149 4.336 -3.786 1.00 0.00 C ATOM 152 O VAL A 14 -7.024 4.341 -5.009 1.00 0.00 O ATOM 153 CB VAL A 14 -5.615 6.009 -2.621 1.00 0.00 C ATOM 154 CG1 VAL A 14 -4.640 5.583 -3.720 1.00 0.00 C ATOM 155 CG2 VAL A 14 -5.492 7.506 -2.330 1.00 0.00 C ATOM 0 H VAL A 14 -7.358 5.697 -0.918 1.00 0.00 H new ATOM 0 HA VAL A 14 -7.427 6.439 -3.629 1.00 0.00 H new ATOM 0 HB VAL A 14 -5.353 5.468 -1.712 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -3.625 5.858 -3.433 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -4.698 4.504 -3.859 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -4.901 6.084 -4.652 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -4.460 7.743 -2.070 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -5.783 8.074 -3.214 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -6.145 7.770 -1.498 1.00 0.00 H new ATOM 165 N LEU A 15 -7.371 3.250 -3.058 1.00 0.00 N ATOM 166 CA LEU A 15 -7.485 1.943 -3.681 1.00 0.00 C ATOM 167 C LEU A 15 -8.926 1.729 -4.148 1.00 0.00 C ATOM 168 O LEU A 15 -9.159 1.187 -5.227 1.00 0.00 O ATOM 169 CB LEU A 15 -6.978 0.853 -2.735 1.00 0.00 C ATOM 170 CG LEU A 15 -5.645 1.136 -2.039 1.00 0.00 C ATOM 171 CD1 LEU A 15 -5.512 0.314 -0.755 1.00 0.00 C ATOM 172 CD2 LEU A 15 -4.469 0.907 -2.991 1.00 0.00 C ATOM 0 H LEU A 15 -7.475 3.250 -2.043 1.00 0.00 H new ATOM 0 HA LEU A 15 -6.851 1.886 -4.566 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -7.736 0.682 -1.970 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -6.881 -0.074 -3.300 1.00 0.00 H new ATOM 0 HG LEU A 15 -5.626 2.187 -1.752 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -4.556 0.534 -0.280 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -6.323 0.570 -0.074 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -5.562 -0.748 -0.996 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -3.534 1.115 -2.471 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -4.472 -0.129 -3.331 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -4.562 1.571 -3.850 1.00 0.00 H new ATOM 184 N LYS A 16 -9.857 2.168 -3.312 1.00 0.00 N ATOM 185 CA LYS A 16 -11.269 2.031 -3.626 1.00 0.00 C ATOM 186 C LYS A 16 -11.578 2.803 -4.911 1.00 0.00 C ATOM 187 O LYS A 16 -12.275 2.298 -5.790 1.00 0.00 O ATOM 188 CB LYS A 16 -12.126 2.456 -2.432 1.00 0.00 C ATOM 189 CG LYS A 16 -12.114 1.384 -1.340 1.00 0.00 C ATOM 190 CD LYS A 16 -12.747 1.909 -0.050 1.00 0.00 C ATOM 191 CE LYS A 16 -13.957 1.062 0.351 1.00 0.00 C ATOM 192 NZ LYS A 16 -14.774 1.770 1.361 1.00 0.00 N ATOM 0 H LYS A 16 -9.660 2.618 -2.418 1.00 0.00 H new ATOM 0 HA LYS A 16 -11.519 0.987 -3.813 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -11.752 3.397 -2.028 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -13.150 2.635 -2.760 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -12.657 0.504 -1.684 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -11.089 1.070 -1.145 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -12.009 1.898 0.752 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -13.054 2.946 -0.187 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -14.563 0.845 -0.528 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -13.622 0.105 0.752 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -15.591 1.181 1.622 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -14.197 1.956 2.206 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -15.109 2.672 0.966 1.00 0.00 H new ATOM 206 N GLY A 17 -11.045 4.014 -4.979 1.00 0.00 N ATOM 207 CA GLY A 17 -11.255 4.860 -6.141 1.00 0.00 C ATOM 208 C GLY A 17 -10.741 4.183 -7.413 1.00 0.00 C ATOM 209 O GLY A 17 -11.470 4.066 -8.396 1.00 0.00 O ATOM 0 H GLY A 17 -10.468 4.429 -4.248 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -12.317 5.082 -6.247 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -10.743 5.812 -5.999 1.00 0.00 H new ATOM 213 N ASP A 18 -9.489 3.754 -7.352 1.00 0.00 N ATOM 214 CA ASP A 18 -8.869 3.091 -8.486 1.00 0.00 C ATOM 215 C ASP A 18 -9.481 1.699 -8.655 1.00 0.00 C ATOM 216 O ASP A 18 -9.461 0.891 -7.728 1.00 0.00 O ATOM 217 CB ASP A 18 -7.364 2.922 -8.270 1.00 0.00 C ATOM 218 CG ASP A 18 -6.480 3.794 -9.165 1.00 0.00 C ATOM 219 OD1 ASP A 18 -6.666 5.029 -9.114 1.00 0.00 O ATOM 220 OD2 ASP A 18 -5.640 3.206 -9.879 1.00 0.00 O ATOM 0 H ASP A 18 -8.887 3.853 -6.534 1.00 0.00 H new ATOM 0 HA ASP A 18 -9.040 3.705 -9.370 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -7.134 3.147 -7.228 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -7.104 1.877 -8.436 1.00 0.00 H new ATOM 225 N ASN A 19 -10.012 1.462 -9.846 1.00 0.00 N ATOM 226 CA ASN A 19 -10.629 0.182 -10.148 1.00 0.00 C ATOM 227 C ASN A 19 -9.549 -0.901 -10.202 1.00 0.00 C ATOM 228 O ASN A 19 -9.728 -1.989 -9.656 1.00 0.00 O ATOM 229 CB ASN A 19 -11.331 0.216 -11.507 1.00 0.00 C ATOM 230 CG ASN A 19 -12.409 1.302 -11.541 1.00 0.00 C ATOM 231 OD1 ASN A 19 -12.258 2.379 -10.988 1.00 0.00 O ATOM 232 ND2 ASN A 19 -13.501 0.960 -12.218 1.00 0.00 N ATOM 0 H ASN A 19 -10.027 2.135 -10.613 1.00 0.00 H new ATOM 0 HA ASN A 19 -11.360 -0.031 -9.369 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -10.599 0.400 -12.294 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -11.782 -0.755 -11.712 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -14.278 1.616 -12.298 1.00 0.00 H new ATOM 0 HD22 ASN A 19 -13.562 0.041 -12.657 1.00 0.00 H new ATOM 239 N ARG A 20 -8.451 -0.564 -10.864 1.00 0.00 N ATOM 240 CA ARG A 20 -7.342 -1.494 -10.995 1.00 0.00 C ATOM 241 C ARG A 20 -7.147 -2.274 -9.694 1.00 0.00 C ATOM 242 O ARG A 20 -6.915 -3.482 -9.719 1.00 0.00 O ATOM 243 CB ARG A 20 -6.046 -0.759 -11.340 1.00 0.00 C ATOM 244 CG ARG A 20 -6.283 0.290 -12.429 1.00 0.00 C ATOM 245 CD ARG A 20 -5.170 0.252 -13.478 1.00 0.00 C ATOM 246 NE ARG A 20 -5.369 -0.900 -14.386 1.00 0.00 N ATOM 247 CZ ARG A 20 -4.753 -1.039 -15.568 1.00 0.00 C ATOM 248 NH1 ARG A 20 -3.898 -0.100 -15.993 1.00 0.00 N ATOM 249 NH2 ARG A 20 -4.994 -2.118 -16.325 1.00 0.00 N ATOM 0 H ARG A 20 -8.306 0.339 -11.315 1.00 0.00 H new ATOM 0 HA ARG A 20 -7.582 -2.184 -11.804 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -5.648 -0.277 -10.447 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -5.296 -1.475 -11.677 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -7.246 0.111 -12.908 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -6.330 1.282 -11.979 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -5.166 1.180 -14.050 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -4.199 0.176 -12.988 1.00 0.00 H new ATOM 0 HE ARG A 20 -6.015 -1.633 -14.094 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -3.715 0.722 -15.417 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -3.429 -0.206 -16.893 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -5.646 -2.833 -16.001 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -4.526 -2.225 -17.225 1.00 0.00 H new ATOM 263 N PHE A 21 -7.248 -1.553 -8.587 1.00 0.00 N ATOM 264 CA PHE A 21 -7.085 -2.163 -7.279 1.00 0.00 C ATOM 265 C PHE A 21 -8.434 -2.318 -6.575 1.00 0.00 C ATOM 266 O PHE A 21 -8.594 -1.895 -5.431 1.00 0.00 O ATOM 267 CB PHE A 21 -6.199 -1.226 -6.455 1.00 0.00 C ATOM 268 CG PHE A 21 -5.096 -0.541 -7.266 1.00 0.00 C ATOM 269 CD1 PHE A 21 -4.250 -1.285 -8.027 1.00 0.00 C ATOM 270 CD2 PHE A 21 -4.962 0.812 -7.224 1.00 0.00 C ATOM 271 CE1 PHE A 21 -3.227 -0.649 -8.779 1.00 0.00 C ATOM 272 CE2 PHE A 21 -3.939 1.448 -7.976 1.00 0.00 C ATOM 273 CZ PHE A 21 -3.093 0.704 -8.738 1.00 0.00 C ATOM 0 H PHE A 21 -7.441 -0.552 -8.569 1.00 0.00 H new ATOM 0 HA PHE A 21 -6.643 -3.154 -7.383 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -6.825 -0.462 -5.994 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -5.741 -1.794 -5.645 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -4.356 -2.359 -8.060 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -5.634 1.403 -6.619 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -2.555 -1.240 -9.384 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -3.833 2.522 -7.943 1.00 0.00 H new ATOM 0 HZ PHE A 21 -2.315 1.187 -9.310 1.00 0.00 H new ATOM 283 N SER A 22 -9.371 -2.927 -7.287 1.00 0.00 N ATOM 284 CA SER A 22 -10.701 -3.143 -6.745 1.00 0.00 C ATOM 285 C SER A 22 -10.741 -4.461 -5.968 1.00 0.00 C ATOM 286 O SER A 22 -10.916 -4.462 -4.750 1.00 0.00 O ATOM 287 CB SER A 22 -11.754 -3.150 -7.855 1.00 0.00 C ATOM 288 OG SER A 22 -11.435 -4.079 -8.888 1.00 0.00 O ATOM 0 H SER A 22 -9.235 -3.278 -8.235 1.00 0.00 H new ATOM 0 HA SER A 22 -10.932 -2.321 -6.067 1.00 0.00 H new ATOM 0 HB2 SER A 22 -12.726 -3.400 -7.431 1.00 0.00 H new ATOM 0 HB3 SER A 22 -11.839 -2.150 -8.280 1.00 0.00 H new ATOM 0 HG SER A 22 -10.763 -3.687 -9.484 1.00 0.00 H new ATOM 294 N MET A 23 -10.577 -5.550 -6.703 1.00 0.00 N ATOM 295 CA MET A 23 -10.592 -6.871 -6.098 1.00 0.00 C ATOM 296 C MET A 23 -9.810 -6.881 -4.784 1.00 0.00 C ATOM 297 O MET A 23 -10.096 -7.679 -3.892 1.00 0.00 O ATOM 298 CB MET A 23 -9.977 -7.884 -7.066 1.00 0.00 C ATOM 299 CG MET A 23 -11.064 -8.700 -7.769 1.00 0.00 C ATOM 300 SD MET A 23 -11.021 -10.391 -7.200 1.00 0.00 S ATOM 301 CE MET A 23 -9.394 -10.866 -7.758 1.00 0.00 C ATOM 0 H MET A 23 -10.433 -5.545 -7.713 1.00 0.00 H new ATOM 0 HA MET A 23 -11.627 -7.140 -5.886 1.00 0.00 H new ATOM 0 HB2 MET A 23 -9.372 -7.363 -7.808 1.00 0.00 H new ATOM 0 HB3 MET A 23 -9.309 -8.553 -6.523 1.00 0.00 H new ATOM 0 HG2 MET A 23 -12.043 -8.265 -7.569 1.00 0.00 H new ATOM 0 HG3 MET A 23 -10.915 -8.667 -8.848 1.00 0.00 H new ATOM 0 HE1 MET A 23 -9.471 -11.747 -8.396 1.00 0.00 H new ATOM 0 HE2 MET A 23 -8.949 -10.047 -8.323 1.00 0.00 H new ATOM 0 HE3 MET A 23 -8.767 -11.095 -6.897 1.00 0.00 H new ATOM 311 N LEU A 24 -8.836 -5.985 -4.705 1.00 0.00 N ATOM 312 CA LEU A 24 -8.010 -5.881 -3.514 1.00 0.00 C ATOM 313 C LEU A 24 -8.858 -5.352 -2.355 1.00 0.00 C ATOM 314 O LEU A 24 -8.961 -5.996 -1.312 1.00 0.00 O ATOM 315 CB LEU A 24 -6.764 -5.039 -3.798 1.00 0.00 C ATOM 316 CG LEU A 24 -6.060 -4.450 -2.575 1.00 0.00 C ATOM 317 CD1 LEU A 24 -5.681 -5.547 -1.579 1.00 0.00 C ATOM 318 CD2 LEU A 24 -4.849 -3.611 -2.991 1.00 0.00 C ATOM 0 H LEU A 24 -8.601 -5.325 -5.446 1.00 0.00 H new ATOM 0 HA LEU A 24 -7.642 -6.864 -3.218 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -6.049 -5.656 -4.342 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -7.046 -4.220 -4.460 1.00 0.00 H new ATOM 0 HG LEU A 24 -6.757 -3.782 -2.069 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -5.182 -5.101 -0.719 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -6.581 -6.065 -1.248 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -5.009 -6.258 -2.059 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -4.366 -3.204 -2.103 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -4.141 -4.238 -3.534 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -5.176 -2.793 -3.633 1.00 0.00 H new ATOM 330 N VAL A 25 -9.443 -4.184 -2.577 1.00 0.00 N ATOM 331 CA VAL A 25 -10.279 -3.561 -1.564 1.00 0.00 C ATOM 332 C VAL A 25 -11.127 -4.635 -0.878 1.00 0.00 C ATOM 333 O VAL A 25 -11.085 -4.777 0.343 1.00 0.00 O ATOM 334 CB VAL A 25 -11.118 -2.446 -2.191 1.00 0.00 C ATOM 335 CG1 VAL A 25 -12.073 -1.835 -1.164 1.00 0.00 C ATOM 336 CG2 VAL A 25 -10.225 -1.373 -2.816 1.00 0.00 C ATOM 0 H VAL A 25 -9.355 -3.653 -3.443 1.00 0.00 H new ATOM 0 HA VAL A 25 -9.664 -3.093 -0.796 1.00 0.00 H new ATOM 0 HB VAL A 25 -11.719 -2.886 -2.987 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -12.658 -1.045 -1.636 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -12.744 -2.607 -0.787 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -11.499 -1.417 -0.337 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -10.847 -0.592 -3.255 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -9.586 -0.939 -2.047 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -9.605 -1.822 -3.592 1.00 0.00 H new ATOM 346 N ALA A 26 -11.876 -5.362 -1.694 1.00 0.00 N ATOM 347 CA ALA A 26 -12.733 -6.418 -1.181 1.00 0.00 C ATOM 348 C ALA A 26 -11.996 -7.174 -0.074 1.00 0.00 C ATOM 349 O ALA A 26 -12.491 -7.278 1.047 1.00 0.00 O ATOM 350 CB ALA A 26 -13.157 -7.334 -2.330 1.00 0.00 C ATOM 0 H ALA A 26 -11.907 -5.241 -2.706 1.00 0.00 H new ATOM 0 HA ALA A 26 -13.640 -5.999 -0.746 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -13.800 -8.126 -1.946 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -13.702 -6.754 -3.075 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -12.272 -7.775 -2.789 1.00 0.00 H new ATOM 356 N ALA A 27 -10.824 -7.681 -0.427 1.00 0.00 N ATOM 357 CA ALA A 27 -10.014 -8.425 0.523 1.00 0.00 C ATOM 358 C ALA A 27 -9.943 -7.651 1.841 1.00 0.00 C ATOM 359 O ALA A 27 -10.136 -8.224 2.912 1.00 0.00 O ATOM 360 CB ALA A 27 -8.630 -8.682 -0.077 1.00 0.00 C ATOM 0 H ALA A 27 -10.416 -7.591 -1.357 1.00 0.00 H new ATOM 0 HA ALA A 27 -10.463 -9.395 0.734 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -8.022 -9.240 0.635 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -8.733 -9.259 -0.996 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -8.147 -7.730 -0.299 1.00 0.00 H new ATOM 366 N ILE A 28 -9.666 -6.361 1.719 1.00 0.00 N ATOM 367 CA ILE A 28 -9.567 -5.504 2.888 1.00 0.00 C ATOM 368 C ILE A 28 -10.941 -5.395 3.553 1.00 0.00 C ATOM 369 O ILE A 28 -11.100 -5.751 4.719 1.00 0.00 O ATOM 370 CB ILE A 28 -8.958 -4.152 2.511 1.00 0.00 C ATOM 371 CG1 ILE A 28 -7.589 -4.333 1.850 1.00 0.00 C ATOM 372 CG2 ILE A 28 -8.890 -3.223 3.724 1.00 0.00 C ATOM 373 CD1 ILE A 28 -7.192 -3.084 1.060 1.00 0.00 C ATOM 0 H ILE A 28 -9.507 -5.889 0.829 1.00 0.00 H new ATOM 0 HA ILE A 28 -8.890 -5.939 3.623 1.00 0.00 H new ATOM 0 HB ILE A 28 -9.610 -3.676 1.778 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -6.838 -4.540 2.612 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -7.614 -5.196 1.185 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -8.453 -2.269 3.428 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -9.895 -3.057 4.112 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -8.273 -3.680 4.498 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -6.216 -3.239 0.601 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -7.933 -2.894 0.283 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -7.144 -2.228 1.733 1.00 0.00 H new ATOM 385 N GLN A 29 -11.898 -4.901 2.782 1.00 0.00 N ATOM 386 CA GLN A 29 -13.253 -4.740 3.282 1.00 0.00 C ATOM 387 C GLN A 29 -13.689 -5.992 4.046 1.00 0.00 C ATOM 388 O GLN A 29 -14.358 -5.895 5.074 1.00 0.00 O ATOM 389 CB GLN A 29 -14.225 -4.429 2.142 1.00 0.00 C ATOM 390 CG GLN A 29 -15.118 -3.238 2.493 1.00 0.00 C ATOM 391 CD GLN A 29 -16.284 -3.117 1.509 1.00 0.00 C ATOM 392 OE1 GLN A 29 -16.621 -4.044 0.790 1.00 0.00 O ATOM 393 NE2 GLN A 29 -16.878 -1.928 1.517 1.00 0.00 N ATOM 0 H GLN A 29 -11.762 -4.607 1.815 1.00 0.00 H new ATOM 0 HA GLN A 29 -13.267 -3.894 3.969 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -13.666 -4.213 1.231 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -14.843 -5.303 1.937 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -15.503 -3.354 3.506 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -14.529 -2.321 2.479 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -16.545 -1.196 2.144 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -17.667 -1.748 0.896 1.00 0.00 H new ATOM 402 N SER A 30 -13.291 -7.139 3.516 1.00 0.00 N ATOM 403 CA SER A 30 -13.631 -8.408 4.135 1.00 0.00 C ATOM 404 C SER A 30 -12.706 -8.676 5.324 1.00 0.00 C ATOM 405 O SER A 30 -13.161 -9.087 6.390 1.00 0.00 O ATOM 406 CB SER A 30 -13.544 -9.555 3.126 1.00 0.00 C ATOM 407 OG SER A 30 -14.660 -10.436 3.221 1.00 0.00 O ATOM 0 H SER A 30 -12.736 -7.216 2.664 1.00 0.00 H new ATOM 0 HA SER A 30 -14.660 -8.349 4.490 1.00 0.00 H new ATOM 0 HB2 SER A 30 -13.490 -9.147 2.117 1.00 0.00 H new ATOM 0 HB3 SER A 30 -12.624 -10.116 3.293 1.00 0.00 H new ATOM 0 HG SER A 30 -14.568 -11.153 2.560 1.00 0.00 H new ATOM 413 N ALA A 31 -11.423 -8.430 5.101 1.00 0.00 N ATOM 414 CA ALA A 31 -10.429 -8.639 6.140 1.00 0.00 C ATOM 415 C ALA A 31 -10.763 -7.756 7.344 1.00 0.00 C ATOM 416 O ALA A 31 -10.458 -8.109 8.482 1.00 0.00 O ATOM 417 CB ALA A 31 -9.035 -8.356 5.578 1.00 0.00 C ATOM 0 H ALA A 31 -11.049 -8.088 4.216 1.00 0.00 H new ATOM 0 HA ALA A 31 -10.439 -9.675 6.478 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -8.290 -8.513 6.358 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -8.835 -9.029 4.744 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -8.985 -7.324 5.231 1.00 0.00 H new ATOM 423 N GLY A 32 -11.386 -6.623 7.052 1.00 0.00 N ATOM 424 CA GLY A 32 -11.764 -5.686 8.096 1.00 0.00 C ATOM 425 C GLY A 32 -10.569 -4.835 8.529 1.00 0.00 C ATOM 426 O GLY A 32 -10.357 -4.616 9.721 1.00 0.00 O ATOM 0 H GLY A 32 -11.638 -6.333 6.107 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -12.564 -5.039 7.736 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -12.156 -6.231 8.954 1.00 0.00 H new ATOM 430 N LEU A 33 -9.818 -4.379 7.538 1.00 0.00 N ATOM 431 CA LEU A 33 -8.649 -3.557 7.801 1.00 0.00 C ATOM 432 C LEU A 33 -8.949 -2.110 7.406 1.00 0.00 C ATOM 433 O LEU A 33 -8.295 -1.184 7.884 1.00 0.00 O ATOM 434 CB LEU A 33 -7.416 -4.141 7.108 1.00 0.00 C ATOM 435 CG LEU A 33 -6.608 -5.156 7.919 1.00 0.00 C ATOM 436 CD1 LEU A 33 -5.881 -6.139 6.999 1.00 0.00 C ATOM 437 CD2 LEU A 33 -5.647 -4.452 8.879 1.00 0.00 C ATOM 0 H LEU A 33 -9.996 -4.563 6.551 1.00 0.00 H new ATOM 0 HA LEU A 33 -8.416 -3.555 8.866 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -7.736 -4.618 6.182 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -6.756 -3.319 6.831 1.00 0.00 H new ATOM 0 HG LEU A 33 -7.302 -5.736 8.527 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -5.314 -6.849 7.601 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -6.610 -6.677 6.393 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -5.200 -5.592 6.347 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -5.085 -5.197 9.443 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -4.956 -3.830 8.311 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -6.214 -3.827 9.569 1.00 0.00 H new ATOM 449 N THR A 34 -9.938 -1.960 6.538 1.00 0.00 N ATOM 450 CA THR A 34 -10.333 -0.641 6.074 1.00 0.00 C ATOM 451 C THR A 34 -10.440 0.329 7.252 1.00 0.00 C ATOM 452 O THR A 34 -9.795 1.377 7.259 1.00 0.00 O ATOM 453 CB THR A 34 -11.636 -0.787 5.286 1.00 0.00 C ATOM 454 OG1 THR A 34 -11.232 -1.368 4.050 1.00 0.00 O ATOM 455 CG2 THR A 34 -12.233 0.563 4.886 1.00 0.00 C ATOM 0 H THR A 34 -10.478 -2.730 6.144 1.00 0.00 H new ATOM 0 HA THR A 34 -9.581 -0.214 5.410 1.00 0.00 H new ATOM 0 HB THR A 34 -12.360 -1.341 5.883 1.00 0.00 H new ATOM 0 HG1 THR A 34 -12.017 -1.499 3.478 1.00 0.00 H new ATOM 0 HG21 THR A 34 -13.156 0.402 4.329 1.00 0.00 H new ATOM 0 HG22 THR A 34 -12.446 1.146 5.782 1.00 0.00 H new ATOM 0 HG23 THR A 34 -11.522 1.104 4.261 1.00 0.00 H new ATOM 463 N GLU A 35 -11.259 -0.054 8.220 1.00 0.00 N ATOM 464 CA GLU A 35 -11.459 0.769 9.400 1.00 0.00 C ATOM 465 C GLU A 35 -10.120 1.317 9.899 1.00 0.00 C ATOM 466 O GLU A 35 -9.924 2.530 9.955 1.00 0.00 O ATOM 467 CB GLU A 35 -12.175 -0.016 10.501 1.00 0.00 C ATOM 468 CG GLU A 35 -13.572 0.550 10.759 1.00 0.00 C ATOM 469 CD GLU A 35 -14.582 -0.573 11.008 1.00 0.00 C ATOM 470 OE1 GLU A 35 -14.350 -1.674 10.464 1.00 0.00 O ATOM 471 OE2 GLU A 35 -15.561 -0.304 11.736 1.00 0.00 O ATOM 0 H GLU A 35 -11.792 -0.924 8.211 1.00 0.00 H new ATOM 0 HA GLU A 35 -12.095 1.611 9.128 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -12.251 -1.065 10.214 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -11.589 0.021 11.419 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -13.545 1.217 11.621 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -13.890 1.147 9.904 1.00 0.00 H new ATOM 478 N THR A 36 -9.234 0.396 10.247 1.00 0.00 N ATOM 479 CA THR A 36 -7.919 0.772 10.739 1.00 0.00 C ATOM 480 C THR A 36 -7.291 1.829 9.829 1.00 0.00 C ATOM 481 O THR A 36 -6.916 2.906 10.290 1.00 0.00 O ATOM 482 CB THR A 36 -7.079 -0.501 10.861 1.00 0.00 C ATOM 483 OG1 THR A 36 -7.492 -1.073 12.099 1.00 0.00 O ATOM 484 CG2 THR A 36 -5.592 -0.204 11.065 1.00 0.00 C ATOM 0 H THR A 36 -9.400 -0.609 10.198 1.00 0.00 H new ATOM 0 HA THR A 36 -7.982 1.233 11.725 1.00 0.00 H new ATOM 0 HB THR A 36 -7.208 -1.108 9.965 1.00 0.00 H new ATOM 0 HG1 THR A 36 -6.998 -1.904 12.256 1.00 0.00 H new ATOM 0 HG21 THR A 36 -5.041 -1.141 11.145 1.00 0.00 H new ATOM 0 HG22 THR A 36 -5.215 0.366 10.216 1.00 0.00 H new ATOM 0 HG23 THR A 36 -5.459 0.375 11.979 1.00 0.00 H new ATOM 492 N LEU A 37 -7.197 1.486 8.553 1.00 0.00 N ATOM 493 CA LEU A 37 -6.622 2.392 7.574 1.00 0.00 C ATOM 494 C LEU A 37 -7.520 3.623 7.435 1.00 0.00 C ATOM 495 O LEU A 37 -7.119 4.625 6.844 1.00 0.00 O ATOM 496 CB LEU A 37 -6.368 1.664 6.253 1.00 0.00 C ATOM 497 CG LEU A 37 -5.535 0.384 6.342 1.00 0.00 C ATOM 498 CD1 LEU A 37 -5.683 -0.457 5.072 1.00 0.00 C ATOM 499 CD2 LEU A 37 -4.070 0.703 6.649 1.00 0.00 C ATOM 0 H LEU A 37 -7.510 0.592 8.174 1.00 0.00 H new ATOM 0 HA LEU A 37 -5.647 2.745 7.909 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -7.331 1.417 5.806 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -5.868 2.353 5.572 1.00 0.00 H new ATOM 0 HG LEU A 37 -5.916 -0.213 7.170 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -5.081 -1.361 5.162 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -6.729 -0.730 4.937 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -5.345 0.120 4.212 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -3.500 -0.224 6.707 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -3.661 1.331 5.858 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -4.004 1.229 7.601 1.00 0.00 H new ATOM 511 N ASN A 38 -8.718 3.508 7.990 1.00 0.00 N ATOM 512 CA ASN A 38 -9.676 4.598 7.935 1.00 0.00 C ATOM 513 C ASN A 38 -9.539 5.455 9.195 1.00 0.00 C ATOM 514 O ASN A 38 -10.464 6.180 9.560 1.00 0.00 O ATOM 515 CB ASN A 38 -11.110 4.069 7.876 1.00 0.00 C ATOM 516 CG ASN A 38 -11.754 4.378 6.523 1.00 0.00 C ATOM 517 OD1 ASN A 38 -11.739 3.357 5.671 1.00 0.00 O flip ATOM 518 ND2 ASN A 38 -12.232 5.471 6.269 1.00 0.00 N flip ATOM 0 H ASN A 38 -9.047 2.676 8.480 1.00 0.00 H new ATOM 0 HA ASN A 38 -9.471 5.183 7.038 1.00 0.00 H new ATOM 0 HB2 ASN A 38 -11.111 2.992 8.046 1.00 0.00 H new ATOM 0 HB3 ASN A 38 -11.700 4.518 8.675 1.00 0.00 H new ATOM 0 HD21 ASN A 38 -12.211 6.212 6.969 1.00 0.00 H new ATOM 0 HD22 ASN A 38 -12.653 5.644 5.356 1.00 0.00 H new ATOM 525 N ARG A 39 -8.379 5.344 9.825 1.00 0.00 N ATOM 526 CA ARG A 39 -8.110 6.099 11.036 1.00 0.00 C ATOM 527 C ARG A 39 -6.907 7.022 10.830 1.00 0.00 C ATOM 528 O ARG A 39 -5.945 6.653 10.159 1.00 0.00 O ATOM 529 CB ARG A 39 -7.831 5.166 12.217 1.00 0.00 C ATOM 530 CG ARG A 39 -9.127 4.544 12.741 1.00 0.00 C ATOM 531 CD ARG A 39 -8.973 4.101 14.197 1.00 0.00 C ATOM 532 NE ARG A 39 -10.169 4.495 14.975 1.00 0.00 N ATOM 533 CZ ARG A 39 -10.240 4.463 16.313 1.00 0.00 C ATOM 534 NH1 ARG A 39 -9.184 4.055 17.029 1.00 0.00 N ATOM 535 NH2 ARG A 39 -11.366 4.839 16.933 1.00 0.00 N ATOM 0 H ARG A 39 -7.614 4.742 9.519 1.00 0.00 H new ATOM 0 HA ARG A 39 -8.996 6.694 11.259 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -7.144 4.378 11.908 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -7.341 5.722 13.016 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -9.939 5.266 12.661 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -9.399 3.688 12.124 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -8.838 3.020 14.245 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -8.081 4.553 14.631 1.00 0.00 H new ATOM 0 HE ARG A 39 -10.991 4.811 14.460 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -8.327 3.769 16.556 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -9.237 4.030 18.047 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -12.170 5.150 16.387 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -11.420 4.815 17.951 1.00 0.00 H new ATOM 549 N GLU A 40 -7.001 8.205 11.419 1.00 0.00 N ATOM 550 CA GLU A 40 -5.932 9.183 11.309 1.00 0.00 C ATOM 551 C GLU A 40 -4.638 8.626 11.905 1.00 0.00 C ATOM 552 O GLU A 40 -4.572 8.346 13.101 1.00 0.00 O ATOM 553 CB GLU A 40 -6.323 10.501 11.981 1.00 0.00 C ATOM 554 CG GLU A 40 -7.156 11.372 11.039 1.00 0.00 C ATOM 555 CD GLU A 40 -7.343 12.778 11.613 1.00 0.00 C ATOM 556 OE1 GLU A 40 -6.333 13.513 11.653 1.00 0.00 O ATOM 557 OE2 GLU A 40 -8.491 13.085 11.999 1.00 0.00 O ATOM 0 H GLU A 40 -7.801 8.508 11.974 1.00 0.00 H new ATOM 0 HA GLU A 40 -5.762 9.389 10.252 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -6.890 10.296 12.889 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -5.425 11.040 12.281 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -6.666 11.434 10.067 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -8.129 10.910 10.876 1.00 0.00 H new ATOM 564 N GLY A 41 -3.642 8.482 11.044 1.00 0.00 N ATOM 565 CA GLY A 41 -2.353 7.963 11.471 1.00 0.00 C ATOM 566 C GLY A 41 -1.416 7.771 10.277 1.00 0.00 C ATOM 567 O GLY A 41 -1.320 8.641 9.413 1.00 0.00 O ATOM 0 H GLY A 41 -3.701 8.715 10.053 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -1.900 8.649 12.187 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -2.492 7.012 11.985 1.00 0.00 H new ATOM 571 N VAL A 42 -0.749 6.626 10.266 1.00 0.00 N ATOM 572 CA VAL A 42 0.177 6.310 9.192 1.00 0.00 C ATOM 573 C VAL A 42 0.173 4.799 8.951 1.00 0.00 C ATOM 574 O VAL A 42 0.278 4.016 9.894 1.00 0.00 O ATOM 575 CB VAL A 42 1.566 6.859 9.520 1.00 0.00 C ATOM 576 CG1 VAL A 42 1.641 8.362 9.243 1.00 0.00 C ATOM 577 CG2 VAL A 42 1.951 6.549 10.968 1.00 0.00 C ATOM 0 H VAL A 42 -0.832 5.906 10.984 1.00 0.00 H new ATOM 0 HA VAL A 42 -0.136 6.789 8.264 1.00 0.00 H new ATOM 0 HB VAL A 42 2.285 6.362 8.869 1.00 0.00 H new ATOM 0 HG11 VAL A 42 2.639 8.727 9.485 1.00 0.00 H new ATOM 0 HG12 VAL A 42 1.431 8.549 8.190 1.00 0.00 H new ATOM 0 HG13 VAL A 42 0.906 8.882 9.857 1.00 0.00 H new ATOM 0 HG21 VAL A 42 2.943 6.950 11.175 1.00 0.00 H new ATOM 0 HG22 VAL A 42 1.227 7.006 11.643 1.00 0.00 H new ATOM 0 HG23 VAL A 42 1.958 5.470 11.120 1.00 0.00 H new ATOM 587 N TYR A 43 0.051 4.435 7.683 1.00 0.00 N ATOM 588 CA TYR A 43 0.033 3.032 7.305 1.00 0.00 C ATOM 589 C TYR A 43 0.473 2.849 5.852 1.00 0.00 C ATOM 590 O TYR A 43 -0.185 3.338 4.934 1.00 0.00 O ATOM 591 CB TYR A 43 -1.421 2.576 7.447 1.00 0.00 C ATOM 592 CG TYR A 43 -1.923 2.535 8.891 1.00 0.00 C ATOM 593 CD1 TYR A 43 -1.392 1.622 9.780 1.00 0.00 C ATOM 594 CD2 TYR A 43 -2.906 3.410 9.306 1.00 0.00 C ATOM 595 CE1 TYR A 43 -1.864 1.583 11.140 1.00 0.00 C ATOM 596 CE2 TYR A 43 -3.378 3.371 10.666 1.00 0.00 C ATOM 597 CZ TYR A 43 -2.834 2.460 11.516 1.00 0.00 C ATOM 598 OH TYR A 43 -3.280 2.423 12.800 1.00 0.00 O ATOM 0 H TYR A 43 -0.036 5.088 6.904 1.00 0.00 H new ATOM 0 HA TYR A 43 0.715 2.457 7.932 1.00 0.00 H new ATOM 0 HB2 TYR A 43 -2.059 3.246 6.871 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -1.524 1.583 7.009 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -0.623 0.937 9.456 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -3.322 4.124 8.611 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -1.457 0.874 11.846 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -4.147 4.050 11.003 1.00 0.00 H new ATOM 0 HH TYR A 43 -3.971 3.106 12.926 1.00 0.00 H new ATOM 608 N THR A 44 1.583 2.144 5.687 1.00 0.00 N ATOM 609 CA THR A 44 2.118 1.891 4.360 1.00 0.00 C ATOM 610 C THR A 44 1.565 0.577 3.803 1.00 0.00 C ATOM 611 O THR A 44 1.971 -0.502 4.230 1.00 0.00 O ATOM 612 CB THR A 44 3.645 1.915 4.455 1.00 0.00 C ATOM 613 OG1 THR A 44 3.959 3.290 4.655 1.00 0.00 O ATOM 614 CG2 THR A 44 4.319 1.569 3.125 1.00 0.00 C ATOM 0 H THR A 44 2.126 1.740 6.450 1.00 0.00 H new ATOM 0 HA THR A 44 1.808 2.662 3.655 1.00 0.00 H new ATOM 0 HB THR A 44 3.972 1.213 5.222 1.00 0.00 H new ATOM 0 HG1 THR A 44 3.897 3.504 5.609 1.00 0.00 H new ATOM 0 HG21 THR A 44 5.402 1.600 3.247 1.00 0.00 H new ATOM 0 HG22 THR A 44 4.018 0.569 2.814 1.00 0.00 H new ATOM 0 HG23 THR A 44 4.018 2.291 2.366 1.00 0.00 H new ATOM 622 N VAL A 45 0.645 0.713 2.859 1.00 0.00 N ATOM 623 CA VAL A 45 0.032 -0.449 2.239 1.00 0.00 C ATOM 624 C VAL A 45 0.540 -0.583 0.802 1.00 0.00 C ATOM 625 O VAL A 45 0.992 0.394 0.206 1.00 0.00 O ATOM 626 CB VAL A 45 -1.492 -0.346 2.328 1.00 0.00 C ATOM 627 CG1 VAL A 45 -2.150 -1.699 2.049 1.00 0.00 C ATOM 628 CG2 VAL A 45 -1.926 0.206 3.687 1.00 0.00 C ATOM 0 H VAL A 45 0.309 1.610 2.509 1.00 0.00 H new ATOM 0 HA VAL A 45 0.314 -1.359 2.769 1.00 0.00 H new ATOM 0 HB VAL A 45 -1.826 0.353 1.561 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -3.233 -1.598 2.119 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -1.880 -2.035 1.048 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -1.806 -2.429 2.782 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -3.014 0.269 3.724 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -1.574 -0.456 4.478 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -1.500 1.199 3.829 1.00 0.00 H new ATOM 638 N PHE A 46 0.448 -1.800 0.287 1.00 0.00 N ATOM 639 CA PHE A 46 0.892 -2.074 -1.069 1.00 0.00 C ATOM 640 C PHE A 46 -0.211 -2.758 -1.880 1.00 0.00 C ATOM 641 O PHE A 46 -0.593 -3.889 -1.584 1.00 0.00 O ATOM 642 CB PHE A 46 2.091 -3.019 -0.964 1.00 0.00 C ATOM 643 CG PHE A 46 3.350 -2.365 -0.389 1.00 0.00 C ATOM 644 CD1 PHE A 46 4.246 -1.768 -1.220 1.00 0.00 C ATOM 645 CD2 PHE A 46 3.572 -2.382 0.952 1.00 0.00 C ATOM 646 CE1 PHE A 46 5.414 -1.161 -0.686 1.00 0.00 C ATOM 647 CE2 PHE A 46 4.740 -1.775 1.486 1.00 0.00 C ATOM 648 CZ PHE A 46 5.636 -1.178 0.655 1.00 0.00 C ATOM 0 H PHE A 46 0.073 -2.608 0.784 1.00 0.00 H new ATOM 0 HA PHE A 46 1.150 -1.142 -1.571 1.00 0.00 H new ATOM 0 HB2 PHE A 46 1.817 -3.869 -0.339 1.00 0.00 H new ATOM 0 HB3 PHE A 46 2.318 -3.413 -1.955 1.00 0.00 H new ATOM 0 HD1 PHE A 46 4.070 -1.755 -2.285 1.00 0.00 H new ATOM 0 HD2 PHE A 46 2.861 -2.857 1.611 1.00 0.00 H new ATOM 0 HE1 PHE A 46 6.125 -0.686 -1.345 1.00 0.00 H new ATOM 0 HE2 PHE A 46 4.916 -1.788 2.551 1.00 0.00 H new ATOM 0 HZ PHE A 46 6.524 -0.717 1.061 1.00 0.00 H new ATOM 658 N ALA A 47 -0.691 -2.042 -2.886 1.00 0.00 N ATOM 659 CA ALA A 47 -1.742 -2.565 -3.742 1.00 0.00 C ATOM 660 C ALA A 47 -1.153 -2.917 -5.109 1.00 0.00 C ATOM 661 O ALA A 47 -0.668 -2.042 -5.824 1.00 0.00 O ATOM 662 CB ALA A 47 -2.876 -1.543 -3.841 1.00 0.00 C ATOM 0 H ALA A 47 -0.371 -1.104 -3.128 1.00 0.00 H new ATOM 0 HA ALA A 47 -2.162 -3.478 -3.320 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -3.664 -1.935 -4.483 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -3.280 -1.350 -2.847 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -2.493 -0.614 -4.263 1.00 0.00 H new ATOM 668 N PRO A 48 -1.218 -4.234 -5.441 1.00 0.00 N ATOM 669 CA PRO A 48 -0.697 -4.713 -6.710 1.00 0.00 C ATOM 670 C PRO A 48 -1.632 -4.341 -7.862 1.00 0.00 C ATOM 671 O PRO A 48 -2.657 -3.694 -7.650 1.00 0.00 O ATOM 672 CB PRO A 48 -0.542 -6.214 -6.531 1.00 0.00 C ATOM 673 CG PRO A 48 -1.413 -6.584 -5.342 1.00 0.00 C ATOM 674 CD PRO A 48 -1.786 -5.299 -4.620 1.00 0.00 C ATOM 0 HA PRO A 48 0.258 -4.257 -6.972 1.00 0.00 H new ATOM 0 HB2 PRO A 48 -0.857 -6.749 -7.427 1.00 0.00 H new ATOM 0 HB3 PRO A 48 0.499 -6.480 -6.350 1.00 0.00 H new ATOM 0 HG2 PRO A 48 -2.309 -7.109 -5.674 1.00 0.00 H new ATOM 0 HG3 PRO A 48 -0.878 -7.257 -4.672 1.00 0.00 H new ATOM 0 HD2 PRO A 48 -2.867 -5.195 -4.530 1.00 0.00 H new ATOM 0 HD3 PRO A 48 -1.378 -5.280 -3.609 1.00 0.00 H new ATOM 682 N THR A 49 -1.247 -4.766 -9.056 1.00 0.00 N ATOM 683 CA THR A 49 -2.039 -4.487 -10.242 1.00 0.00 C ATOM 684 C THR A 49 -3.240 -5.431 -10.316 1.00 0.00 C ATOM 685 O THR A 49 -3.510 -6.174 -9.373 1.00 0.00 O ATOM 686 CB THR A 49 -1.116 -4.580 -11.459 1.00 0.00 C ATOM 687 OG1 THR A 49 -0.272 -5.691 -11.171 1.00 0.00 O ATOM 688 CG2 THR A 49 -0.153 -3.395 -11.556 1.00 0.00 C ATOM 0 H THR A 49 -0.396 -5.302 -9.228 1.00 0.00 H new ATOM 0 HA THR A 49 -2.458 -3.481 -10.210 1.00 0.00 H new ATOM 0 HB THR A 49 -1.717 -4.634 -12.367 1.00 0.00 H new ATOM 0 HG1 THR A 49 0.358 -5.824 -11.910 1.00 0.00 H new ATOM 0 HG21 THR A 49 0.479 -3.511 -12.437 1.00 0.00 H new ATOM 0 HG22 THR A 49 -0.722 -2.469 -11.637 1.00 0.00 H new ATOM 0 HG23 THR A 49 0.472 -3.360 -10.663 1.00 0.00 H new ATOM 696 N ASN A 50 -3.930 -5.372 -11.446 1.00 0.00 N ATOM 697 CA ASN A 50 -5.096 -6.213 -11.656 1.00 0.00 C ATOM 698 C ASN A 50 -4.641 -7.633 -11.998 1.00 0.00 C ATOM 699 O ASN A 50 -5.022 -8.590 -11.325 1.00 0.00 O ATOM 700 CB ASN A 50 -5.946 -5.696 -12.818 1.00 0.00 C ATOM 701 CG ASN A 50 -7.438 -5.828 -12.507 1.00 0.00 C ATOM 702 OD1 ASN A 50 -7.842 -6.163 -11.406 1.00 0.00 O ATOM 703 ND2 ASN A 50 -8.232 -5.545 -13.536 1.00 0.00 N ATOM 0 H ASN A 50 -3.704 -4.755 -12.226 1.00 0.00 H new ATOM 0 HA ASN A 50 -5.689 -6.201 -10.742 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -5.703 -4.652 -13.015 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -5.709 -6.255 -13.723 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -9.245 -5.602 -13.430 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -7.828 -5.271 -14.431 1.00 0.00 H new ATOM 710 N GLU A 51 -3.832 -7.725 -13.043 1.00 0.00 N ATOM 711 CA GLU A 51 -3.320 -9.013 -13.482 1.00 0.00 C ATOM 712 C GLU A 51 -2.511 -9.672 -12.363 1.00 0.00 C ATOM 713 O GLU A 51 -2.316 -10.887 -12.367 1.00 0.00 O ATOM 714 CB GLU A 51 -2.480 -8.864 -14.752 1.00 0.00 C ATOM 715 CG GLU A 51 -3.363 -8.908 -16.001 1.00 0.00 C ATOM 716 CD GLU A 51 -2.664 -9.655 -17.140 1.00 0.00 C ATOM 717 OE1 GLU A 51 -1.487 -9.323 -17.398 1.00 0.00 O ATOM 718 OE2 GLU A 51 -3.323 -10.540 -17.726 1.00 0.00 O ATOM 0 H GLU A 51 -3.518 -6.929 -13.599 1.00 0.00 H new ATOM 0 HA GLU A 51 -4.166 -9.658 -13.719 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -1.933 -7.922 -14.722 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -1.739 -9.662 -14.798 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -4.308 -9.398 -15.766 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -3.601 -7.893 -16.319 1.00 0.00 H new ATOM 725 N ALA A 52 -2.062 -8.843 -11.433 1.00 0.00 N ATOM 726 CA ALA A 52 -1.279 -9.330 -10.311 1.00 0.00 C ATOM 727 C ALA A 52 -2.031 -10.475 -9.629 1.00 0.00 C ATOM 728 O ALA A 52 -1.422 -11.456 -9.205 1.00 0.00 O ATOM 729 CB ALA A 52 -0.985 -8.174 -9.353 1.00 0.00 C ATOM 0 H ALA A 52 -2.226 -7.836 -11.434 1.00 0.00 H new ATOM 0 HA ALA A 52 -0.321 -9.722 -10.653 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -0.397 -8.540 -8.511 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -0.425 -7.400 -9.878 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -1.923 -7.757 -8.987 1.00 0.00 H new ATOM 735 N PHE A 53 -3.343 -10.311 -9.544 1.00 0.00 N ATOM 736 CA PHE A 53 -4.184 -11.319 -8.921 1.00 0.00 C ATOM 737 C PHE A 53 -4.437 -12.488 -9.875 1.00 0.00 C ATOM 738 O PHE A 53 -4.307 -13.649 -9.488 1.00 0.00 O ATOM 739 CB PHE A 53 -5.518 -10.647 -8.592 1.00 0.00 C ATOM 740 CG PHE A 53 -5.487 -9.790 -7.325 1.00 0.00 C ATOM 741 CD1 PHE A 53 -4.808 -8.611 -7.317 1.00 0.00 C ATOM 742 CD2 PHE A 53 -6.139 -10.206 -6.206 1.00 0.00 C ATOM 743 CE1 PHE A 53 -4.780 -7.816 -6.141 1.00 0.00 C ATOM 744 CE2 PHE A 53 -6.110 -9.411 -5.030 1.00 0.00 C ATOM 745 CZ PHE A 53 -5.431 -8.232 -5.023 1.00 0.00 C ATOM 0 H PHE A 53 -3.844 -9.495 -9.896 1.00 0.00 H new ATOM 0 HA PHE A 53 -3.695 -11.712 -8.029 1.00 0.00 H new ATOM 0 HB2 PHE A 53 -5.816 -10.022 -9.434 1.00 0.00 H new ATOM 0 HB3 PHE A 53 -6.283 -11.416 -8.480 1.00 0.00 H new ATOM 0 HD1 PHE A 53 -4.290 -8.280 -8.205 1.00 0.00 H new ATOM 0 HD2 PHE A 53 -6.679 -11.141 -6.212 1.00 0.00 H new ATOM 0 HE1 PHE A 53 -4.241 -6.880 -6.135 1.00 0.00 H new ATOM 0 HE2 PHE A 53 -6.627 -9.742 -4.141 1.00 0.00 H new ATOM 0 HZ PHE A 53 -5.409 -7.627 -4.129 1.00 0.00 H new ATOM 755 N ARG A 54 -4.794 -12.142 -11.102 1.00 0.00 N ATOM 756 CA ARG A 54 -5.067 -13.148 -12.115 1.00 0.00 C ATOM 757 C ARG A 54 -3.933 -14.175 -12.161 1.00 0.00 C ATOM 758 O ARG A 54 -4.146 -15.323 -12.549 1.00 0.00 O ATOM 759 CB ARG A 54 -5.226 -12.511 -13.496 1.00 0.00 C ATOM 760 CG ARG A 54 -6.581 -11.811 -13.625 1.00 0.00 C ATOM 761 CD ARG A 54 -6.711 -11.112 -14.979 1.00 0.00 C ATOM 762 NE ARG A 54 -7.984 -11.497 -15.628 1.00 0.00 N ATOM 763 CZ ARG A 54 -8.312 -11.178 -16.887 1.00 0.00 C ATOM 764 NH1 ARG A 54 -7.464 -10.465 -17.640 1.00 0.00 N ATOM 765 NH2 ARG A 54 -9.490 -11.570 -17.393 1.00 0.00 N ATOM 0 H ARG A 54 -4.901 -11.178 -11.419 1.00 0.00 H new ATOM 0 HA ARG A 54 -6.000 -13.643 -11.848 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -4.424 -11.792 -13.663 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -5.133 -13.277 -14.266 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -7.383 -12.540 -13.510 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -6.695 -11.082 -12.823 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -6.675 -10.031 -14.844 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -5.871 -11.382 -15.619 1.00 0.00 H new ATOM 0 HE ARG A 54 -8.654 -12.039 -15.082 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -6.568 -10.165 -17.255 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -7.714 -10.222 -18.599 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -10.137 -12.111 -16.819 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -9.740 -11.327 -18.352 1.00 0.00 H new ATOM 779 N ALA A 55 -2.753 -13.724 -11.762 1.00 0.00 N ATOM 780 CA ALA A 55 -1.586 -14.589 -11.753 1.00 0.00 C ATOM 781 C ALA A 55 -1.739 -15.635 -10.647 1.00 0.00 C ATOM 782 O ALA A 55 -1.493 -16.819 -10.870 1.00 0.00 O ATOM 783 CB ALA A 55 -0.323 -13.741 -11.583 1.00 0.00 C ATOM 0 H ALA A 55 -2.580 -12.771 -11.443 1.00 0.00 H new ATOM 0 HA ALA A 55 -1.496 -15.122 -12.700 1.00 0.00 H new ATOM 0 HB1 ALA A 55 0.553 -14.390 -11.576 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -0.245 -13.035 -12.410 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -0.376 -13.194 -10.642 1.00 0.00 H new ATOM 789 N LEU A 56 -2.144 -15.159 -9.479 1.00 0.00 N ATOM 790 CA LEU A 56 -2.333 -16.038 -8.338 1.00 0.00 C ATOM 791 C LEU A 56 -3.102 -17.285 -8.782 1.00 0.00 C ATOM 792 O LEU A 56 -4.020 -17.195 -9.596 1.00 0.00 O ATOM 793 CB LEU A 56 -2.998 -15.284 -7.185 1.00 0.00 C ATOM 794 CG LEU A 56 -2.138 -14.225 -6.492 1.00 0.00 C ATOM 795 CD1 LEU A 56 -2.973 -13.393 -5.517 1.00 0.00 C ATOM 796 CD2 LEU A 56 -0.927 -14.862 -5.810 1.00 0.00 C ATOM 0 H LEU A 56 -2.347 -14.176 -9.298 1.00 0.00 H new ATOM 0 HA LEU A 56 -1.370 -16.376 -7.954 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -3.898 -14.801 -7.564 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -3.317 -16.011 -6.438 1.00 0.00 H new ATOM 0 HG LEU A 56 -1.757 -13.544 -7.253 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -2.338 -12.648 -5.038 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -3.774 -12.892 -6.060 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -3.403 -14.046 -4.757 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -0.333 -14.087 -5.325 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -1.266 -15.580 -5.063 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -0.317 -15.374 -6.555 1.00 0.00 H new ATOM 808 N PRO A 57 -2.688 -18.448 -8.212 1.00 0.00 N ATOM 809 CA PRO A 57 -3.327 -19.711 -8.540 1.00 0.00 C ATOM 810 C PRO A 57 -4.694 -19.826 -7.863 1.00 0.00 C ATOM 811 O PRO A 57 -5.005 -19.063 -6.950 1.00 0.00 O ATOM 812 CB PRO A 57 -2.347 -20.779 -8.083 1.00 0.00 C ATOM 813 CG PRO A 57 -1.411 -20.093 -7.101 1.00 0.00 C ATOM 814 CD PRO A 57 -1.605 -18.592 -7.244 1.00 0.00 C ATOM 0 HA PRO A 57 -3.537 -19.811 -9.605 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -2.869 -21.611 -7.609 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -1.794 -21.189 -8.928 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -1.628 -20.411 -6.081 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -0.376 -20.366 -7.306 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -1.864 -18.134 -6.290 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -0.694 -18.107 -7.594 1.00 0.00 H new ATOM 822 N PRO A 58 -5.496 -20.811 -8.350 1.00 0.00 N ATOM 823 CA PRO A 58 -6.823 -21.035 -7.802 1.00 0.00 C ATOM 824 C PRO A 58 -6.743 -21.726 -6.439 1.00 0.00 C ATOM 825 O PRO A 58 -7.769 -22.008 -5.821 1.00 0.00 O ATOM 826 CB PRO A 58 -7.545 -21.868 -8.849 1.00 0.00 C ATOM 827 CG PRO A 58 -6.459 -22.470 -9.725 1.00 0.00 C ATOM 828 CD PRO A 58 -5.162 -21.733 -9.431 1.00 0.00 C ATOM 0 HA PRO A 58 -7.362 -20.107 -7.610 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -8.146 -22.648 -8.381 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -8.225 -21.252 -9.438 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -6.348 -23.535 -9.519 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -6.722 -22.375 -10.779 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -4.373 -22.424 -9.133 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -4.802 -21.199 -10.310 1.00 0.00 H new ATOM 836 N ARG A 59 -5.515 -21.978 -6.010 1.00 0.00 N ATOM 837 CA ARG A 59 -5.289 -22.630 -4.731 1.00 0.00 C ATOM 838 C ARG A 59 -5.052 -21.587 -3.638 1.00 0.00 C ATOM 839 O ARG A 59 -5.538 -21.735 -2.518 1.00 0.00 O ATOM 840 CB ARG A 59 -4.084 -23.571 -4.799 1.00 0.00 C ATOM 841 CG ARG A 59 -4.532 -25.027 -4.934 1.00 0.00 C ATOM 842 CD ARG A 59 -3.382 -25.986 -4.616 1.00 0.00 C ATOM 843 NE ARG A 59 -3.203 -26.947 -5.727 1.00 0.00 N ATOM 844 CZ ARG A 59 -2.161 -27.783 -5.836 1.00 0.00 C ATOM 845 NH1 ARG A 59 -1.200 -27.781 -4.903 1.00 0.00 N ATOM 846 NH2 ARG A 59 -2.081 -28.621 -6.879 1.00 0.00 N ATOM 0 H ARG A 59 -4.667 -21.743 -6.525 1.00 0.00 H new ATOM 0 HA ARG A 59 -6.179 -23.213 -4.494 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -3.454 -23.301 -5.647 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -3.477 -23.455 -3.901 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -5.367 -25.218 -4.260 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -4.892 -25.208 -5.947 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -2.462 -25.424 -4.459 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -3.590 -26.522 -3.690 1.00 0.00 H new ATOM 0 HE ARG A 59 -3.917 -26.975 -6.455 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -1.261 -27.143 -4.109 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -0.407 -28.417 -4.986 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -2.813 -28.622 -7.589 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -1.288 -29.257 -6.962 1.00 0.00 H new ATOM 860 N GLU A 60 -4.306 -20.555 -4.001 1.00 0.00 N ATOM 861 CA GLU A 60 -3.999 -19.487 -3.064 1.00 0.00 C ATOM 862 C GLU A 60 -4.987 -18.331 -3.235 1.00 0.00 C ATOM 863 O GLU A 60 -5.511 -17.808 -2.253 1.00 0.00 O ATOM 864 CB GLU A 60 -2.557 -19.005 -3.236 1.00 0.00 C ATOM 865 CG GLU A 60 -2.427 -17.524 -2.875 1.00 0.00 C ATOM 866 CD GLU A 60 -2.815 -17.279 -1.416 1.00 0.00 C ATOM 867 OE1 GLU A 60 -3.574 -18.116 -0.882 1.00 0.00 O ATOM 868 OE2 GLU A 60 -2.345 -16.259 -0.867 1.00 0.00 O ATOM 0 H GLU A 60 -3.905 -20.435 -4.931 1.00 0.00 H new ATOM 0 HA GLU A 60 -4.099 -19.878 -2.052 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -1.894 -19.596 -2.604 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -2.238 -19.161 -4.267 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -1.402 -17.194 -3.043 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -3.064 -16.929 -3.529 1.00 0.00 H new ATOM 875 N ARG A 61 -5.211 -17.967 -4.489 1.00 0.00 N ATOM 876 CA ARG A 61 -6.127 -16.882 -4.800 1.00 0.00 C ATOM 877 C ARG A 61 -7.467 -17.100 -4.094 1.00 0.00 C ATOM 878 O ARG A 61 -7.895 -16.266 -3.297 1.00 0.00 O ATOM 879 CB ARG A 61 -6.365 -16.778 -6.308 1.00 0.00 C ATOM 880 CG ARG A 61 -7.400 -15.698 -6.627 1.00 0.00 C ATOM 881 CD ARG A 61 -6.995 -14.898 -7.866 1.00 0.00 C ATOM 882 NE ARG A 61 -8.080 -14.939 -8.872 1.00 0.00 N ATOM 883 CZ ARG A 61 -8.419 -16.033 -9.567 1.00 0.00 C ATOM 884 NH1 ARG A 61 -7.760 -17.183 -9.371 1.00 0.00 N ATOM 885 NH2 ARG A 61 -9.417 -15.977 -10.460 1.00 0.00 N ATOM 0 H ARG A 61 -4.775 -18.403 -5.301 1.00 0.00 H new ATOM 0 HA ARG A 61 -5.674 -15.955 -4.450 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -5.427 -16.548 -6.813 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -6.707 -17.739 -6.693 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -8.374 -16.160 -6.790 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -7.505 -15.027 -5.775 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -6.784 -13.865 -7.589 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -6.079 -15.308 -8.290 1.00 0.00 H new ATOM 0 HE ARG A 61 -8.602 -14.081 -9.047 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -7.000 -17.226 -8.692 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -8.019 -18.016 -9.900 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -9.918 -15.101 -10.610 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -9.675 -16.810 -10.989 1.00 0.00 H new ATOM 899 N SER A 62 -8.091 -18.225 -4.411 1.00 0.00 N ATOM 900 CA SER A 62 -9.373 -18.562 -3.816 1.00 0.00 C ATOM 901 C SER A 62 -9.277 -18.492 -2.291 1.00 0.00 C ATOM 902 O SER A 62 -10.067 -17.803 -1.647 1.00 0.00 O ATOM 903 CB SER A 62 -9.835 -19.953 -4.256 1.00 0.00 C ATOM 904 OG SER A 62 -11.254 -20.038 -4.351 1.00 0.00 O ATOM 0 H SER A 62 -7.733 -18.914 -5.072 1.00 0.00 H new ATOM 0 HA SER A 62 -10.111 -17.838 -4.160 1.00 0.00 H new ATOM 0 HB2 SER A 62 -9.392 -20.194 -5.222 1.00 0.00 H new ATOM 0 HB3 SER A 62 -9.474 -20.697 -3.546 1.00 0.00 H new ATOM 0 HG SER A 62 -11.509 -20.940 -4.636 1.00 0.00 H new ATOM 910 N ARG A 63 -8.304 -19.215 -1.757 1.00 0.00 N ATOM 911 CA ARG A 63 -8.095 -19.243 -0.320 1.00 0.00 C ATOM 912 C ARG A 63 -8.210 -17.833 0.262 1.00 0.00 C ATOM 913 O ARG A 63 -8.968 -17.606 1.203 1.00 0.00 O ATOM 914 CB ARG A 63 -6.720 -19.819 0.026 1.00 0.00 C ATOM 915 CG ARG A 63 -6.809 -21.319 0.310 1.00 0.00 C ATOM 916 CD ARG A 63 -5.823 -21.729 1.406 1.00 0.00 C ATOM 917 NE ARG A 63 -5.732 -23.205 1.479 1.00 0.00 N ATOM 918 CZ ARG A 63 -4.979 -23.868 2.367 1.00 0.00 C ATOM 919 NH1 ARG A 63 -4.247 -23.191 3.262 1.00 0.00 N ATOM 920 NH2 ARG A 63 -4.959 -25.208 2.360 1.00 0.00 N ATOM 0 H ARG A 63 -7.651 -19.786 -2.294 1.00 0.00 H new ATOM 0 HA ARG A 63 -8.864 -19.882 0.113 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -6.030 -19.642 -0.799 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -6.315 -19.304 0.897 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -7.824 -21.576 0.614 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -6.598 -21.878 -0.601 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -4.840 -21.306 1.199 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -6.147 -21.328 2.367 1.00 0.00 H new ATOM 0 HE ARG A 63 -6.277 -23.751 0.812 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -4.263 -22.171 3.267 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -3.674 -23.695 3.938 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -5.517 -25.723 1.679 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -4.386 -25.713 3.036 1.00 0.00 H new ATOM 934 N LEU A 64 -7.446 -16.922 -0.323 1.00 0.00 N ATOM 935 CA LEU A 64 -7.453 -15.540 0.125 1.00 0.00 C ATOM 936 C LEU A 64 -8.897 -15.038 0.195 1.00 0.00 C ATOM 937 O LEU A 64 -9.374 -14.654 1.262 1.00 0.00 O ATOM 938 CB LEU A 64 -6.548 -14.684 -0.763 1.00 0.00 C ATOM 939 CG LEU A 64 -5.048 -14.968 -0.662 1.00 0.00 C ATOM 940 CD1 LEU A 64 -4.229 -13.758 -1.118 1.00 0.00 C ATOM 941 CD2 LEU A 64 -4.669 -15.417 0.751 1.00 0.00 C ATOM 0 H LEU A 64 -6.818 -17.114 -1.103 1.00 0.00 H new ATOM 0 HA LEU A 64 -7.039 -15.464 1.130 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -6.855 -14.821 -1.800 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -6.717 -13.636 -0.517 1.00 0.00 H new ATOM 0 HG LEU A 64 -4.810 -15.791 -1.336 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -3.166 -13.986 -1.036 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -4.471 -13.524 -2.155 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -4.465 -12.900 -0.488 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -3.598 -15.612 0.796 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -4.925 -14.632 1.463 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -5.214 -16.327 1.002 1.00 0.00 H new ATOM 953 N LEU A 65 -9.553 -15.057 -0.957 1.00 0.00 N ATOM 954 CA LEU A 65 -10.933 -14.609 -1.039 1.00 0.00 C ATOM 955 C LEU A 65 -11.807 -15.497 -0.151 1.00 0.00 C ATOM 956 O LEU A 65 -12.930 -15.128 0.188 1.00 0.00 O ATOM 957 CB LEU A 65 -11.393 -14.557 -2.498 1.00 0.00 C ATOM 958 CG LEU A 65 -10.501 -13.762 -3.454 1.00 0.00 C ATOM 959 CD1 LEU A 65 -10.675 -14.245 -4.895 1.00 0.00 C ATOM 960 CD2 LEU A 65 -10.753 -12.259 -3.318 1.00 0.00 C ATOM 0 H LEU A 65 -9.154 -15.375 -1.840 1.00 0.00 H new ATOM 0 HA LEU A 65 -11.026 -13.590 -0.662 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -11.471 -15.578 -2.870 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -12.395 -14.129 -2.527 1.00 0.00 H new ATOM 0 HG LEU A 65 -9.461 -13.939 -3.178 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -10.030 -13.664 -5.554 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -10.405 -15.299 -4.961 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -11.714 -14.117 -5.199 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -10.106 -11.718 -4.008 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -11.795 -12.042 -3.552 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -10.537 -11.945 -2.297 1.00 0.00 H new ATOM 972 N GLY A 66 -11.258 -16.650 0.202 1.00 0.00 N ATOM 973 CA GLY A 66 -11.973 -17.593 1.045 1.00 0.00 C ATOM 974 C GLY A 66 -11.845 -17.214 2.522 1.00 0.00 C ATOM 975 O GLY A 66 -12.619 -16.403 3.028 1.00 0.00 O ATOM 0 H GLY A 66 -10.326 -16.953 -0.081 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -13.025 -17.615 0.761 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -11.580 -18.597 0.888 1.00 0.00 H new ATOM 979 N ASP A 67 -10.863 -17.821 3.172 1.00 0.00 N ATOM 980 CA ASP A 67 -10.624 -17.557 4.581 1.00 0.00 C ATOM 981 C ASP A 67 -10.298 -16.074 4.770 1.00 0.00 C ATOM 982 O ASP A 67 -9.446 -15.528 4.072 1.00 0.00 O ATOM 983 CB ASP A 67 -9.437 -18.372 5.100 1.00 0.00 C ATOM 984 CG ASP A 67 -9.716 -19.862 5.305 1.00 0.00 C ATOM 985 OD1 ASP A 67 -10.536 -20.168 6.197 1.00 0.00 O ATOM 986 OD2 ASP A 67 -9.103 -20.661 4.565 1.00 0.00 O ATOM 0 H ASP A 67 -10.224 -18.494 2.749 1.00 0.00 H new ATOM 0 HA ASP A 67 -11.522 -17.835 5.133 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -8.609 -18.266 4.399 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -9.109 -17.945 6.048 1.00 0.00 H new ATOM 991 N ALA A 68 -10.995 -15.465 5.718 1.00 0.00 N ATOM 992 CA ALA A 68 -10.791 -14.056 6.008 1.00 0.00 C ATOM 993 C ALA A 68 -9.545 -13.895 6.881 1.00 0.00 C ATOM 994 O ALA A 68 -8.736 -12.996 6.655 1.00 0.00 O ATOM 995 CB ALA A 68 -12.046 -13.484 6.672 1.00 0.00 C ATOM 0 H ALA A 68 -11.701 -15.921 6.295 1.00 0.00 H new ATOM 0 HA ALA A 68 -10.624 -13.495 5.088 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -11.893 -12.427 6.890 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -12.897 -13.597 6.000 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -12.243 -14.021 7.600 1.00 0.00 H new ATOM 1001 N LYS A 69 -9.430 -14.779 7.861 1.00 0.00 N ATOM 1002 CA LYS A 69 -8.296 -14.746 8.769 1.00 0.00 C ATOM 1003 C LYS A 69 -6.999 -14.702 7.958 1.00 0.00 C ATOM 1004 O LYS A 69 -6.157 -13.832 8.173 1.00 0.00 O ATOM 1005 CB LYS A 69 -8.365 -15.914 9.755 1.00 0.00 C ATOM 1006 CG LYS A 69 -8.956 -15.467 11.094 1.00 0.00 C ATOM 1007 CD LYS A 69 -7.853 -15.212 12.122 1.00 0.00 C ATOM 1008 CE LYS A 69 -8.448 -14.858 13.487 1.00 0.00 C ATOM 1009 NZ LYS A 69 -7.824 -13.626 14.020 1.00 0.00 N ATOM 0 H LYS A 69 -10.103 -15.522 8.046 1.00 0.00 H new ATOM 0 HA LYS A 69 -8.322 -13.842 9.378 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -8.973 -16.715 9.334 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -7.366 -16.321 9.912 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -9.542 -14.559 10.952 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -9.637 -16.231 11.468 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -7.224 -16.098 12.214 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -7.212 -14.400 11.779 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -9.525 -14.717 13.396 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -8.292 -15.682 14.183 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -8.239 -13.400 14.946 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -6.800 -13.773 14.126 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -7.994 -12.838 13.363 1.00 0.00 H new ATOM 1023 N GLU A 70 -6.880 -15.651 7.041 1.00 0.00 N ATOM 1024 CA GLU A 70 -5.700 -15.732 6.197 1.00 0.00 C ATOM 1025 C GLU A 70 -5.583 -14.478 5.327 1.00 0.00 C ATOM 1026 O GLU A 70 -4.483 -13.982 5.092 1.00 0.00 O ATOM 1027 CB GLU A 70 -5.727 -16.996 5.336 1.00 0.00 C ATOM 1028 CG GLU A 70 -5.353 -18.230 6.160 1.00 0.00 C ATOM 1029 CD GLU A 70 -4.169 -18.969 5.534 1.00 0.00 C ATOM 1030 OE1 GLU A 70 -4.238 -19.218 4.311 1.00 0.00 O ATOM 1031 OE2 GLU A 70 -3.222 -19.269 6.292 1.00 0.00 O ATOM 0 H GLU A 70 -7.581 -16.370 6.864 1.00 0.00 H new ATOM 0 HA GLU A 70 -4.821 -15.789 6.839 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -6.721 -17.128 4.908 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -5.033 -16.887 4.502 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -5.102 -17.930 7.177 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -6.210 -18.900 6.227 1.00 0.00 H new ATOM 1038 N LEU A 71 -6.734 -14.003 4.873 1.00 0.00 N ATOM 1039 CA LEU A 71 -6.774 -12.817 4.035 1.00 0.00 C ATOM 1040 C LEU A 71 -6.088 -11.659 4.763 1.00 0.00 C ATOM 1041 O LEU A 71 -5.015 -11.215 4.357 1.00 0.00 O ATOM 1042 CB LEU A 71 -8.212 -12.510 3.610 1.00 0.00 C ATOM 1043 CG LEU A 71 -8.396 -12.025 2.170 1.00 0.00 C ATOM 1044 CD1 LEU A 71 -9.863 -11.695 1.887 1.00 0.00 C ATOM 1045 CD2 LEU A 71 -7.474 -10.843 1.868 1.00 0.00 C ATOM 0 H LEU A 71 -7.645 -14.418 5.070 1.00 0.00 H new ATOM 0 HA LEU A 71 -6.221 -12.985 3.111 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -8.811 -13.410 3.749 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -8.615 -11.752 4.282 1.00 0.00 H new ATOM 0 HG LEU A 71 -8.112 -12.834 1.497 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -9.967 -11.353 0.857 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -10.472 -12.587 2.036 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -10.197 -10.910 2.566 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -7.625 -10.518 0.839 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -7.703 -10.021 2.546 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -6.436 -11.147 2.004 1.00 0.00 H new ATOM 1057 N ALA A 72 -6.735 -11.203 5.825 1.00 0.00 N ATOM 1058 CA ALA A 72 -6.201 -10.106 6.613 1.00 0.00 C ATOM 1059 C ALA A 72 -4.722 -10.365 6.904 1.00 0.00 C ATOM 1060 O ALA A 72 -3.915 -9.437 6.913 1.00 0.00 O ATOM 1061 CB ALA A 72 -7.027 -9.945 7.891 1.00 0.00 C ATOM 0 H ALA A 72 -7.625 -11.574 6.158 1.00 0.00 H new ATOM 0 HA ALA A 72 -6.269 -9.169 6.061 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -6.626 -9.122 8.482 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -8.064 -9.733 7.630 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -6.980 -10.866 8.473 1.00 0.00 H new ATOM 1067 N ASN A 73 -4.411 -11.632 7.135 1.00 0.00 N ATOM 1068 CA ASN A 73 -3.042 -12.026 7.425 1.00 0.00 C ATOM 1069 C ASN A 73 -2.115 -11.466 6.346 1.00 0.00 C ATOM 1070 O ASN A 73 -1.101 -10.841 6.656 1.00 0.00 O ATOM 1071 CB ASN A 73 -2.897 -13.549 7.430 1.00 0.00 C ATOM 1072 CG ASN A 73 -1.879 -13.999 8.480 1.00 0.00 C ATOM 1073 OD1 ASN A 73 -1.143 -13.209 9.048 1.00 0.00 O ATOM 1074 ND2 ASN A 73 -1.879 -15.310 8.706 1.00 0.00 N ATOM 0 H ASN A 73 -5.083 -12.399 7.127 1.00 0.00 H new ATOM 0 HA ASN A 73 -2.780 -11.636 8.408 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -3.864 -14.009 7.635 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -2.583 -13.891 6.444 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -1.236 -15.710 9.390 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -2.522 -15.916 8.195 1.00 0.00 H new ATOM 1081 N ILE A 74 -2.494 -11.709 5.100 1.00 0.00 N ATOM 1082 CA ILE A 74 -1.709 -11.236 3.972 1.00 0.00 C ATOM 1083 C ILE A 74 -1.712 -9.707 3.960 1.00 0.00 C ATOM 1084 O ILE A 74 -0.656 -9.081 3.878 1.00 0.00 O ATOM 1085 CB ILE A 74 -2.211 -11.863 2.670 1.00 0.00 C ATOM 1086 CG1 ILE A 74 -1.897 -13.360 2.624 1.00 0.00 C ATOM 1087 CG2 ILE A 74 -1.651 -11.122 1.454 1.00 0.00 C ATOM 1088 CD1 ILE A 74 -0.393 -13.600 2.475 1.00 0.00 C ATOM 0 H ILE A 74 -3.335 -12.228 4.846 1.00 0.00 H new ATOM 0 HA ILE A 74 -0.670 -11.552 4.071 1.00 0.00 H new ATOM 0 HB ILE A 74 -3.296 -11.762 2.638 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -2.257 -13.839 3.535 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -2.427 -13.821 1.790 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -2.023 -11.587 0.541 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -1.968 -10.080 1.485 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -0.562 -11.170 1.468 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -0.197 -14.672 2.445 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -0.041 -13.141 1.551 1.00 0.00 H new ATOM 0 HD13 ILE A 74 0.132 -13.159 3.323 1.00 0.00 H new ATOM 1100 N LEU A 75 -2.911 -9.148 4.042 1.00 0.00 N ATOM 1101 CA LEU A 75 -3.065 -7.703 4.041 1.00 0.00 C ATOM 1102 C LEU A 75 -2.163 -7.098 5.119 1.00 0.00 C ATOM 1103 O LEU A 75 -1.506 -6.084 4.886 1.00 0.00 O ATOM 1104 CB LEU A 75 -4.539 -7.322 4.188 1.00 0.00 C ATOM 1105 CG LEU A 75 -5.478 -7.841 3.098 1.00 0.00 C ATOM 1106 CD1 LEU A 75 -6.833 -7.134 3.158 1.00 0.00 C ATOM 1107 CD2 LEU A 75 -4.832 -7.724 1.716 1.00 0.00 C ATOM 0 H LEU A 75 -3.785 -9.670 4.110 1.00 0.00 H new ATOM 0 HA LEU A 75 -2.745 -7.286 3.086 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -4.894 -7.689 5.151 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -4.612 -6.235 4.215 1.00 0.00 H new ATOM 0 HG LEU A 75 -5.659 -8.900 3.281 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -7.481 -7.522 2.372 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -7.294 -7.313 4.130 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -6.691 -6.063 3.015 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -5.521 -8.100 0.959 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -4.601 -6.679 1.510 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -3.913 -8.310 1.693 1.00 0.00 H new ATOM 1119 N LYS A 76 -2.159 -7.745 6.275 1.00 0.00 N ATOM 1120 CA LYS A 76 -1.349 -7.283 7.389 1.00 0.00 C ATOM 1121 C LYS A 76 0.095 -7.095 6.919 1.00 0.00 C ATOM 1122 O LYS A 76 0.668 -6.018 7.080 1.00 0.00 O ATOM 1123 CB LYS A 76 -1.489 -8.230 8.582 1.00 0.00 C ATOM 1124 CG LYS A 76 -2.772 -7.942 9.364 1.00 0.00 C ATOM 1125 CD LYS A 76 -3.107 -9.094 10.314 1.00 0.00 C ATOM 1126 CE LYS A 76 -4.525 -8.951 10.870 1.00 0.00 C ATOM 1127 NZ LYS A 76 -4.509 -9.005 12.349 1.00 0.00 N ATOM 0 H LYS A 76 -2.704 -8.586 6.464 1.00 0.00 H new ATOM 0 HA LYS A 76 -1.700 -6.312 7.739 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -1.496 -9.262 8.232 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -0.626 -8.122 9.239 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -2.656 -7.019 9.933 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -3.598 -7.787 8.670 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -3.013 -10.044 9.787 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -2.391 -9.113 11.135 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -4.958 -8.007 10.539 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -5.158 -9.747 10.478 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -5.479 -8.906 12.710 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -4.115 -9.916 12.659 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -3.922 -8.230 12.718 1.00 0.00 H new ATOM 1141 N TYR A 77 0.642 -8.158 6.348 1.00 0.00 N ATOM 1142 CA TYR A 77 2.008 -8.123 5.855 1.00 0.00 C ATOM 1143 C TYR A 77 2.147 -7.133 4.696 1.00 0.00 C ATOM 1144 O TYR A 77 3.258 -6.835 4.260 1.00 0.00 O ATOM 1145 CB TYR A 77 2.307 -9.534 5.343 1.00 0.00 C ATOM 1146 CG TYR A 77 3.741 -9.722 4.842 1.00 0.00 C ATOM 1147 CD1 TYR A 77 4.728 -10.132 5.715 1.00 0.00 C ATOM 1148 CD2 TYR A 77 4.046 -9.483 3.518 1.00 0.00 C ATOM 1149 CE1 TYR A 77 6.077 -10.310 5.243 1.00 0.00 C ATOM 1150 CE2 TYR A 77 5.395 -9.661 3.046 1.00 0.00 C ATOM 1151 CZ TYR A 77 6.344 -10.065 3.932 1.00 0.00 C ATOM 1152 OH TYR A 77 7.618 -10.233 3.487 1.00 0.00 O ATOM 0 H TYR A 77 0.164 -9.049 6.216 1.00 0.00 H new ATOM 0 HA TYR A 77 2.693 -7.810 6.643 1.00 0.00 H new ATOM 0 HB2 TYR A 77 2.116 -10.248 6.144 1.00 0.00 H new ATOM 0 HB3 TYR A 77 1.616 -9.770 4.534 1.00 0.00 H new ATOM 0 HD1 TYR A 77 4.489 -10.319 6.751 1.00 0.00 H new ATOM 0 HD2 TYR A 77 3.273 -9.162 2.835 1.00 0.00 H new ATOM 0 HE1 TYR A 77 6.859 -10.631 5.915 1.00 0.00 H new ATOM 0 HE2 TYR A 77 5.647 -9.478 2.012 1.00 0.00 H new ATOM 0 HH TYR A 77 7.661 -10.023 2.531 1.00 0.00 H new ATOM 1162 N HIS A 78 1.004 -6.651 4.231 1.00 0.00 N ATOM 1163 CA HIS A 78 0.984 -5.701 3.132 1.00 0.00 C ATOM 1164 C HIS A 78 0.897 -4.278 3.686 1.00 0.00 C ATOM 1165 O HIS A 78 1.204 -3.315 2.984 1.00 0.00 O ATOM 1166 CB HIS A 78 -0.145 -6.027 2.153 1.00 0.00 C ATOM 1167 CG HIS A 78 0.276 -6.908 1.001 1.00 0.00 C ATOM 1168 ND1 HIS A 78 0.396 -8.282 1.113 1.00 0.00 N ATOM 1169 CD2 HIS A 78 0.601 -6.596 -0.287 1.00 0.00 C ATOM 1170 CE1 HIS A 78 0.779 -8.765 -0.060 1.00 0.00 C ATOM 1171 NE2 HIS A 78 0.906 -7.719 -0.926 1.00 0.00 N ATOM 0 H HIS A 78 0.085 -6.901 4.595 1.00 0.00 H new ATOM 0 HA HIS A 78 1.911 -5.776 2.564 1.00 0.00 H new ATOM 0 HB2 HIS A 78 -0.953 -6.518 2.696 1.00 0.00 H new ATOM 0 HB3 HIS A 78 -0.548 -5.095 1.756 1.00 0.00 H new ATOM 0 HD1 HIS A 78 0.220 -8.830 1.955 1.00 0.00 H new ATOM 0 HD2 HIS A 78 0.609 -5.604 -0.714 1.00 0.00 H new ATOM 0 HE1 HIS A 78 0.959 -9.805 -0.290 1.00 0.00 H new ATOM 1179 N ILE A 79 0.477 -4.189 4.939 1.00 0.00 N ATOM 1180 CA ILE A 79 0.346 -2.899 5.595 1.00 0.00 C ATOM 1181 C ILE A 79 1.542 -2.680 6.524 1.00 0.00 C ATOM 1182 O ILE A 79 2.054 -3.628 7.117 1.00 0.00 O ATOM 1183 CB ILE A 79 -1.008 -2.792 6.300 1.00 0.00 C ATOM 1184 CG1 ILE A 79 -2.158 -2.906 5.299 1.00 0.00 C ATOM 1185 CG2 ILE A 79 -1.094 -1.509 7.130 1.00 0.00 C ATOM 1186 CD1 ILE A 79 -3.121 -4.027 5.694 1.00 0.00 C ATOM 0 H ILE A 79 0.223 -4.989 5.518 1.00 0.00 H new ATOM 0 HA ILE A 79 0.362 -2.094 4.860 1.00 0.00 H new ATOM 0 HB ILE A 79 -1.100 -3.629 6.992 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -2.697 -1.960 5.250 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -1.760 -3.098 4.303 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -2.066 -1.457 7.621 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -0.307 -1.510 7.884 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -0.971 -0.645 6.478 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -3.929 -4.086 4.965 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -2.585 -4.976 5.719 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -3.536 -3.819 6.680 1.00 0.00 H new ATOM 1198 N GLY A 80 1.953 -1.424 6.621 1.00 0.00 N ATOM 1199 CA GLY A 80 3.079 -1.068 7.467 1.00 0.00 C ATOM 1200 C GLY A 80 2.627 -0.208 8.649 1.00 0.00 C ATOM 1201 O GLY A 80 1.504 0.294 8.662 1.00 0.00 O ATOM 0 H GLY A 80 1.526 -0.640 6.127 1.00 0.00 H new ATOM 0 HA2 GLY A 80 3.562 -1.973 7.835 1.00 0.00 H new ATOM 0 HA3 GLY A 80 3.821 -0.526 6.881 1.00 0.00 H new ATOM 1205 N ASP A 81 3.524 -0.065 9.613 1.00 0.00 N ATOM 1206 CA ASP A 81 3.231 0.725 10.797 1.00 0.00 C ATOM 1207 C ASP A 81 4.032 2.028 10.745 1.00 0.00 C ATOM 1208 O ASP A 81 4.508 2.509 11.772 1.00 0.00 O ATOM 1209 CB ASP A 81 3.627 -0.023 12.071 1.00 0.00 C ATOM 1210 CG ASP A 81 2.570 -0.990 12.608 1.00 0.00 C ATOM 1211 OD1 ASP A 81 1.454 -0.508 12.896 1.00 0.00 O ATOM 1212 OD2 ASP A 81 2.903 -2.190 12.718 1.00 0.00 O ATOM 0 H ASP A 81 4.454 -0.483 9.599 1.00 0.00 H new ATOM 0 HA ASP A 81 2.159 0.922 10.814 1.00 0.00 H new ATOM 0 HB2 ASP A 81 4.543 -0.581 11.877 1.00 0.00 H new ATOM 0 HB3 ASP A 81 3.857 0.707 12.847 1.00 0.00 H new ATOM 1217 N GLU A 82 4.155 2.563 9.539 1.00 0.00 N ATOM 1218 CA GLU A 82 4.889 3.800 9.341 1.00 0.00 C ATOM 1219 C GLU A 82 4.927 4.163 7.855 1.00 0.00 C ATOM 1220 O GLU A 82 4.701 3.309 6.998 1.00 0.00 O ATOM 1221 CB GLU A 82 6.303 3.697 9.916 1.00 0.00 C ATOM 1222 CG GLU A 82 6.950 2.362 9.545 1.00 0.00 C ATOM 1223 CD GLU A 82 7.955 1.924 10.613 1.00 0.00 C ATOM 1224 OE1 GLU A 82 8.820 2.759 10.955 1.00 0.00 O ATOM 1225 OE2 GLU A 82 7.836 0.763 11.062 1.00 0.00 O ATOM 0 H GLU A 82 3.758 2.162 8.689 1.00 0.00 H new ATOM 0 HA GLU A 82 4.371 4.596 9.877 1.00 0.00 H new ATOM 0 HB2 GLU A 82 6.913 4.518 9.539 1.00 0.00 H new ATOM 0 HB3 GLU A 82 6.267 3.798 11.001 1.00 0.00 H new ATOM 0 HG2 GLU A 82 6.179 1.600 9.431 1.00 0.00 H new ATOM 0 HG3 GLU A 82 7.453 2.453 8.582 1.00 0.00 H new ATOM 1232 N ILE A 83 5.216 5.429 7.594 1.00 0.00 N ATOM 1233 CA ILE A 83 5.286 5.915 6.227 1.00 0.00 C ATOM 1234 C ILE A 83 6.719 5.766 5.711 1.00 0.00 C ATOM 1235 O ILE A 83 7.667 6.183 6.374 1.00 0.00 O ATOM 1236 CB ILE A 83 4.745 7.343 6.136 1.00 0.00 C ATOM 1237 CG1 ILE A 83 3.317 7.424 6.680 1.00 0.00 C ATOM 1238 CG2 ILE A 83 4.845 7.878 4.706 1.00 0.00 C ATOM 1239 CD1 ILE A 83 2.552 6.127 6.407 1.00 0.00 C ATOM 0 H ILE A 83 5.405 6.134 8.307 1.00 0.00 H new ATOM 0 HA ILE A 83 4.648 5.316 5.577 1.00 0.00 H new ATOM 0 HB ILE A 83 5.365 7.984 6.763 1.00 0.00 H new ATOM 0 HG12 ILE A 83 3.343 7.616 7.753 1.00 0.00 H new ATOM 0 HG13 ILE A 83 2.795 8.262 6.218 1.00 0.00 H new ATOM 0 HG21 ILE A 83 4.454 8.895 4.670 1.00 0.00 H new ATOM 0 HG22 ILE A 83 5.888 7.879 4.390 1.00 0.00 H new ATOM 0 HG23 ILE A 83 4.264 7.242 4.038 1.00 0.00 H new ATOM 0 HD11 ILE A 83 1.540 6.211 6.804 1.00 0.00 H new ATOM 0 HD12 ILE A 83 2.507 5.950 5.332 1.00 0.00 H new ATOM 0 HD13 ILE A 83 3.063 5.294 6.890 1.00 0.00 H new ATOM 1251 N LEU A 84 6.831 5.171 4.532 1.00 0.00 N ATOM 1252 CA LEU A 84 8.132 4.963 3.920 1.00 0.00 C ATOM 1253 C LEU A 84 8.068 5.371 2.446 1.00 0.00 C ATOM 1254 O LEU A 84 7.291 4.810 1.676 1.00 0.00 O ATOM 1255 CB LEU A 84 8.603 3.524 4.139 1.00 0.00 C ATOM 1256 CG LEU A 84 10.093 3.263 3.909 1.00 0.00 C ATOM 1257 CD1 LEU A 84 10.548 2.000 4.642 1.00 0.00 C ATOM 1258 CD2 LEU A 84 10.415 3.206 2.414 1.00 0.00 C ATOM 0 H LEU A 84 6.042 4.827 3.985 1.00 0.00 H new ATOM 0 HA LEU A 84 8.882 5.596 4.395 1.00 0.00 H new ATOM 0 HB2 LEU A 84 8.357 3.234 5.161 1.00 0.00 H new ATOM 0 HB3 LEU A 84 8.034 2.872 3.477 1.00 0.00 H new ATOM 0 HG LEU A 84 10.655 4.098 4.328 1.00 0.00 H new ATOM 0 HD11 LEU A 84 11.611 1.838 4.462 1.00 0.00 H new ATOM 0 HD12 LEU A 84 10.375 2.118 5.712 1.00 0.00 H new ATOM 0 HD13 LEU A 84 9.983 1.143 4.276 1.00 0.00 H new ATOM 0 HD21 LEU A 84 11.480 3.019 2.278 1.00 0.00 H new ATOM 0 HD22 LEU A 84 9.844 2.403 1.949 1.00 0.00 H new ATOM 0 HD23 LEU A 84 10.151 4.155 1.948 1.00 0.00 H new ATOM 1270 N VAL A 85 8.896 6.345 2.099 1.00 0.00 N ATOM 1271 CA VAL A 85 8.944 6.835 0.732 1.00 0.00 C ATOM 1272 C VAL A 85 10.394 6.829 0.243 1.00 0.00 C ATOM 1273 O VAL A 85 11.324 6.869 1.047 1.00 0.00 O ATOM 1274 CB VAL A 85 8.291 8.216 0.648 1.00 0.00 C ATOM 1275 CG1 VAL A 85 6.836 8.164 1.120 1.00 0.00 C ATOM 1276 CG2 VAL A 85 9.089 9.250 1.444 1.00 0.00 C ATOM 0 H VAL A 85 9.539 6.808 2.741 1.00 0.00 H new ATOM 0 HA VAL A 85 8.375 6.180 0.072 1.00 0.00 H new ATOM 0 HB VAL A 85 8.294 8.524 -0.397 1.00 0.00 H new ATOM 0 HG11 VAL A 85 6.395 9.158 1.050 1.00 0.00 H new ATOM 0 HG12 VAL A 85 6.274 7.473 0.492 1.00 0.00 H new ATOM 0 HG13 VAL A 85 6.801 7.823 2.155 1.00 0.00 H new ATOM 0 HG21 VAL A 85 8.603 10.223 1.367 1.00 0.00 H new ATOM 0 HG22 VAL A 85 9.134 8.948 2.490 1.00 0.00 H new ATOM 0 HG23 VAL A 85 10.100 9.317 1.042 1.00 0.00 H new ATOM 1286 N SER A 86 10.541 6.779 -1.073 1.00 0.00 N ATOM 1287 CA SER A 86 11.862 6.768 -1.678 1.00 0.00 C ATOM 1288 C SER A 86 12.638 8.020 -1.265 1.00 0.00 C ATOM 1289 O SER A 86 13.868 8.029 -1.291 1.00 0.00 O ATOM 1290 CB SER A 86 11.768 6.680 -3.203 1.00 0.00 C ATOM 1291 OG SER A 86 11.734 7.968 -3.811 1.00 0.00 O ATOM 0 H SER A 86 9.767 6.746 -1.737 1.00 0.00 H new ATOM 0 HA SER A 86 12.394 5.886 -1.322 1.00 0.00 H new ATOM 0 HB2 SER A 86 12.621 6.120 -3.587 1.00 0.00 H new ATOM 0 HB3 SER A 86 10.872 6.125 -3.480 1.00 0.00 H new ATOM 0 HG SER A 86 11.676 7.869 -4.784 1.00 0.00 H new ATOM 1366 N VAL A 93 16.098 0.316 4.698 1.00 0.00 N ATOM 1367 CA VAL A 93 15.118 0.718 5.693 1.00 0.00 C ATOM 1368 C VAL A 93 14.139 -0.434 5.932 1.00 0.00 C ATOM 1369 O VAL A 93 13.404 -0.826 5.027 1.00 0.00 O ATOM 1370 CB VAL A 93 14.425 2.009 5.254 1.00 0.00 C ATOM 1371 CG1 VAL A 93 13.207 2.304 6.131 1.00 0.00 C ATOM 1372 CG2 VAL A 93 15.403 3.186 5.261 1.00 0.00 C ATOM 0 HA VAL A 93 15.606 0.934 6.644 1.00 0.00 H new ATOM 0 HB VAL A 93 14.075 1.869 4.231 1.00 0.00 H new ATOM 0 HG11 VAL A 93 12.733 3.227 5.797 1.00 0.00 H new ATOM 0 HG12 VAL A 93 12.495 1.482 6.053 1.00 0.00 H new ATOM 0 HG13 VAL A 93 13.523 2.413 7.168 1.00 0.00 H new ATOM 0 HG21 VAL A 93 14.885 4.091 4.945 1.00 0.00 H new ATOM 0 HG22 VAL A 93 15.797 3.326 6.268 1.00 0.00 H new ATOM 0 HG23 VAL A 93 16.225 2.980 4.575 1.00 0.00 H new ATOM 1382 N ARG A 94 14.161 -0.943 7.155 1.00 0.00 N ATOM 1383 CA ARG A 94 13.285 -2.041 7.525 1.00 0.00 C ATOM 1384 C ARG A 94 11.964 -1.504 8.079 1.00 0.00 C ATOM 1385 O ARG A 94 11.934 -0.909 9.155 1.00 0.00 O ATOM 1386 CB ARG A 94 13.942 -2.941 8.574 1.00 0.00 C ATOM 1387 CG ARG A 94 14.942 -3.899 7.925 1.00 0.00 C ATOM 1388 CD ARG A 94 14.842 -5.296 8.542 1.00 0.00 C ATOM 1389 NE ARG A 94 15.595 -5.342 9.815 1.00 0.00 N ATOM 1390 CZ ARG A 94 15.622 -6.403 10.634 1.00 0.00 C ATOM 1391 NH1 ARG A 94 14.939 -7.511 10.318 1.00 0.00 N ATOM 1392 NH2 ARG A 94 16.333 -6.355 11.769 1.00 0.00 N ATOM 0 H ARG A 94 14.772 -0.615 7.903 1.00 0.00 H new ATOM 0 HA ARG A 94 13.094 -2.629 6.627 1.00 0.00 H new ATOM 0 HB2 ARG A 94 14.451 -2.327 9.318 1.00 0.00 H new ATOM 0 HB3 ARG A 94 13.176 -3.511 9.101 1.00 0.00 H new ATOM 0 HG2 ARG A 94 14.753 -3.957 6.853 1.00 0.00 H new ATOM 0 HG3 ARG A 94 15.954 -3.514 8.050 1.00 0.00 H new ATOM 0 HD2 ARG A 94 13.797 -5.551 8.719 1.00 0.00 H new ATOM 0 HD3 ARG A 94 15.238 -6.038 7.849 1.00 0.00 H new ATOM 0 HE ARG A 94 16.127 -4.515 10.086 1.00 0.00 H new ATOM 0 HH11 ARG A 94 14.398 -7.548 9.454 1.00 0.00 H new ATOM 0 HH12 ARG A 94 14.960 -8.318 10.941 1.00 0.00 H new ATOM 0 HH21 ARG A 94 16.853 -5.511 12.010 1.00 0.00 H new ATOM 0 HH22 ARG A 94 16.354 -7.162 12.392 1.00 0.00 H new ATOM 1406 N LEU A 95 10.904 -1.732 7.318 1.00 0.00 N ATOM 1407 CA LEU A 95 9.583 -1.277 7.719 1.00 0.00 C ATOM 1408 C LEU A 95 8.852 -2.416 8.434 1.00 0.00 C ATOM 1409 O LEU A 95 8.593 -3.461 7.840 1.00 0.00 O ATOM 1410 CB LEU A 95 8.821 -0.716 6.517 1.00 0.00 C ATOM 1411 CG LEU A 95 7.592 0.135 6.840 1.00 0.00 C ATOM 1412 CD1 LEU A 95 6.713 0.322 5.601 1.00 0.00 C ATOM 1413 CD2 LEU A 95 6.809 -0.455 8.014 1.00 0.00 C ATOM 0 H LEU A 95 10.933 -2.226 6.426 1.00 0.00 H new ATOM 0 HA LEU A 95 9.663 -0.453 8.428 1.00 0.00 H new ATOM 0 HB2 LEU A 95 9.510 -0.114 5.924 1.00 0.00 H new ATOM 0 HB3 LEU A 95 8.506 -1.550 5.890 1.00 0.00 H new ATOM 0 HG LEU A 95 7.933 1.124 7.145 1.00 0.00 H new ATOM 0 HD11 LEU A 95 5.846 0.931 5.858 1.00 0.00 H new ATOM 0 HD12 LEU A 95 7.287 0.820 4.820 1.00 0.00 H new ATOM 0 HD13 LEU A 95 6.379 -0.651 5.242 1.00 0.00 H new ATOM 0 HD21 LEU A 95 5.940 0.170 8.223 1.00 0.00 H new ATOM 0 HD22 LEU A 95 6.479 -1.463 7.762 1.00 0.00 H new ATOM 0 HD23 LEU A 95 7.449 -0.493 8.896 1.00 0.00 H new ATOM 1425 N LYS A 96 8.541 -2.174 9.699 1.00 0.00 N ATOM 1426 CA LYS A 96 7.845 -3.166 10.501 1.00 0.00 C ATOM 1427 C LYS A 96 6.393 -3.268 10.030 1.00 0.00 C ATOM 1428 O LYS A 96 5.686 -2.264 9.963 1.00 0.00 O ATOM 1429 CB LYS A 96 7.988 -2.848 11.990 1.00 0.00 C ATOM 1430 CG LYS A 96 8.399 -4.092 12.780 1.00 0.00 C ATOM 1431 CD LYS A 96 8.863 -3.718 14.189 1.00 0.00 C ATOM 1432 CE LYS A 96 7.777 -4.023 15.223 1.00 0.00 C ATOM 1433 NZ LYS A 96 8.285 -3.787 16.593 1.00 0.00 N ATOM 0 H LYS A 96 8.758 -1.306 10.188 1.00 0.00 H new ATOM 0 HA LYS A 96 8.295 -4.150 10.365 1.00 0.00 H new ATOM 0 HB2 LYS A 96 8.732 -2.063 12.128 1.00 0.00 H new ATOM 0 HB3 LYS A 96 7.044 -2.464 12.376 1.00 0.00 H new ATOM 0 HG2 LYS A 96 7.558 -4.782 12.842 1.00 0.00 H new ATOM 0 HG3 LYS A 96 9.200 -4.612 12.255 1.00 0.00 H new ATOM 0 HD2 LYS A 96 9.770 -4.270 14.435 1.00 0.00 H new ATOM 0 HD3 LYS A 96 9.115 -2.658 14.223 1.00 0.00 H new ATOM 0 HE2 LYS A 96 6.905 -3.396 15.039 1.00 0.00 H new ATOM 0 HE3 LYS A 96 7.452 -5.058 15.123 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 7.536 -3.999 17.282 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 9.103 -4.404 16.771 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 8.574 -2.793 16.690 1.00 0.00 H new ATOM 1447 N SER A 97 5.990 -4.491 9.717 1.00 0.00 N ATOM 1448 CA SER A 97 4.635 -4.737 9.255 1.00 0.00 C ATOM 1449 C SER A 97 3.742 -5.125 10.435 1.00 0.00 C ATOM 1450 O SER A 97 4.163 -5.869 11.319 1.00 0.00 O ATOM 1451 CB SER A 97 4.607 -5.833 8.187 1.00 0.00 C ATOM 1452 OG SER A 97 4.430 -7.128 8.754 1.00 0.00 O ATOM 0 H SER A 97 6.579 -5.322 9.774 1.00 0.00 H new ATOM 0 HA SER A 97 4.256 -3.819 8.806 1.00 0.00 H new ATOM 0 HB2 SER A 97 3.799 -5.632 7.483 1.00 0.00 H new ATOM 0 HB3 SER A 97 5.537 -5.810 7.620 1.00 0.00 H new ATOM 0 HG SER A 97 5.298 -7.579 8.817 1.00 0.00 H new ATOM 1458 N LEU A 98 2.525 -4.602 10.412 1.00 0.00 N ATOM 1459 CA LEU A 98 1.569 -4.884 11.469 1.00 0.00 C ATOM 1460 C LEU A 98 1.453 -6.398 11.656 1.00 0.00 C ATOM 1461 O LEU A 98 1.097 -6.868 12.736 1.00 0.00 O ATOM 1462 CB LEU A 98 0.232 -4.196 11.180 1.00 0.00 C ATOM 1463 CG LEU A 98 0.212 -2.675 11.342 1.00 0.00 C ATOM 1464 CD1 LEU A 98 1.191 -2.007 10.375 1.00 0.00 C ATOM 1465 CD2 LEU A 98 -1.208 -2.127 11.189 1.00 0.00 C ATOM 0 H LEU A 98 2.179 -3.984 9.678 1.00 0.00 H new ATOM 0 HA LEU A 98 1.916 -4.471 12.416 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -0.065 -4.437 10.159 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -0.523 -4.622 11.840 1.00 0.00 H new ATOM 0 HG LEU A 98 0.544 -2.435 12.352 1.00 0.00 H new ATOM 0 HD11 LEU A 98 1.157 -0.926 10.511 1.00 0.00 H new ATOM 0 HD12 LEU A 98 2.201 -2.366 10.574 1.00 0.00 H new ATOM 0 HD13 LEU A 98 0.914 -2.252 9.350 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -1.195 -1.044 11.309 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -1.590 -2.378 10.200 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -1.852 -2.568 11.950 1.00 0.00 H new ATOM 1477 N GLN A 99 1.762 -7.119 10.589 1.00 0.00 N ATOM 1478 CA GLN A 99 1.698 -8.570 10.622 1.00 0.00 C ATOM 1479 C GLN A 99 2.780 -9.128 11.549 1.00 0.00 C ATOM 1480 O GLN A 99 2.694 -10.274 11.990 1.00 0.00 O ATOM 1481 CB GLN A 99 1.825 -9.157 9.215 1.00 0.00 C ATOM 1482 CG GLN A 99 1.105 -10.504 9.116 1.00 0.00 C ATOM 1483 CD GLN A 99 2.102 -11.642 8.886 1.00 0.00 C ATOM 1484 OE1 GLN A 99 2.340 -12.078 7.772 1.00 0.00 O ATOM 1485 NE2 GLN A 99 2.668 -12.098 10.000 1.00 0.00 N ATOM 0 H GLN A 99 2.058 -6.725 9.696 1.00 0.00 H new ATOM 0 HA GLN A 99 0.724 -8.862 11.015 1.00 0.00 H new ATOM 0 HB2 GLN A 99 1.405 -8.462 8.488 1.00 0.00 H new ATOM 0 HB3 GLN A 99 2.878 -9.284 8.964 1.00 0.00 H new ATOM 0 HG2 GLN A 99 0.542 -10.688 10.031 1.00 0.00 H new ATOM 0 HG3 GLN A 99 0.384 -10.476 8.299 1.00 0.00 H new ATOM 0 HE21 GLN A 99 2.423 -11.688 10.901 1.00 0.00 H new ATOM 0 HE22 GLN A 99 3.347 -12.858 9.953 1.00 0.00 H new ATOM 1494 N GLY A 100 3.773 -8.293 11.817 1.00 0.00 N ATOM 1495 CA GLY A 100 4.870 -8.689 12.683 1.00 0.00 C ATOM 1496 C GLY A 100 6.200 -8.673 11.926 1.00 0.00 C ATOM 1497 O GLY A 100 7.205 -8.184 12.439 1.00 0.00 O ATOM 0 H GLY A 100 3.841 -7.344 11.450 1.00 0.00 H new ATOM 0 HA2 GLY A 100 4.926 -8.014 13.537 1.00 0.00 H new ATOM 0 HA3 GLY A 100 4.684 -9.688 13.078 1.00 0.00 H new ATOM 1501 N ASP A 101 6.162 -9.214 10.717 1.00 0.00 N ATOM 1502 CA ASP A 101 7.351 -9.269 9.884 1.00 0.00 C ATOM 1503 C ASP A 101 7.721 -7.853 9.438 1.00 0.00 C ATOM 1504 O ASP A 101 6.848 -7.001 9.276 1.00 0.00 O ATOM 1505 CB ASP A 101 7.107 -10.111 8.631 1.00 0.00 C ATOM 1506 CG ASP A 101 6.459 -11.474 8.883 1.00 0.00 C ATOM 1507 OD1 ASP A 101 6.639 -11.988 10.008 1.00 0.00 O ATOM 1508 OD2 ASP A 101 5.798 -11.970 7.945 1.00 0.00 O ATOM 0 H ASP A 101 5.326 -9.618 10.294 1.00 0.00 H new ATOM 0 HA ASP A 101 8.153 -9.719 10.470 1.00 0.00 H new ATOM 0 HB2 ASP A 101 6.473 -9.545 7.949 1.00 0.00 H new ATOM 0 HB3 ASP A 101 8.060 -10.267 8.125 1.00 0.00 H new ATOM 1513 N LYS A 102 9.016 -7.645 9.252 1.00 0.00 N ATOM 1514 CA LYS A 102 9.512 -6.347 8.827 1.00 0.00 C ATOM 1515 C LYS A 102 9.814 -6.387 7.328 1.00 0.00 C ATOM 1516 O LYS A 102 10.698 -7.121 6.888 1.00 0.00 O ATOM 1517 CB LYS A 102 10.708 -5.924 9.684 1.00 0.00 C ATOM 1518 CG LYS A 102 10.561 -6.434 11.119 1.00 0.00 C ATOM 1519 CD LYS A 102 11.158 -7.835 11.267 1.00 0.00 C ATOM 1520 CE LYS A 102 11.896 -7.978 12.600 1.00 0.00 C ATOM 1521 NZ LYS A 102 11.527 -9.249 13.262 1.00 0.00 N ATOM 0 H LYS A 102 9.737 -8.354 9.388 1.00 0.00 H new ATOM 0 HA LYS A 102 8.752 -5.580 8.979 1.00 0.00 H new ATOM 0 HB2 LYS A 102 11.628 -6.313 9.248 1.00 0.00 H new ATOM 0 HB3 LYS A 102 10.792 -4.837 9.687 1.00 0.00 H new ATOM 0 HG2 LYS A 102 11.059 -5.749 11.805 1.00 0.00 H new ATOM 0 HG3 LYS A 102 9.507 -6.453 11.396 1.00 0.00 H new ATOM 0 HD2 LYS A 102 10.365 -8.581 11.204 1.00 0.00 H new ATOM 0 HD3 LYS A 102 11.845 -8.030 10.444 1.00 0.00 H new ATOM 0 HE2 LYS A 102 12.972 -7.948 12.432 1.00 0.00 H new ATOM 0 HE3 LYS A 102 11.651 -7.138 13.250 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 12.036 -9.331 14.165 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 10.502 -9.263 13.440 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 11.783 -10.048 12.647 1.00 0.00 H new ATOM 1535 N LEU A 103 9.063 -5.588 6.584 1.00 0.00 N ATOM 1536 CA LEU A 103 9.238 -5.522 5.143 1.00 0.00 C ATOM 1537 C LEU A 103 10.494 -4.709 4.824 1.00 0.00 C ATOM 1538 O LEU A 103 10.793 -3.729 5.504 1.00 0.00 O ATOM 1539 CB LEU A 103 7.972 -4.987 4.473 1.00 0.00 C ATOM 1540 CG LEU A 103 6.654 -5.621 4.926 1.00 0.00 C ATOM 1541 CD1 LEU A 103 5.504 -4.616 4.837 1.00 0.00 C ATOM 1542 CD2 LEU A 103 6.361 -6.899 4.138 1.00 0.00 C ATOM 0 H LEU A 103 8.331 -4.980 6.953 1.00 0.00 H new ATOM 0 HA LEU A 103 9.390 -6.520 4.731 1.00 0.00 H new ATOM 0 HB2 LEU A 103 7.916 -3.913 4.652 1.00 0.00 H new ATOM 0 HB3 LEU A 103 8.068 -5.126 3.396 1.00 0.00 H new ATOM 0 HG LEU A 103 6.753 -5.905 5.974 1.00 0.00 H new ATOM 0 HD11 LEU A 103 4.579 -5.091 5.164 1.00 0.00 H new ATOM 0 HD12 LEU A 103 5.718 -3.760 5.477 1.00 0.00 H new ATOM 0 HD13 LEU A 103 5.394 -4.279 3.806 1.00 0.00 H new ATOM 0 HD21 LEU A 103 5.419 -7.329 4.479 1.00 0.00 H new ATOM 0 HD22 LEU A 103 6.288 -6.663 3.076 1.00 0.00 H new ATOM 0 HD23 LEU A 103 7.166 -7.617 4.296 1.00 0.00 H new ATOM 1554 N GLU A 104 11.196 -5.145 3.788 1.00 0.00 N ATOM 1555 CA GLU A 104 12.412 -4.470 3.370 1.00 0.00 C ATOM 1556 C GLU A 104 12.110 -3.485 2.238 1.00 0.00 C ATOM 1557 O GLU A 104 11.456 -3.841 1.259 1.00 0.00 O ATOM 1558 CB GLU A 104 13.482 -5.478 2.948 1.00 0.00 C ATOM 1559 CG GLU A 104 14.675 -5.444 3.906 1.00 0.00 C ATOM 1560 CD GLU A 104 15.257 -6.845 4.107 1.00 0.00 C ATOM 1561 OE1 GLU A 104 14.742 -7.550 5.001 1.00 0.00 O ATOM 1562 OE2 GLU A 104 16.203 -7.179 3.362 1.00 0.00 O ATOM 0 H GLU A 104 10.945 -5.958 3.226 1.00 0.00 H new ATOM 0 HA GLU A 104 12.803 -3.909 4.219 1.00 0.00 H new ATOM 0 HB2 GLU A 104 13.055 -6.481 2.929 1.00 0.00 H new ATOM 0 HB3 GLU A 104 13.818 -5.255 1.935 1.00 0.00 H new ATOM 0 HG2 GLU A 104 15.444 -4.780 3.511 1.00 0.00 H new ATOM 0 HG3 GLU A 104 14.363 -5.035 4.867 1.00 0.00 H new ATOM 1569 N VAL A 105 12.602 -2.267 2.409 1.00 0.00 N ATOM 1570 CA VAL A 105 12.393 -1.229 1.414 1.00 0.00 C ATOM 1571 C VAL A 105 13.663 -0.385 1.290 1.00 0.00 C ATOM 1572 O VAL A 105 14.198 0.089 2.291 1.00 0.00 O ATOM 1573 CB VAL A 105 11.158 -0.401 1.773 1.00 0.00 C ATOM 1574 CG1 VAL A 105 10.564 0.265 0.530 1.00 0.00 C ATOM 1575 CG2 VAL A 105 10.112 -1.258 2.489 1.00 0.00 C ATOM 0 H VAL A 105 13.145 -1.976 3.222 1.00 0.00 H new ATOM 0 HA VAL A 105 12.199 -1.670 0.436 1.00 0.00 H new ATOM 0 HB VAL A 105 11.471 0.387 2.458 1.00 0.00 H new ATOM 0 HG11 VAL A 105 9.687 0.847 0.813 1.00 0.00 H new ATOM 0 HG12 VAL A 105 11.307 0.923 0.080 1.00 0.00 H new ATOM 0 HG13 VAL A 105 10.274 -0.501 -0.190 1.00 0.00 H new ATOM 0 HG21 VAL A 105 9.244 -0.645 2.733 1.00 0.00 H new ATOM 0 HG22 VAL A 105 9.806 -2.077 1.839 1.00 0.00 H new ATOM 0 HG23 VAL A 105 10.539 -1.663 3.406 1.00 0.00 H new ATOM 1585 N SER A 106 14.109 -0.223 0.053 1.00 0.00 N ATOM 1586 CA SER A 106 15.306 0.556 -0.215 1.00 0.00 C ATOM 1587 C SER A 106 15.161 1.298 -1.545 1.00 0.00 C ATOM 1588 O SER A 106 14.147 1.162 -2.228 1.00 0.00 O ATOM 1589 CB SER A 106 16.550 -0.335 -0.237 1.00 0.00 C ATOM 1590 OG SER A 106 16.239 -1.676 -0.608 1.00 0.00 O ATOM 0 H SER A 106 13.663 -0.618 -0.775 1.00 0.00 H new ATOM 0 HA SER A 106 15.427 1.283 0.588 1.00 0.00 H new ATOM 0 HB2 SER A 106 17.278 0.075 -0.937 1.00 0.00 H new ATOM 0 HB3 SER A 106 17.017 -0.330 0.748 1.00 0.00 H new ATOM 0 HG SER A 106 17.059 -2.213 -0.612 1.00 0.00 H new ATOM 1596 N LEU A 107 16.189 2.066 -1.873 1.00 0.00 N ATOM 1597 CA LEU A 107 16.189 2.830 -3.109 1.00 0.00 C ATOM 1598 C LEU A 107 17.490 2.563 -3.869 1.00 0.00 C ATOM 1599 O LEU A 107 18.561 2.989 -3.441 1.00 0.00 O ATOM 1600 CB LEU A 107 15.936 4.312 -2.824 1.00 0.00 C ATOM 1601 CG LEU A 107 15.895 5.232 -4.045 1.00 0.00 C ATOM 1602 CD1 LEU A 107 14.938 4.690 -5.109 1.00 0.00 C ATOM 1603 CD2 LEU A 107 15.547 6.666 -3.640 1.00 0.00 C ATOM 0 H LEU A 107 17.028 2.176 -1.304 1.00 0.00 H new ATOM 0 HA LEU A 107 15.371 2.510 -3.754 1.00 0.00 H new ATOM 0 HB2 LEU A 107 14.988 4.403 -2.293 1.00 0.00 H new ATOM 0 HB3 LEU A 107 16.714 4.670 -2.150 1.00 0.00 H new ATOM 0 HG LEU A 107 16.891 5.254 -4.488 1.00 0.00 H new ATOM 0 HD11 LEU A 107 14.928 5.363 -5.966 1.00 0.00 H new ATOM 0 HD12 LEU A 107 15.270 3.702 -5.428 1.00 0.00 H new ATOM 0 HD13 LEU A 107 13.933 4.618 -4.692 1.00 0.00 H new ATOM 0 HD21 LEU A 107 15.525 7.299 -4.527 1.00 0.00 H new ATOM 0 HD22 LEU A 107 14.569 6.681 -3.159 1.00 0.00 H new ATOM 0 HD23 LEU A 107 16.299 7.041 -2.946 1.00 0.00 H new ATOM 1615 N LYS A 108 17.353 1.859 -4.983 1.00 0.00 N ATOM 1616 CA LYS A 108 18.505 1.530 -5.806 1.00 0.00 C ATOM 1617 C LYS A 108 18.146 1.728 -7.280 1.00 0.00 C ATOM 1618 O LYS A 108 17.039 1.398 -7.703 1.00 0.00 O ATOM 1619 CB LYS A 108 19.012 0.124 -5.481 1.00 0.00 C ATOM 1620 CG LYS A 108 20.307 0.183 -4.667 1.00 0.00 C ATOM 1621 CD LYS A 108 20.884 -1.218 -4.454 1.00 0.00 C ATOM 1622 CE LYS A 108 22.358 -1.271 -4.862 1.00 0.00 C ATOM 1623 NZ LYS A 108 23.054 -2.367 -4.151 1.00 0.00 N ATOM 0 H LYS A 108 16.463 1.507 -5.335 1.00 0.00 H new ATOM 0 HA LYS A 108 19.335 2.202 -5.586 1.00 0.00 H new ATOM 0 HB2 LYS A 108 18.251 -0.421 -4.922 1.00 0.00 H new ATOM 0 HB3 LYS A 108 19.184 -0.427 -6.405 1.00 0.00 H new ATOM 0 HG2 LYS A 108 21.037 0.806 -5.183 1.00 0.00 H new ATOM 0 HG3 LYS A 108 20.113 0.651 -3.702 1.00 0.00 H new ATOM 0 HD2 LYS A 108 20.782 -1.502 -3.407 1.00 0.00 H new ATOM 0 HD3 LYS A 108 20.315 -1.942 -5.037 1.00 0.00 H new ATOM 0 HE2 LYS A 108 22.438 -1.420 -5.939 1.00 0.00 H new ATOM 0 HE3 LYS A 108 22.839 -0.319 -4.635 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 24.053 -2.389 -4.440 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 22.993 -2.209 -3.125 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 22.605 -3.275 -4.388 1.00 0.00 H new ATOM 1637 N ASN A 109 19.103 2.266 -8.022 1.00 0.00 N ATOM 1638 CA ASN A 109 18.901 2.512 -9.440 1.00 0.00 C ATOM 1639 C ASN A 109 17.663 3.391 -9.630 1.00 0.00 C ATOM 1640 O ASN A 109 17.094 3.440 -10.719 1.00 0.00 O ATOM 1641 CB ASN A 109 18.673 1.203 -10.199 1.00 0.00 C ATOM 1642 CG ASN A 109 19.966 0.392 -10.295 1.00 0.00 C ATOM 1643 OD1 ASN A 109 20.429 -0.203 -9.336 1.00 0.00 O ATOM 1644 ND2 ASN A 109 20.522 0.401 -11.503 1.00 0.00 N ATOM 0 H ASN A 109 20.020 2.538 -7.668 1.00 0.00 H new ATOM 0 HA ASN A 109 19.794 3.003 -9.828 1.00 0.00 H new ATOM 0 HB2 ASN A 109 17.907 0.614 -9.694 1.00 0.00 H new ATOM 0 HB3 ASN A 109 18.300 1.419 -11.200 1.00 0.00 H new ATOM 0 HD21 ASN A 109 21.388 -0.111 -11.670 1.00 0.00 H new ATOM 0 HD22 ASN A 109 20.082 0.920 -12.263 1.00 0.00 H new ATOM 1651 N ASN A 110 17.283 4.063 -8.553 1.00 0.00 N ATOM 1652 CA ASN A 110 16.123 4.937 -8.587 1.00 0.00 C ATOM 1653 C ASN A 110 14.852 4.089 -8.651 1.00 0.00 C ATOM 1654 O ASN A 110 13.799 4.571 -9.065 1.00 0.00 O ATOM 1655 CB ASN A 110 16.151 5.841 -9.822 1.00 0.00 C ATOM 1656 CG ASN A 110 15.934 7.305 -9.435 1.00 0.00 C ATOM 1657 OD1 ASN A 110 15.447 7.625 -8.364 1.00 0.00 O ATOM 1658 ND2 ASN A 110 16.323 8.173 -10.365 1.00 0.00 N ATOM 0 H ASN A 110 17.758 4.020 -7.651 1.00 0.00 H new ATOM 0 HA ASN A 110 16.139 5.553 -7.688 1.00 0.00 H new ATOM 0 HB2 ASN A 110 17.108 5.734 -10.333 1.00 0.00 H new ATOM 0 HB3 ASN A 110 15.378 5.528 -10.524 1.00 0.00 H new ATOM 0 HD21 ASN A 110 16.221 9.175 -10.202 1.00 0.00 H new ATOM 0 HD22 ASN A 110 16.723 7.837 -11.241 1.00 0.00 H new ATOM 1665 N VAL A 111 14.992 2.839 -8.234 1.00 0.00 N ATOM 1666 CA VAL A 111 13.867 1.918 -8.238 1.00 0.00 C ATOM 1667 C VAL A 111 13.564 1.484 -6.803 1.00 0.00 C ATOM 1668 O VAL A 111 14.479 1.242 -6.017 1.00 0.00 O ATOM 1669 CB VAL A 111 14.159 0.741 -9.170 1.00 0.00 C ATOM 1670 CG1 VAL A 111 13.284 -0.465 -8.820 1.00 0.00 C ATOM 1671 CG2 VAL A 111 13.977 1.143 -10.635 1.00 0.00 C ATOM 0 H VAL A 111 15.867 2.442 -7.891 1.00 0.00 H new ATOM 0 HA VAL A 111 12.973 2.408 -8.625 1.00 0.00 H new ATOM 0 HB VAL A 111 15.201 0.452 -9.029 1.00 0.00 H new ATOM 0 HG11 VAL A 111 13.511 -1.288 -9.497 1.00 0.00 H new ATOM 0 HG12 VAL A 111 13.484 -0.774 -7.794 1.00 0.00 H new ATOM 0 HG13 VAL A 111 12.233 -0.193 -8.919 1.00 0.00 H new ATOM 0 HG21 VAL A 111 14.191 0.288 -11.276 1.00 0.00 H new ATOM 0 HG22 VAL A 111 12.950 1.471 -10.798 1.00 0.00 H new ATOM 0 HG23 VAL A 111 14.660 1.957 -10.876 1.00 0.00 H new ATOM 1681 N VAL A 112 12.276 1.399 -6.504 1.00 0.00 N ATOM 1682 CA VAL A 112 11.841 0.998 -5.177 1.00 0.00 C ATOM 1683 C VAL A 112 11.456 -0.483 -5.197 1.00 0.00 C ATOM 1684 O VAL A 112 10.976 -0.989 -6.210 1.00 0.00 O ATOM 1685 CB VAL A 112 10.703 1.905 -4.703 1.00 0.00 C ATOM 1686 CG1 VAL A 112 10.291 1.564 -3.270 1.00 0.00 C ATOM 1687 CG2 VAL A 112 11.091 3.380 -4.825 1.00 0.00 C ATOM 0 H VAL A 112 11.520 1.601 -7.158 1.00 0.00 H new ATOM 0 HA VAL A 112 12.652 1.114 -4.458 1.00 0.00 H new ATOM 0 HB VAL A 112 9.843 1.730 -5.350 1.00 0.00 H new ATOM 0 HG11 VAL A 112 9.481 2.223 -2.958 1.00 0.00 H new ATOM 0 HG12 VAL A 112 9.954 0.528 -3.225 1.00 0.00 H new ATOM 0 HG13 VAL A 112 11.144 1.697 -2.605 1.00 0.00 H new ATOM 0 HG21 VAL A 112 10.265 4.003 -4.482 1.00 0.00 H new ATOM 0 HG22 VAL A 112 11.972 3.576 -4.214 1.00 0.00 H new ATOM 0 HG23 VAL A 112 11.313 3.613 -5.866 1.00 0.00 H new ATOM 1697 N SER A 113 11.680 -1.135 -4.065 1.00 0.00 N ATOM 1698 CA SER A 113 11.363 -2.547 -3.940 1.00 0.00 C ATOM 1699 C SER A 113 10.834 -2.842 -2.535 1.00 0.00 C ATOM 1700 O SER A 113 11.207 -2.171 -1.574 1.00 0.00 O ATOM 1701 CB SER A 113 12.586 -3.415 -4.241 1.00 0.00 C ATOM 1702 OG SER A 113 13.607 -2.685 -4.915 1.00 0.00 O ATOM 0 H SER A 113 12.077 -0.711 -3.227 1.00 0.00 H new ATOM 0 HA SER A 113 10.591 -2.790 -4.670 1.00 0.00 H new ATOM 0 HB2 SER A 113 12.983 -3.817 -3.309 1.00 0.00 H new ATOM 0 HB3 SER A 113 12.285 -4.266 -4.852 1.00 0.00 H new ATOM 0 HG SER A 113 14.371 -3.274 -5.088 1.00 0.00 H new ATOM 1708 N VAL A 114 9.975 -3.847 -2.460 1.00 0.00 N ATOM 1709 CA VAL A 114 9.391 -4.239 -1.188 1.00 0.00 C ATOM 1710 C VAL A 114 9.409 -5.765 -1.072 1.00 0.00 C ATOM 1711 O VAL A 114 8.605 -6.448 -1.704 1.00 0.00 O ATOM 1712 CB VAL A 114 7.988 -3.646 -1.051 1.00 0.00 C ATOM 1713 CG1 VAL A 114 7.089 -4.090 -2.207 1.00 0.00 C ATOM 1714 CG2 VAL A 114 7.367 -4.013 0.299 1.00 0.00 C ATOM 0 H VAL A 114 9.669 -4.402 -3.259 1.00 0.00 H new ATOM 0 HA VAL A 114 9.979 -3.843 -0.360 1.00 0.00 H new ATOM 0 HB VAL A 114 8.078 -2.561 -1.095 1.00 0.00 H new ATOM 0 HG11 VAL A 114 6.097 -3.654 -2.085 1.00 0.00 H new ATOM 0 HG12 VAL A 114 7.519 -3.755 -3.151 1.00 0.00 H new ATOM 0 HG13 VAL A 114 7.010 -5.177 -2.209 1.00 0.00 H new ATOM 0 HG21 VAL A 114 6.370 -3.579 0.371 1.00 0.00 H new ATOM 0 HG22 VAL A 114 7.298 -5.097 0.385 1.00 0.00 H new ATOM 0 HG23 VAL A 114 7.991 -3.624 1.104 1.00 0.00 H new ATOM 1724 N ASN A 115 10.335 -6.254 -0.261 1.00 0.00 N ATOM 1725 CA ASN A 115 10.468 -7.686 -0.054 1.00 0.00 C ATOM 1726 C ASN A 115 11.164 -8.310 -1.266 1.00 0.00 C ATOM 1727 O ASN A 115 10.906 -9.462 -1.610 1.00 0.00 O ATOM 1728 CB ASN A 115 9.098 -8.351 0.097 1.00 0.00 C ATOM 1729 CG ASN A 115 8.170 -7.502 0.969 1.00 0.00 C ATOM 1730 OD1 ASN A 115 8.601 -6.697 1.779 1.00 0.00 O ATOM 1731 ND2 ASN A 115 6.876 -7.726 0.759 1.00 0.00 N ATOM 0 H ASN A 115 11.001 -5.684 0.261 1.00 0.00 H new ATOM 0 HA ASN A 115 11.047 -7.842 0.856 1.00 0.00 H new ATOM 0 HB2 ASN A 115 8.649 -8.494 -0.886 1.00 0.00 H new ATOM 0 HB3 ASN A 115 9.216 -9.340 0.541 1.00 0.00 H new ATOM 0 HD21 ASN A 115 6.176 -7.209 1.292 1.00 0.00 H new ATOM 0 HD22 ASN A 115 6.584 -8.414 0.065 1.00 0.00 H new ATOM 1738 N LYS A 116 12.033 -7.520 -1.880 1.00 0.00 N ATOM 1739 CA LYS A 116 12.768 -7.980 -3.045 1.00 0.00 C ATOM 1740 C LYS A 116 11.823 -8.043 -4.247 1.00 0.00 C ATOM 1741 O LYS A 116 12.054 -8.806 -5.183 1.00 0.00 O ATOM 1742 CB LYS A 116 13.473 -9.305 -2.746 1.00 0.00 C ATOM 1743 CG LYS A 116 14.977 -9.096 -2.560 1.00 0.00 C ATOM 1744 CD LYS A 116 15.766 -10.297 -3.086 1.00 0.00 C ATOM 1745 CE LYS A 116 16.999 -9.843 -3.870 1.00 0.00 C ATOM 1746 NZ LYS A 116 18.220 -10.481 -3.330 1.00 0.00 N ATOM 0 H LYS A 116 12.244 -6.564 -1.592 1.00 0.00 H new ATOM 0 HA LYS A 116 13.560 -7.275 -3.298 1.00 0.00 H new ATOM 0 HB2 LYS A 116 13.050 -9.751 -1.846 1.00 0.00 H new ATOM 0 HB3 LYS A 116 13.298 -10.006 -3.562 1.00 0.00 H new ATOM 0 HG2 LYS A 116 15.290 -8.193 -3.084 1.00 0.00 H new ATOM 0 HG3 LYS A 116 15.199 -8.945 -1.504 1.00 0.00 H new ATOM 0 HD2 LYS A 116 16.073 -10.928 -2.252 1.00 0.00 H new ATOM 0 HD3 LYS A 116 15.127 -10.904 -3.727 1.00 0.00 H new ATOM 0 HE2 LYS A 116 16.883 -10.100 -4.923 1.00 0.00 H new ATOM 0 HE3 LYS A 116 17.093 -8.758 -3.815 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 19.048 -10.162 -3.873 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 18.338 -10.215 -2.331 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 18.134 -11.515 -3.405 1.00 0.00 H new ATOM 1760 N GLU A 117 10.778 -7.231 -4.181 1.00 0.00 N ATOM 1761 CA GLU A 117 9.797 -7.185 -5.251 1.00 0.00 C ATOM 1762 C GLU A 117 9.774 -5.795 -5.891 1.00 0.00 C ATOM 1763 O GLU A 117 9.914 -4.787 -5.200 1.00 0.00 O ATOM 1764 CB GLU A 117 8.409 -7.577 -4.740 1.00 0.00 C ATOM 1765 CG GLU A 117 8.306 -9.090 -4.540 1.00 0.00 C ATOM 1766 CD GLU A 117 7.122 -9.667 -5.318 1.00 0.00 C ATOM 1767 OE1 GLU A 117 5.980 -9.442 -4.862 1.00 0.00 O ATOM 1768 OE2 GLU A 117 7.385 -10.319 -6.352 1.00 0.00 O ATOM 0 H GLU A 117 10.590 -6.600 -3.402 1.00 0.00 H new ATOM 0 HA GLU A 117 10.085 -7.909 -6.013 1.00 0.00 H new ATOM 0 HB2 GLU A 117 8.207 -7.067 -3.798 1.00 0.00 H new ATOM 0 HB3 GLU A 117 7.650 -7.248 -5.450 1.00 0.00 H new ATOM 0 HG2 GLU A 117 9.229 -9.567 -4.869 1.00 0.00 H new ATOM 0 HG3 GLU A 117 8.192 -9.313 -3.479 1.00 0.00 H new ATOM 1775 N PRO A 118 9.591 -5.785 -7.238 1.00 0.00 N ATOM 1776 CA PRO A 118 9.547 -4.536 -7.979 1.00 0.00 C ATOM 1777 C PRO A 118 8.217 -3.814 -7.758 1.00 0.00 C ATOM 1778 O PRO A 118 7.153 -4.426 -7.839 1.00 0.00 O ATOM 1779 CB PRO A 118 9.776 -4.930 -9.429 1.00 0.00 C ATOM 1780 CG PRO A 118 9.476 -6.418 -9.509 1.00 0.00 C ATOM 1781 CD PRO A 118 9.421 -6.959 -8.090 1.00 0.00 C ATOM 0 HA PRO A 118 10.304 -3.825 -7.650 1.00 0.00 H new ATOM 0 HB2 PRO A 118 9.125 -4.364 -10.095 1.00 0.00 H new ATOM 0 HB3 PRO A 118 10.802 -4.721 -9.733 1.00 0.00 H new ATOM 0 HG2 PRO A 118 8.529 -6.589 -10.020 1.00 0.00 H new ATOM 0 HG3 PRO A 118 10.246 -6.932 -10.084 1.00 0.00 H new ATOM 0 HD2 PRO A 118 8.472 -7.457 -7.893 1.00 0.00 H new ATOM 0 HD3 PRO A 118 10.208 -7.692 -7.915 1.00 0.00 H new ATOM 1789 N VAL A 119 8.319 -2.522 -7.483 1.00 0.00 N ATOM 1790 CA VAL A 119 7.137 -1.710 -7.250 1.00 0.00 C ATOM 1791 C VAL A 119 6.673 -1.101 -8.575 1.00 0.00 C ATOM 1792 O VAL A 119 7.452 -0.995 -9.521 1.00 0.00 O ATOM 1793 CB VAL A 119 7.428 -0.658 -6.178 1.00 0.00 C ATOM 1794 CG1 VAL A 119 6.274 0.341 -6.062 1.00 0.00 C ATOM 1795 CG2 VAL A 119 7.720 -1.317 -4.828 1.00 0.00 C ATOM 0 H VAL A 119 9.203 -2.017 -7.416 1.00 0.00 H new ATOM 0 HA VAL A 119 6.320 -2.324 -6.871 1.00 0.00 H new ATOM 0 HB VAL A 119 8.318 -0.108 -6.482 1.00 0.00 H new ATOM 0 HG11 VAL A 119 6.506 1.078 -5.293 1.00 0.00 H new ATOM 0 HG12 VAL A 119 6.132 0.846 -7.018 1.00 0.00 H new ATOM 0 HG13 VAL A 119 5.360 -0.188 -5.793 1.00 0.00 H new ATOM 0 HG21 VAL A 119 7.924 -0.547 -4.084 1.00 0.00 H new ATOM 0 HG22 VAL A 119 6.857 -1.905 -4.516 1.00 0.00 H new ATOM 0 HG23 VAL A 119 8.588 -1.969 -4.922 1.00 0.00 H new ATOM 1805 N ALA A 120 5.406 -0.715 -8.600 1.00 0.00 N ATOM 1806 CA ALA A 120 4.829 -0.119 -9.793 1.00 0.00 C ATOM 1807 C ALA A 120 5.020 1.398 -9.743 1.00 0.00 C ATOM 1808 O ALA A 120 5.899 1.939 -10.413 1.00 0.00 O ATOM 1809 CB ALA A 120 3.355 -0.518 -9.901 1.00 0.00 C ATOM 0 H ALA A 120 4.763 -0.803 -7.813 1.00 0.00 H new ATOM 0 HA ALA A 120 5.333 -0.485 -10.688 1.00 0.00 H new ATOM 0 HB1 ALA A 120 2.922 -0.071 -10.796 1.00 0.00 H new ATOM 0 HB2 ALA A 120 3.275 -1.603 -9.962 1.00 0.00 H new ATOM 0 HB3 ALA A 120 2.817 -0.164 -9.022 1.00 0.00 H new ATOM 1815 N GLU A 121 4.182 2.042 -8.944 1.00 0.00 N ATOM 1816 CA GLU A 121 4.248 3.487 -8.798 1.00 0.00 C ATOM 1817 C GLU A 121 4.255 3.871 -7.317 1.00 0.00 C ATOM 1818 O GLU A 121 3.203 4.127 -6.733 1.00 0.00 O ATOM 1819 CB GLU A 121 3.092 4.165 -9.535 1.00 0.00 C ATOM 1820 CG GLU A 121 3.385 4.275 -11.033 1.00 0.00 C ATOM 1821 CD GLU A 121 2.194 4.875 -11.782 1.00 0.00 C ATOM 1822 OE1 GLU A 121 2.092 6.120 -11.781 1.00 0.00 O ATOM 1823 OE2 GLU A 121 1.412 4.074 -12.340 1.00 0.00 O ATOM 0 H GLU A 121 3.454 1.590 -8.391 1.00 0.00 H new ATOM 0 HA GLU A 121 5.177 3.837 -9.248 1.00 0.00 H new ATOM 0 HB2 GLU A 121 2.175 3.596 -9.381 1.00 0.00 H new ATOM 0 HB3 GLU A 121 2.924 5.159 -9.120 1.00 0.00 H new ATOM 0 HG2 GLU A 121 4.268 4.895 -11.190 1.00 0.00 H new ATOM 0 HG3 GLU A 121 3.613 3.288 -11.436 1.00 0.00 H new ATOM 1830 N PRO A 122 5.485 3.900 -6.737 1.00 0.00 N ATOM 1831 CA PRO A 122 5.643 4.249 -5.335 1.00 0.00 C ATOM 1832 C PRO A 122 5.468 5.754 -5.121 1.00 0.00 C ATOM 1833 O PRO A 122 5.262 6.500 -6.077 1.00 0.00 O ATOM 1834 CB PRO A 122 7.029 3.752 -4.960 1.00 0.00 C ATOM 1835 CG PRO A 122 7.774 3.564 -6.272 1.00 0.00 C ATOM 1836 CD PRO A 122 6.752 3.602 -7.397 1.00 0.00 C ATOM 0 HA PRO A 122 4.885 3.791 -4.699 1.00 0.00 H new ATOM 0 HB2 PRO A 122 7.541 4.470 -4.320 1.00 0.00 H new ATOM 0 HB3 PRO A 122 6.971 2.815 -4.406 1.00 0.00 H new ATOM 0 HG2 PRO A 122 8.518 4.350 -6.405 1.00 0.00 H new ATOM 0 HG3 PRO A 122 8.310 2.615 -6.274 1.00 0.00 H new ATOM 0 HD2 PRO A 122 7.003 4.364 -8.134 1.00 0.00 H new ATOM 0 HD3 PRO A 122 6.709 2.649 -7.925 1.00 0.00 H new ATOM 1844 N ASP A 123 5.558 6.154 -3.862 1.00 0.00 N ATOM 1845 CA ASP A 123 5.413 7.557 -3.511 1.00 0.00 C ATOM 1846 C ASP A 123 3.961 7.986 -3.733 1.00 0.00 C ATOM 1847 O ASP A 123 3.693 8.900 -4.512 1.00 0.00 O ATOM 1848 CB ASP A 123 6.306 8.439 -4.385 1.00 0.00 C ATOM 1849 CG ASP A 123 7.758 7.971 -4.504 1.00 0.00 C ATOM 1850 OD1 ASP A 123 8.323 7.600 -3.453 1.00 0.00 O ATOM 1851 OD2 ASP A 123 8.270 7.996 -5.644 1.00 0.00 O ATOM 0 H ASP A 123 5.729 5.532 -3.072 1.00 0.00 H new ATOM 0 HA ASP A 123 5.702 7.675 -2.467 1.00 0.00 H new ATOM 0 HB2 ASP A 123 5.874 8.491 -5.384 1.00 0.00 H new ATOM 0 HB3 ASP A 123 6.298 9.451 -3.981 1.00 0.00 H new ATOM 1856 N ILE A 124 3.063 7.307 -3.035 1.00 0.00 N ATOM 1857 CA ILE A 124 1.646 7.607 -3.147 1.00 0.00 C ATOM 1858 C ILE A 124 1.156 8.230 -1.838 1.00 0.00 C ATOM 1859 O ILE A 124 0.773 7.517 -0.912 1.00 0.00 O ATOM 1860 CB ILE A 124 0.865 6.359 -3.564 1.00 0.00 C ATOM 1861 CG1 ILE A 124 1.575 5.624 -4.703 1.00 0.00 C ATOM 1862 CG2 ILE A 124 -0.580 6.711 -3.922 1.00 0.00 C ATOM 1863 CD1 ILE A 124 1.037 4.200 -4.855 1.00 0.00 C ATOM 0 H ILE A 124 3.289 6.550 -2.390 1.00 0.00 H new ATOM 0 HA ILE A 124 1.473 8.341 -3.934 1.00 0.00 H new ATOM 0 HB ILE A 124 0.829 5.678 -2.714 1.00 0.00 H new ATOM 0 HG12 ILE A 124 1.436 6.171 -5.636 1.00 0.00 H new ATOM 0 HG13 ILE A 124 2.647 5.593 -4.508 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -1.113 5.806 -4.215 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -1.071 7.157 -3.057 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -0.587 7.420 -4.750 1.00 0.00 H new ATOM 0 HD11 ILE A 124 1.558 3.699 -5.671 1.00 0.00 H new ATOM 0 HD12 ILE A 124 1.199 3.649 -3.929 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -0.030 4.236 -5.074 1.00 0.00 H new ATOM 1875 N MET A 125 1.184 9.554 -1.803 1.00 0.00 N ATOM 1876 CA MET A 125 0.748 10.281 -0.623 1.00 0.00 C ATOM 1877 C MET A 125 -0.764 10.149 -0.426 1.00 0.00 C ATOM 1878 O MET A 125 -1.543 10.532 -1.297 1.00 0.00 O ATOM 1879 CB MET A 125 1.117 11.759 -0.768 1.00 0.00 C ATOM 1880 CG MET A 125 2.540 12.020 -0.268 1.00 0.00 C ATOM 1881 SD MET A 125 2.490 12.836 1.318 1.00 0.00 S ATOM 1882 CE MET A 125 2.359 11.417 2.393 1.00 0.00 C ATOM 0 H MET A 125 1.502 10.142 -2.573 1.00 0.00 H new ATOM 0 HA MET A 125 1.248 9.857 0.248 1.00 0.00 H new ATOM 0 HB2 MET A 125 1.034 12.057 -1.813 1.00 0.00 H new ATOM 0 HB3 MET A 125 0.412 12.371 -0.205 1.00 0.00 H new ATOM 0 HG2 MET A 125 3.083 11.079 -0.185 1.00 0.00 H new ATOM 0 HG3 MET A 125 3.079 12.637 -0.987 1.00 0.00 H new ATOM 0 HE1 MET A 125 2.512 11.728 3.426 1.00 0.00 H new ATOM 0 HE2 MET A 125 1.369 10.973 2.291 1.00 0.00 H new ATOM 0 HE3 MET A 125 3.116 10.682 2.119 1.00 0.00 H new ATOM 1892 N ALA A 126 -1.133 9.606 0.725 1.00 0.00 N ATOM 1893 CA ALA A 126 -2.537 9.419 1.048 1.00 0.00 C ATOM 1894 C ALA A 126 -3.020 10.593 1.903 1.00 0.00 C ATOM 1895 O ALA A 126 -2.334 11.608 2.015 1.00 0.00 O ATOM 1896 CB ALA A 126 -2.725 8.072 1.748 1.00 0.00 C ATOM 0 H ALA A 126 -0.484 9.290 1.445 1.00 0.00 H new ATOM 0 HA ALA A 126 -3.141 9.402 0.140 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -3.778 7.932 1.990 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -2.395 7.270 1.088 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -2.136 8.053 2.665 1.00 0.00 H new ATOM 1902 N THR A 127 -4.198 10.415 2.483 1.00 0.00 N ATOM 1903 CA THR A 127 -4.780 11.447 3.325 1.00 0.00 C ATOM 1904 C THR A 127 -4.429 11.199 4.793 1.00 0.00 C ATOM 1905 O THR A 127 -4.818 11.972 5.667 1.00 0.00 O ATOM 1906 CB THR A 127 -6.286 11.480 3.057 1.00 0.00 C ATOM 1907 OG1 THR A 127 -6.559 12.850 2.778 1.00 0.00 O ATOM 1908 CG2 THR A 127 -7.111 11.184 4.312 1.00 0.00 C ATOM 0 H THR A 127 -4.765 9.572 2.387 1.00 0.00 H new ATOM 0 HA THR A 127 -4.371 12.429 3.088 1.00 0.00 H new ATOM 0 HB THR A 127 -6.532 10.755 2.281 1.00 0.00 H new ATOM 0 HG1 THR A 127 -7.514 12.962 2.591 1.00 0.00 H new ATOM 0 HG21 THR A 127 -8.172 11.220 4.067 1.00 0.00 H new ATOM 0 HG22 THR A 127 -6.859 10.192 4.688 1.00 0.00 H new ATOM 0 HG23 THR A 127 -6.890 11.929 5.077 1.00 0.00 H new ATOM 1916 N ASN A 128 -3.698 10.117 5.019 1.00 0.00 N ATOM 1917 CA ASN A 128 -3.290 9.758 6.367 1.00 0.00 C ATOM 1918 C ASN A 128 -2.281 8.610 6.300 1.00 0.00 C ATOM 1919 O ASN A 128 -2.293 7.718 7.147 1.00 0.00 O ATOM 1920 CB ASN A 128 -4.486 9.288 7.197 1.00 0.00 C ATOM 1921 CG ASN A 128 -5.102 8.020 6.604 1.00 0.00 C ATOM 1922 OD1 ASN A 128 -6.358 8.168 6.195 1.00 0.00 O flip ATOM 1923 ND2 ASN A 128 -4.477 6.975 6.523 1.00 0.00 N flip ATOM 0 H ASN A 128 -3.378 9.478 4.292 1.00 0.00 H new ATOM 0 HA ASN A 128 -2.851 10.640 6.834 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -4.169 9.097 8.222 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -5.237 10.077 7.237 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -3.514 6.929 6.856 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -4.917 6.147 6.122 1.00 0.00 H new ATOM 1930 N GLY A 129 -1.431 8.670 5.286 1.00 0.00 N ATOM 1931 CA GLY A 129 -0.417 7.646 5.098 1.00 0.00 C ATOM 1932 C GLY A 129 0.146 7.687 3.675 1.00 0.00 C ATOM 1933 O GLY A 129 0.051 8.707 2.995 1.00 0.00 O ATOM 0 H GLY A 129 -1.423 9.412 4.586 1.00 0.00 H new ATOM 0 HA2 GLY A 129 0.390 7.792 5.816 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -0.846 6.664 5.295 1.00 0.00 H new ATOM 1937 N VAL A 130 0.719 6.563 3.268 1.00 0.00 N ATOM 1938 CA VAL A 130 1.296 6.457 1.939 1.00 0.00 C ATOM 1939 C VAL A 130 0.905 5.112 1.324 1.00 0.00 C ATOM 1940 O VAL A 130 0.357 4.249 2.007 1.00 0.00 O ATOM 1941 CB VAL A 130 2.810 6.666 2.008 1.00 0.00 C ATOM 1942 CG1 VAL A 130 3.524 5.372 2.406 1.00 0.00 C ATOM 1943 CG2 VAL A 130 3.351 7.205 0.683 1.00 0.00 C ATOM 0 H VAL A 130 0.796 5.719 3.835 1.00 0.00 H new ATOM 0 HA VAL A 130 0.903 7.238 1.288 1.00 0.00 H new ATOM 0 HB VAL A 130 3.010 7.411 2.778 1.00 0.00 H new ATOM 0 HG11 VAL A 130 4.599 5.548 2.448 1.00 0.00 H new ATOM 0 HG12 VAL A 130 3.171 5.048 3.385 1.00 0.00 H new ATOM 0 HG13 VAL A 130 3.311 4.598 1.669 1.00 0.00 H new ATOM 0 HG21 VAL A 130 4.429 7.344 0.760 1.00 0.00 H new ATOM 0 HG22 VAL A 130 3.133 6.495 -0.115 1.00 0.00 H new ATOM 0 HG23 VAL A 130 2.877 8.160 0.458 1.00 0.00 H new ATOM 1953 N VAL A 131 1.203 4.976 0.040 1.00 0.00 N ATOM 1954 CA VAL A 131 0.890 3.751 -0.675 1.00 0.00 C ATOM 1955 C VAL A 131 1.957 3.501 -1.743 1.00 0.00 C ATOM 1956 O VAL A 131 2.566 4.443 -2.249 1.00 0.00 O ATOM 1957 CB VAL A 131 -0.526 3.828 -1.252 1.00 0.00 C ATOM 1958 CG1 VAL A 131 -0.732 2.775 -2.342 1.00 0.00 C ATOM 1959 CG2 VAL A 131 -1.576 3.688 -0.148 1.00 0.00 C ATOM 0 H VAL A 131 1.658 5.694 -0.523 1.00 0.00 H new ATOM 0 HA VAL A 131 0.904 2.899 0.005 1.00 0.00 H new ATOM 0 HB VAL A 131 -0.649 4.810 -1.708 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -1.746 2.852 -2.735 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -0.017 2.941 -3.148 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -0.580 1.781 -1.921 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -2.573 3.746 -0.585 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -1.454 2.726 0.351 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -1.450 4.492 0.578 1.00 0.00 H new ATOM 1969 N HIS A 132 2.151 2.228 -2.054 1.00 0.00 N ATOM 1970 CA HIS A 132 3.134 1.843 -3.052 1.00 0.00 C ATOM 1971 C HIS A 132 2.563 0.728 -3.931 1.00 0.00 C ATOM 1972 O HIS A 132 2.588 -0.441 -3.551 1.00 0.00 O ATOM 1973 CB HIS A 132 4.458 1.456 -2.390 1.00 0.00 C ATOM 1974 CG HIS A 132 4.969 2.474 -1.398 1.00 0.00 C ATOM 1975 ND1 HIS A 132 5.519 3.684 -1.781 1.00 0.00 N ATOM 1976 CD2 HIS A 132 5.006 2.448 -0.034 1.00 0.00 C ATOM 1977 CE1 HIS A 132 5.869 4.349 -0.690 1.00 0.00 C ATOM 1978 NE2 HIS A 132 5.551 3.581 0.391 1.00 0.00 N ATOM 0 H HIS A 132 1.644 1.450 -1.632 1.00 0.00 H new ATOM 0 HA HIS A 132 3.353 2.693 -3.699 1.00 0.00 H new ATOM 0 HB2 HIS A 132 4.333 0.500 -1.882 1.00 0.00 H new ATOM 0 HB3 HIS A 132 5.211 1.309 -3.165 1.00 0.00 H new ATOM 0 HD2 HIS A 132 4.652 1.643 0.593 1.00 0.00 H new ATOM 0 HE1 HIS A 132 6.326 5.327 -0.662 1.00 0.00 H new ATOM 0 HE2 HIS A 132 5.707 3.836 1.366 1.00 0.00 H new ATOM 1986 N VAL A 133 2.062 1.131 -5.090 1.00 0.00 N ATOM 1987 CA VAL A 133 1.486 0.181 -6.026 1.00 0.00 C ATOM 1988 C VAL A 133 2.557 -0.829 -6.445 1.00 0.00 C ATOM 1989 O VAL A 133 3.591 -0.451 -6.995 1.00 0.00 O ATOM 1990 CB VAL A 133 0.869 0.924 -7.212 1.00 0.00 C ATOM 1991 CG1 VAL A 133 0.291 -0.058 -8.234 1.00 0.00 C ATOM 1992 CG2 VAL A 133 -0.196 1.917 -6.743 1.00 0.00 C ATOM 0 H VAL A 133 2.043 2.102 -5.402 1.00 0.00 H new ATOM 0 HA VAL A 133 0.678 -0.378 -5.554 1.00 0.00 H new ATOM 0 HB VAL A 133 1.662 1.489 -7.702 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -0.141 0.496 -9.067 1.00 0.00 H new ATOM 0 HG12 VAL A 133 1.084 -0.708 -8.603 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -0.482 -0.663 -7.760 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -0.619 2.432 -7.606 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -0.986 1.381 -6.217 1.00 0.00 H new ATOM 0 HG23 VAL A 133 0.257 2.646 -6.072 1.00 0.00 H new ATOM 2002 N ILE A 134 2.272 -2.093 -6.171 1.00 0.00 N ATOM 2003 CA ILE A 134 3.198 -3.160 -6.512 1.00 0.00 C ATOM 2004 C ILE A 134 2.751 -3.818 -7.819 1.00 0.00 C ATOM 2005 O ILE A 134 1.659 -3.544 -8.315 1.00 0.00 O ATOM 2006 CB ILE A 134 3.339 -4.141 -5.347 1.00 0.00 C ATOM 2007 CG1 ILE A 134 2.031 -4.250 -4.560 1.00 0.00 C ATOM 2008 CG2 ILE A 134 4.518 -3.760 -4.449 1.00 0.00 C ATOM 2009 CD1 ILE A 134 2.008 -5.519 -3.707 1.00 0.00 C ATOM 0 H ILE A 134 1.413 -2.403 -5.717 1.00 0.00 H new ATOM 0 HA ILE A 134 4.197 -2.758 -6.682 1.00 0.00 H new ATOM 0 HB ILE A 134 3.552 -5.129 -5.756 1.00 0.00 H new ATOM 0 HG12 ILE A 134 1.914 -3.375 -3.920 1.00 0.00 H new ATOM 0 HG13 ILE A 134 1.187 -4.256 -5.250 1.00 0.00 H new ATOM 0 HG21 ILE A 134 4.596 -4.473 -3.629 1.00 0.00 H new ATOM 0 HG22 ILE A 134 5.439 -3.775 -5.032 1.00 0.00 H new ATOM 0 HG23 ILE A 134 4.360 -2.760 -4.046 1.00 0.00 H new ATOM 0 HD11 ILE A 134 1.068 -5.572 -3.158 1.00 0.00 H new ATOM 0 HD12 ILE A 134 2.101 -6.393 -4.352 1.00 0.00 H new ATOM 0 HD13 ILE A 134 2.839 -5.498 -3.002 1.00 0.00 H new ATOM 2021 N THR A 135 3.618 -4.674 -8.340 1.00 0.00 N ATOM 2022 CA THR A 135 3.326 -5.374 -9.580 1.00 0.00 C ATOM 2023 C THR A 135 3.258 -6.883 -9.338 1.00 0.00 C ATOM 2024 O THR A 135 3.535 -7.673 -10.239 1.00 0.00 O ATOM 2025 CB THR A 135 4.383 -4.971 -10.610 1.00 0.00 C ATOM 2026 OG1 THR A 135 5.622 -5.229 -9.956 1.00 0.00 O ATOM 2027 CG2 THR A 135 4.405 -3.463 -10.867 1.00 0.00 C ATOM 0 H THR A 135 4.523 -4.899 -7.926 1.00 0.00 H new ATOM 0 HA THR A 135 2.347 -5.095 -9.970 1.00 0.00 H new ATOM 0 HB THR A 135 4.195 -5.496 -11.546 1.00 0.00 H new ATOM 0 HG1 THR A 135 6.362 -4.997 -10.554 1.00 0.00 H new ATOM 0 HG21 THR A 135 5.173 -3.231 -11.605 1.00 0.00 H new ATOM 0 HG22 THR A 135 3.433 -3.144 -11.242 1.00 0.00 H new ATOM 0 HG23 THR A 135 4.626 -2.939 -9.937 1.00 0.00 H new ATOM 2035 N ASN A 136 2.887 -7.237 -8.116 1.00 0.00 N ATOM 2036 CA ASN A 136 2.779 -8.638 -7.744 1.00 0.00 C ATOM 2037 C ASN A 136 2.329 -8.740 -6.285 1.00 0.00 C ATOM 2038 O ASN A 136 2.713 -7.919 -5.454 1.00 0.00 O ATOM 2039 CB ASN A 136 4.128 -9.348 -7.873 1.00 0.00 C ATOM 2040 CG ASN A 136 5.271 -8.337 -7.984 1.00 0.00 C ATOM 2041 OD1 ASN A 136 5.401 -7.417 -7.193 1.00 0.00 O ATOM 2042 ND2 ASN A 136 6.090 -8.557 -9.009 1.00 0.00 N ATOM 0 H ASN A 136 2.658 -6.579 -7.371 1.00 0.00 H new ATOM 0 HA ASN A 136 2.058 -9.110 -8.412 1.00 0.00 H new ATOM 0 HB2 ASN A 136 4.289 -9.991 -7.008 1.00 0.00 H new ATOM 0 HB3 ASN A 136 4.121 -9.993 -8.752 1.00 0.00 H new ATOM 0 HD21 ASN A 136 6.884 -7.937 -9.170 1.00 0.00 H new ATOM 0 HD22 ASN A 136 5.924 -9.346 -9.634 1.00 0.00 H new ATOM 2049 N VAL A 137 1.519 -9.755 -6.019 1.00 0.00 N ATOM 2050 CA VAL A 137 1.012 -9.975 -4.675 1.00 0.00 C ATOM 2051 C VAL A 137 2.143 -10.497 -3.787 1.00 0.00 C ATOM 2052 O VAL A 137 2.664 -11.587 -4.016 1.00 0.00 O ATOM 2053 CB VAL A 137 -0.195 -10.914 -4.719 1.00 0.00 C ATOM 2054 CG1 VAL A 137 -0.639 -11.302 -3.307 1.00 0.00 C ATOM 2055 CG2 VAL A 137 -1.349 -10.287 -5.504 1.00 0.00 C ATOM 0 H VAL A 137 1.202 -10.434 -6.711 1.00 0.00 H new ATOM 0 HA VAL A 137 0.663 -9.038 -4.240 1.00 0.00 H new ATOM 0 HB VAL A 137 0.107 -11.824 -5.237 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -1.498 -11.970 -3.366 1.00 0.00 H new ATOM 0 HG12 VAL A 137 0.179 -11.808 -2.795 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -0.914 -10.405 -2.753 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -2.194 -10.975 -5.520 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -1.649 -9.354 -5.027 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -1.027 -10.084 -6.525 1.00 0.00 H new ATOM 2065 N LEU A 138 2.490 -9.693 -2.792 1.00 0.00 N ATOM 2066 CA LEU A 138 3.550 -10.060 -1.868 1.00 0.00 C ATOM 2067 C LEU A 138 3.115 -11.284 -1.060 1.00 0.00 C ATOM 2068 O LEU A 138 1.934 -11.628 -1.034 1.00 0.00 O ATOM 2069 CB LEU A 138 3.946 -8.862 -1.004 1.00 0.00 C ATOM 2070 CG LEU A 138 4.371 -7.601 -1.760 1.00 0.00 C ATOM 2071 CD1 LEU A 138 4.267 -6.364 -0.865 1.00 0.00 C ATOM 2072 CD2 LEU A 138 5.772 -7.763 -2.352 1.00 0.00 C ATOM 0 H LEU A 138 2.056 -8.789 -2.606 1.00 0.00 H new ATOM 0 HA LEU A 138 4.451 -10.341 -2.414 1.00 0.00 H new ATOM 0 HB2 LEU A 138 3.103 -8.609 -0.360 1.00 0.00 H new ATOM 0 HB3 LEU A 138 4.766 -9.164 -0.352 1.00 0.00 H new ATOM 0 HG LEU A 138 3.684 -7.455 -2.593 1.00 0.00 H new ATOM 0 HD11 LEU A 138 4.575 -5.482 -1.426 1.00 0.00 H new ATOM 0 HD12 LEU A 138 3.236 -6.241 -0.532 1.00 0.00 H new ATOM 0 HD13 LEU A 138 4.916 -6.487 0.002 1.00 0.00 H new ATOM 0 HD21 LEU A 138 6.050 -6.853 -2.884 1.00 0.00 H new ATOM 0 HD22 LEU A 138 6.487 -7.947 -1.550 1.00 0.00 H new ATOM 0 HD23 LEU A 138 5.779 -8.605 -3.045 1.00 0.00 H new ATOM 2084 N GLN A 139 4.092 -11.909 -0.420 1.00 0.00 N ATOM 2085 CA GLN A 139 3.825 -13.087 0.387 1.00 0.00 C ATOM 2086 C GLN A 139 4.625 -13.031 1.690 1.00 0.00 C ATOM 2087 O GLN A 139 5.679 -12.399 1.749 1.00 0.00 O ATOM 2088 CB GLN A 139 4.135 -14.367 -0.392 1.00 0.00 C ATOM 2089 CG GLN A 139 3.026 -14.679 -1.399 1.00 0.00 C ATOM 2090 CD GLN A 139 3.323 -15.973 -2.159 1.00 0.00 C ATOM 2091 OE1 GLN A 139 4.154 -16.776 -1.767 1.00 0.00 O ATOM 2092 NE2 GLN A 139 2.600 -16.129 -3.264 1.00 0.00 N ATOM 0 H GLN A 139 5.070 -11.622 -0.444 1.00 0.00 H new ATOM 0 HA GLN A 139 2.764 -13.100 0.636 1.00 0.00 H new ATOM 0 HB2 GLN A 139 5.085 -14.258 -0.915 1.00 0.00 H new ATOM 0 HB3 GLN A 139 4.247 -15.201 0.301 1.00 0.00 H new ATOM 0 HG2 GLN A 139 2.072 -14.769 -0.879 1.00 0.00 H new ATOM 0 HG3 GLN A 139 2.927 -13.854 -2.104 1.00 0.00 H new ATOM 0 HE21 GLN A 139 1.921 -15.417 -3.534 1.00 0.00 H new ATOM 0 HE22 GLN A 139 2.724 -16.961 -3.842 1.00 0.00 H new ATOM 2101 N PRO A 140 4.080 -13.717 2.730 1.00 0.00 N ATOM 2102 CA PRO A 140 4.731 -13.751 4.028 1.00 0.00 C ATOM 2103 C PRO A 140 5.947 -14.680 4.008 1.00 0.00 C ATOM 2104 O PRO A 140 6.126 -15.452 3.067 1.00 0.00 O ATOM 2105 CB PRO A 140 3.652 -14.206 4.998 1.00 0.00 C ATOM 2106 CG PRO A 140 2.573 -14.854 4.146 1.00 0.00 C ATOM 2107 CD PRO A 140 2.833 -14.477 2.697 1.00 0.00 C ATOM 0 HA PRO A 140 5.130 -12.781 4.323 1.00 0.00 H new ATOM 0 HB2 PRO A 140 4.053 -14.913 5.725 1.00 0.00 H new ATOM 0 HB3 PRO A 140 3.252 -13.363 5.561 1.00 0.00 H new ATOM 0 HG2 PRO A 140 2.590 -15.937 4.267 1.00 0.00 H new ATOM 0 HG3 PRO A 140 1.585 -14.514 4.457 1.00 0.00 H new ATOM 0 HD2 PRO A 140 2.925 -15.362 2.068 1.00 0.00 H new ATOM 0 HD3 PRO A 140 2.016 -13.881 2.290 1.00 0.00 H new