USER MOD reduce.3.24.130724 H: found=0, std=0, add=880, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 879 hydrogens (32 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: A 18 HIS HE2 : A 18 HIS NE2 : A 105 HECFE :(H bumps) USER MOD NoAdj-H: A 105 HEC HAC : A 105 HEC CAC : A 17 CYS SG :(H bumps) USER MOD NoAdj-H: A 105 HEC HAB : A 105 HEC CAB : A 14 CYS SG :(H bumps) USER MOD NoAdj-H: A 105 HEC H2A : A 105 HEC O2A : A 105 HEC CGA :(short bond) USER MOD Set 1.1: A 87 LYS NZ :NH3+ -160:sc= 1.19 (180deg=0) USER MOD Set 1.2: A 89 THR OG1 : rot -154:sc= 1.01 USER MOD Set 2.1: A 49 THR OG1 : rot 67:sc= 2.15 USER MOD Set 2.2: A 52 ASN : amide:sc= -0.379 K(o=4.9,f=3.2) USER MOD Set 2.3: A 78 THR OG1 : rot -56:sc= 1.26 USER MOD Set 2.4: A 105 HEC O2D : rot -176:sc= 1.89 USER MOD Set 3.1: A 33 HIS : no HE2:sc= -0.33 K(o=-1.1,f=-13!) USER MOD Set 3.2: A 53 LYS NZ :NH3+ -161:sc= -0.804! (180deg=-1.33) USER MOD Set 4.1: A 8 LYS NZ :NH3+ -165:sc= 1.3 (180deg=0) USER MOD Set 4.2: A 12 GLN : amide:sc= 1.03 K(o=2.3,f=-8.2!) USER MOD Single : A 1 GLY N :NH3+ 141:sc= 2.31 (180deg=0.861) USER MOD Single : A 5 LYS NZ :NH3+ 171:sc= 1.24 (180deg=1.08) USER MOD Single : A 7 LYS NZ :NH3+ -169:sc= 1.27 (180deg=1.13) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 GLN : amide:sc= -0.0367 K(o=-0.037,f=-2.9!) USER MOD Single : A 19 THR OG1 : rot 168:sc= 0.723 USER MOD Single : A 22 LYS NZ :NH3+ -147:sc= 1.12 (180deg=-0.0909) USER MOD Single : A 25 LYS NZ :NH3+ -171:sc= 1.23 (180deg=1.23) USER MOD Single : A 26 HIS : no HE2:sc= 0.334 K(o=0.33,f=-2.6!) USER MOD Single : A 27 LYS NZ :NH3+ -137:sc= -0.0428 (180deg=-1.11) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 ASN : amide:sc= 0.702 K(o=0.7,f=-4.6!) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 THR OG1 : rot 111:sc= 1.25 USER MOD Single : A 42 GLN : amide:sc= 0.316 K(o=0.32,f=-3) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 TYR OH : rot 161:sc= 1.29 USER MOD Single : A 54 ASN : amide:sc= 1.05 K(o=1.1,f=-1.5) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ -118:sc= 1.19 (180deg=0.362) USER MOD Single : A 63 THR OG1 : rot 175:sc= 1.18 USER MOD Single : A 65 MET CE :methyl -171:sc=-0.00701 (180deg=-0.135) USER MOD Single : A 67 TYR OH : rot -136:sc= 0.422 USER MOD Single : A 70 ASN : amide:sc= -0.355 X(o=-0.35,f=-0.35) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 162:sc= 1.24 (180deg=0.64) USER MOD Single : A 74 TYR OH : rot 30:sc= 0 USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 MET CE :methyl 162:sc= -0.389 (180deg=-1.76) USER MOD Single : A 86 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.0125) USER MOD Single : A 88 LYS NZ :NH3+ -164:sc= -0.101 (180deg=-0.617) USER MOD Single : A 97 TYR OH : rot 152:sc= 0.212 USER MOD Single : A 99 LYS NZ :NH3+ -176:sc= 1.72 (180deg=1.68) USER MOD Single : A 100 LYS NZ :NH3+ -167:sc= 0.988 (180deg=0.821) USER MOD Single : A 102 THR OG1 : rot 149:sc= 1.27 USER MOD Single : A 103 ASN : amide:sc= -0.519 X(o=-0.52,f=-0.063) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 1.764 1.668 -0.507 1.00 10.00 N ATOM 2 CA GLY A 1 1.566 0.416 0.253 1.00 10.00 C ATOM 3 C GLY A 1 0.953 0.598 1.641 1.00 10.00 C ATOM 4 O GLY A 1 1.582 0.185 2.609 1.00 10.00 O ATOM 0 H1 GLY A 1 2.665 1.621 -1.025 1.00 10.00 H new ATOM 0 H2 GLY A 1 0.983 1.792 -1.182 1.00 10.00 H new ATOM 0 H3 GLY A 1 1.784 2.474 0.150 1.00 10.00 H new ATOM 0 HA2 GLY A 1 0.925 -0.247 -0.328 1.00 10.00 H new ATOM 0 HA3 GLY A 1 2.529 -0.084 0.359 1.00 10.00 H new ATOM 10 N ASP A 2 -0.245 1.179 1.763 1.00 10.00 N ATOM 11 CA ASP A 2 -1.081 1.169 2.976 1.00 10.00 C ATOM 12 C ASP A 2 -1.864 -0.155 3.111 1.00 10.00 C ATOM 13 O ASP A 2 -2.053 -0.871 2.132 1.00 10.00 O ATOM 14 CB ASP A 2 -2.085 2.335 2.863 1.00 10.00 C ATOM 15 CG ASP A 2 -2.669 2.852 4.183 1.00 10.00 C ATOM 16 OD1 ASP A 2 -2.836 2.054 5.128 1.00 10.00 O ATOM 17 OD2 ASP A 2 -2.990 4.063 4.194 1.00 10.00 O ATOM 0 H ASP A 2 -0.678 1.689 0.993 1.00 10.00 H new ATOM 0 HA ASP A 2 -0.441 1.272 3.853 1.00 10.00 H new ATOM 0 HB2 ASP A 2 -1.591 3.165 2.358 1.00 10.00 H new ATOM 0 HB3 ASP A 2 -2.909 2.018 2.224 1.00 10.00 H new ATOM 22 N VAL A 3 -2.396 -0.437 4.303 1.00 10.00 N ATOM 23 CA VAL A 3 -3.499 -1.384 4.524 1.00 10.00 C ATOM 24 C VAL A 3 -4.838 -0.763 4.098 1.00 10.00 C ATOM 25 O VAL A 3 -5.592 -1.370 3.338 1.00 10.00 O ATOM 26 CB VAL A 3 -3.541 -1.836 6.001 1.00 10.00 C ATOM 27 CG1 VAL A 3 -4.732 -2.762 6.299 1.00 10.00 C ATOM 28 CG2 VAL A 3 -2.257 -2.595 6.369 1.00 10.00 C ATOM 0 H VAL A 3 -2.065 -0.004 5.165 1.00 10.00 H new ATOM 0 HA VAL A 3 -3.325 -2.266 3.907 1.00 10.00 H new ATOM 0 HB VAL A 3 -3.641 -0.926 6.593 1.00 10.00 H new ATOM 0 HG11 VAL A 3 -4.715 -3.050 7.350 1.00 10.00 H new ATOM 0 HG12 VAL A 3 -5.663 -2.239 6.082 1.00 10.00 H new ATOM 0 HG13 VAL A 3 -4.664 -3.654 5.677 1.00 10.00 H new ATOM 0 HG21 VAL A 3 -2.304 -2.906 7.413 1.00 10.00 H new ATOM 0 HG22 VAL A 3 -2.159 -3.475 5.733 1.00 10.00 H new ATOM 0 HG23 VAL A 3 -1.395 -1.944 6.223 1.00 10.00 H new ATOM 38 N GLU A 4 -5.155 0.451 4.555 1.00 10.00 N ATOM 39 CA GLU A 4 -6.487 1.045 4.382 1.00 10.00 C ATOM 40 C GLU A 4 -6.825 1.343 2.925 1.00 10.00 C ATOM 41 O GLU A 4 -7.867 0.902 2.433 1.00 10.00 O ATOM 42 CB GLU A 4 -6.619 2.279 5.268 1.00 10.00 C ATOM 43 CG GLU A 4 -7.256 1.993 6.633 1.00 10.00 C ATOM 44 CD GLU A 4 -6.817 0.668 7.270 1.00 10.00 C ATOM 45 OE1 GLU A 4 -5.709 0.631 7.845 1.00 10.00 O ATOM 46 OE2 GLU A 4 -7.604 -0.299 7.140 1.00 10.00 O ATOM 0 H GLU A 4 -4.498 1.051 5.055 1.00 10.00 H new ATOM 0 HA GLU A 4 -7.224 0.306 4.698 1.00 10.00 H new ATOM 0 HB2 GLU A 4 -5.631 2.712 5.422 1.00 10.00 H new ATOM 0 HB3 GLU A 4 -7.217 3.027 4.747 1.00 10.00 H new ATOM 0 HG2 GLU A 4 -7.011 2.808 7.313 1.00 10.00 H new ATOM 0 HG3 GLU A 4 -8.340 1.987 6.521 1.00 10.00 H new ATOM 53 N LYS A 5 -5.928 2.021 2.201 1.00 10.00 N ATOM 54 CA LYS A 5 -6.068 2.227 0.753 1.00 10.00 C ATOM 55 C LYS A 5 -6.179 0.892 0.002 1.00 10.00 C ATOM 56 O LYS A 5 -6.923 0.797 -0.974 1.00 10.00 O ATOM 57 CB LYS A 5 -4.886 3.045 0.216 1.00 10.00 C ATOM 58 CG LYS A 5 -4.650 4.340 1.008 1.00 10.00 C ATOM 59 CD LYS A 5 -3.472 5.143 0.445 1.00 10.00 C ATOM 60 CE LYS A 5 -3.178 6.342 1.354 1.00 10.00 C ATOM 61 NZ LYS A 5 -2.325 5.981 2.512 1.00 10.00 N ATOM 0 H LYS A 5 -5.088 2.441 2.599 1.00 10.00 H new ATOM 0 HA LYS A 5 -6.991 2.781 0.582 1.00 10.00 H new ATOM 0 HB2 LYS A 5 -3.983 2.435 0.248 1.00 10.00 H new ATOM 0 HB3 LYS A 5 -5.066 3.292 -0.830 1.00 10.00 H new ATOM 0 HG2 LYS A 5 -5.552 4.951 0.983 1.00 10.00 H new ATOM 0 HG3 LYS A 5 -4.458 4.097 2.053 1.00 10.00 H new ATOM 0 HD2 LYS A 5 -2.590 4.507 0.370 1.00 10.00 H new ATOM 0 HD3 LYS A 5 -3.704 5.487 -0.563 1.00 10.00 H new ATOM 0 HE2 LYS A 5 -2.686 7.122 0.773 1.00 10.00 H new ATOM 0 HE3 LYS A 5 -4.118 6.759 1.715 1.00 10.00 H new ATOM 0 HZ1 LYS A 5 -2.030 6.846 3.009 1.00 10.00 H new ATOM 0 HZ2 LYS A 5 -2.863 5.374 3.163 1.00 10.00 H new ATOM 0 HZ3 LYS A 5 -1.483 5.470 2.177 1.00 10.00 H new ATOM 75 N GLY A 6 -5.517 -0.152 0.518 1.00 10.00 N ATOM 76 CA GLY A 6 -5.520 -1.496 -0.050 1.00 10.00 C ATOM 77 C GLY A 6 -6.866 -2.175 0.146 1.00 10.00 C ATOM 78 O GLY A 6 -7.390 -2.774 -0.795 1.00 10.00 O ATOM 0 H GLY A 6 -4.952 -0.078 1.364 1.00 10.00 H new ATOM 0 HA2 GLY A 6 -5.288 -1.444 -1.114 1.00 10.00 H new ATOM 0 HA3 GLY A 6 -4.737 -2.093 0.418 1.00 10.00 H new ATOM 82 N LYS A 7 -7.483 -2.030 1.332 1.00 10.00 N ATOM 83 CA LYS A 7 -8.827 -2.550 1.542 1.00 10.00 C ATOM 84 C LYS A 7 -9.876 -1.762 0.753 1.00 10.00 C ATOM 85 O LYS A 7 -10.815 -2.354 0.229 1.00 10.00 O ATOM 86 CB LYS A 7 -9.134 -2.715 3.038 1.00 10.00 C ATOM 87 CG LYS A 7 -9.640 -1.495 3.815 1.00 10.00 C ATOM 88 CD LYS A 7 -10.917 -1.891 4.565 1.00 10.00 C ATOM 89 CE LYS A 7 -11.578 -0.721 5.286 1.00 10.00 C ATOM 90 NZ LYS A 7 -12.793 -1.200 5.983 1.00 10.00 N ATOM 0 H LYS A 7 -7.073 -1.564 2.141 1.00 10.00 H new ATOM 0 HA LYS A 7 -8.877 -3.557 1.128 1.00 10.00 H new ATOM 0 HB2 LYS A 7 -9.878 -3.506 3.139 1.00 10.00 H new ATOM 0 HB3 LYS A 7 -8.226 -3.067 3.527 1.00 10.00 H new ATOM 0 HG2 LYS A 7 -8.880 -1.151 4.517 1.00 10.00 H new ATOM 0 HG3 LYS A 7 -9.842 -0.669 3.133 1.00 10.00 H new ATOM 0 HD2 LYS A 7 -11.627 -2.322 3.859 1.00 10.00 H new ATOM 0 HD3 LYS A 7 -10.678 -2.668 5.291 1.00 10.00 H new ATOM 0 HE2 LYS A 7 -10.884 -0.281 6.002 1.00 10.00 H new ATOM 0 HE3 LYS A 7 -11.838 0.061 4.572 1.00 10.00 H new ATOM 0 HZ1 LYS A 7 -13.346 -0.385 6.317 1.00 10.00 H new ATOM 0 HZ2 LYS A 7 -13.370 -1.764 5.327 1.00 10.00 H new ATOM 0 HZ3 LYS A 7 -12.518 -1.788 6.795 1.00 10.00 H new ATOM 104 N LYS A 8 -9.668 -0.446 0.588 1.00 10.00 N ATOM 105 CA LYS A 8 -10.503 0.440 -0.229 1.00 10.00 C ATOM 106 C LYS A 8 -10.503 -0.025 -1.686 1.00 10.00 C ATOM 107 O LYS A 8 -11.575 -0.251 -2.239 1.00 10.00 O ATOM 108 CB LYS A 8 -10.043 1.902 -0.063 1.00 10.00 C ATOM 109 CG LYS A 8 -11.164 2.946 -0.210 1.00 10.00 C ATOM 110 CD LYS A 8 -11.832 3.076 -1.587 1.00 10.00 C ATOM 111 CE LYS A 8 -10.826 3.385 -2.700 1.00 10.00 C ATOM 112 NZ LYS A 8 -11.508 3.909 -3.904 1.00 10.00 N ATOM 0 H LYS A 8 -8.891 0.042 1.033 1.00 10.00 H new ATOM 0 HA LYS A 8 -11.537 0.392 0.114 1.00 10.00 H new ATOM 0 HB2 LYS A 8 -9.585 2.016 0.919 1.00 10.00 H new ATOM 0 HB3 LYS A 8 -9.269 2.112 -0.802 1.00 10.00 H new ATOM 0 HG2 LYS A 8 -11.939 2.713 0.520 1.00 10.00 H new ATOM 0 HG3 LYS A 8 -10.755 3.920 0.059 1.00 10.00 H new ATOM 0 HD2 LYS A 8 -12.356 2.149 -1.822 1.00 10.00 H new ATOM 0 HD3 LYS A 8 -12.582 3.866 -1.550 1.00 10.00 H new ATOM 0 HE2 LYS A 8 -10.098 4.114 -2.344 1.00 10.00 H new ATOM 0 HE3 LYS A 8 -10.273 2.481 -2.956 1.00 10.00 H new ATOM 0 HZ1 LYS A 8 -10.858 3.871 -4.715 1.00 10.00 H new ATOM 0 HZ2 LYS A 8 -12.349 3.331 -4.106 1.00 10.00 H new ATOM 0 HZ3 LYS A 8 -11.797 4.894 -3.738 1.00 10.00 H new ATOM 126 N ILE A 9 -9.324 -0.200 -2.300 1.00 10.00 N ATOM 127 CA ILE A 9 -9.239 -0.712 -3.673 1.00 10.00 C ATOM 128 C ILE A 9 -9.702 -2.178 -3.791 1.00 10.00 C ATOM 129 O ILE A 9 -10.361 -2.512 -4.780 1.00 10.00 O ATOM 130 CB ILE A 9 -7.852 -0.428 -4.300 1.00 10.00 C ATOM 131 CG1 ILE A 9 -7.834 -0.575 -5.834 1.00 10.00 C ATOM 132 CG2 ILE A 9 -6.739 -1.308 -3.725 1.00 10.00 C ATOM 133 CD1 ILE A 9 -8.753 0.417 -6.553 1.00 10.00 C ATOM 0 H ILE A 9 -8.422 0.004 -1.870 1.00 10.00 H new ATOM 0 HA ILE A 9 -9.955 -0.155 -4.277 1.00 10.00 H new ATOM 0 HB ILE A 9 -7.661 0.613 -4.038 1.00 10.00 H new ATOM 0 HG12 ILE A 9 -6.814 -0.438 -6.192 1.00 10.00 H new ATOM 0 HG13 ILE A 9 -8.131 -1.590 -6.097 1.00 10.00 H new ATOM 0 HG21 ILE A 9 -5.793 -1.059 -4.206 1.00 10.00 H new ATOM 0 HG22 ILE A 9 -6.657 -1.136 -2.652 1.00 10.00 H new ATOM 0 HG23 ILE A 9 -6.974 -2.357 -3.907 1.00 10.00 H new ATOM 0 HD11 ILE A 9 -8.690 0.257 -7.629 1.00 10.00 H new ATOM 0 HD12 ILE A 9 -9.781 0.266 -6.223 1.00 10.00 H new ATOM 0 HD13 ILE A 9 -8.443 1.435 -6.319 1.00 10.00 H new ATOM 145 N PHE A 10 -9.488 -3.031 -2.769 1.00 10.00 N ATOM 146 CA PHE A 10 -10.078 -4.374 -2.739 1.00 10.00 C ATOM 147 C PHE A 10 -11.599 -4.299 -2.859 1.00 10.00 C ATOM 148 O PHE A 10 -12.205 -4.894 -3.754 1.00 10.00 O ATOM 149 CB PHE A 10 -9.671 -5.194 -1.507 1.00 10.00 C ATOM 150 CG PHE A 10 -10.180 -6.639 -1.559 1.00 10.00 C ATOM 151 CD1 PHE A 10 -11.518 -6.953 -1.231 1.00 10.00 C ATOM 152 CD2 PHE A 10 -9.336 -7.677 -2.001 1.00 10.00 C ATOM 153 CE1 PHE A 10 -12.007 -8.266 -1.383 1.00 10.00 C ATOM 154 CE2 PHE A 10 -9.807 -8.996 -2.100 1.00 10.00 C ATOM 155 CZ PHE A 10 -11.148 -9.289 -1.815 1.00 10.00 C ATOM 0 H PHE A 10 -8.911 -2.809 -1.957 1.00 10.00 H new ATOM 0 HA PHE A 10 -9.675 -4.902 -3.603 1.00 10.00 H new ATOM 0 HB2 PHE A 10 -8.584 -5.199 -1.423 1.00 10.00 H new ATOM 0 HB3 PHE A 10 -10.058 -4.710 -0.610 1.00 10.00 H new ATOM 0 HD1 PHE A 10 -12.173 -6.179 -0.860 1.00 10.00 H new ATOM 0 HD2 PHE A 10 -8.313 -7.455 -2.267 1.00 10.00 H new ATOM 0 HE1 PHE A 10 -13.042 -8.485 -1.167 1.00 10.00 H new ATOM 0 HE2 PHE A 10 -9.134 -9.787 -2.397 1.00 10.00 H new ATOM 0 HZ PHE A 10 -11.519 -10.297 -1.927 1.00 10.00 H new ATOM 165 N VAL A 11 -12.228 -3.518 -1.980 1.00 10.00 N ATOM 166 CA VAL A 11 -13.680 -3.349 -1.951 1.00 10.00 C ATOM 167 C VAL A 11 -14.234 -2.685 -3.230 1.00 10.00 C ATOM 168 O VAL A 11 -15.440 -2.705 -3.463 1.00 10.00 O ATOM 169 CB VAL A 11 -14.068 -2.600 -0.651 1.00 10.00 C ATOM 170 CG1 VAL A 11 -15.511 -2.082 -0.580 1.00 10.00 C ATOM 171 CG2 VAL A 11 -13.859 -3.523 0.561 1.00 10.00 C ATOM 0 H VAL A 11 -11.740 -2.981 -1.263 1.00 10.00 H new ATOM 0 HA VAL A 11 -14.153 -4.331 -1.939 1.00 10.00 H new ATOM 0 HB VAL A 11 -13.418 -1.725 -0.646 1.00 10.00 H new ATOM 0 HG11 VAL A 11 -15.669 -1.576 0.372 1.00 10.00 H new ATOM 0 HG12 VAL A 11 -15.687 -1.382 -1.397 1.00 10.00 H new ATOM 0 HG13 VAL A 11 -16.203 -2.920 -0.665 1.00 10.00 H new ATOM 0 HG21 VAL A 11 -14.133 -2.993 1.473 1.00 10.00 H new ATOM 0 HG22 VAL A 11 -14.484 -4.410 0.455 1.00 10.00 H new ATOM 0 HG23 VAL A 11 -12.812 -3.821 0.615 1.00 10.00 H new ATOM 181 N GLN A 12 -13.359 -2.163 -4.096 1.00 10.00 N ATOM 182 CA GLN A 12 -13.707 -1.522 -5.360 1.00 10.00 C ATOM 183 C GLN A 12 -13.745 -2.537 -6.509 1.00 10.00 C ATOM 184 O GLN A 12 -14.721 -2.572 -7.253 1.00 10.00 O ATOM 185 CB GLN A 12 -12.689 -0.411 -5.674 1.00 10.00 C ATOM 186 CG GLN A 12 -13.272 0.690 -6.568 1.00 10.00 C ATOM 187 CD GLN A 12 -14.091 1.680 -5.749 1.00 10.00 C ATOM 188 OE1 GLN A 12 -13.545 2.466 -4.986 1.00 10.00 O ATOM 189 NE2 GLN A 12 -15.405 1.678 -5.866 1.00 10.00 N ATOM 0 H GLN A 12 -12.353 -2.178 -3.926 1.00 10.00 H new ATOM 0 HA GLN A 12 -14.703 -1.090 -5.261 1.00 10.00 H new ATOM 0 HB2 GLN A 12 -12.340 0.031 -4.741 1.00 10.00 H new ATOM 0 HB3 GLN A 12 -11.819 -0.849 -6.164 1.00 10.00 H new ATOM 0 HG2 GLN A 12 -12.465 1.215 -7.079 1.00 10.00 H new ATOM 0 HG3 GLN A 12 -13.900 0.243 -7.339 1.00 10.00 H new ATOM 0 HE21 GLN A 12 -15.859 1.023 -6.502 1.00 10.00 H new ATOM 0 HE22 GLN A 12 -15.967 2.332 -5.320 1.00 10.00 H new ATOM 198 N LYS A 13 -12.664 -3.319 -6.677 1.00 10.00 N ATOM 199 CA LYS A 13 -12.418 -4.151 -7.869 1.00 10.00 C ATOM 200 C LYS A 13 -11.952 -5.581 -7.603 1.00 10.00 C ATOM 201 O LYS A 13 -11.635 -6.314 -8.533 1.00 10.00 O ATOM 202 CB LYS A 13 -11.542 -3.388 -8.868 1.00 10.00 C ATOM 203 CG LYS A 13 -10.174 -2.952 -8.321 1.00 10.00 C ATOM 204 CD LYS A 13 -9.427 -2.078 -9.333 1.00 10.00 C ATOM 205 CE LYS A 13 -10.149 -0.746 -9.581 1.00 10.00 C ATOM 206 NZ LYS A 13 -9.345 0.154 -10.434 1.00 10.00 N ATOM 0 H LYS A 13 -11.925 -3.392 -5.978 1.00 10.00 H new ATOM 0 HA LYS A 13 -13.394 -4.324 -8.323 1.00 10.00 H new ATOM 0 HB2 LYS A 13 -11.384 -4.016 -9.745 1.00 10.00 H new ATOM 0 HB3 LYS A 13 -12.083 -2.503 -9.203 1.00 10.00 H new ATOM 0 HG2 LYS A 13 -10.310 -2.401 -7.391 1.00 10.00 H new ATOM 0 HG3 LYS A 13 -9.576 -3.832 -8.085 1.00 10.00 H new ATOM 0 HD2 LYS A 13 -8.418 -1.882 -8.969 1.00 10.00 H new ATOM 0 HD3 LYS A 13 -9.327 -2.618 -10.275 1.00 10.00 H new ATOM 0 HE2 LYS A 13 -11.112 -0.935 -10.056 1.00 10.00 H new ATOM 0 HE3 LYS A 13 -10.354 -0.259 -8.628 1.00 10.00 H new ATOM 0 HZ1 LYS A 13 -9.861 1.045 -10.582 1.00 10.00 H new ATOM 0 HZ2 LYS A 13 -8.437 0.354 -9.969 1.00 10.00 H new ATOM 0 HZ3 LYS A 13 -9.171 -0.302 -11.352 1.00 10.00 H new ATOM 220 N CYS A 14 -12.010 -6.008 -6.344 1.00 10.00 N ATOM 221 CA CYS A 14 -11.865 -7.395 -5.922 1.00 10.00 C ATOM 222 C CYS A 14 -13.183 -7.927 -5.343 1.00 10.00 C ATOM 223 O CYS A 14 -13.607 -9.032 -5.688 1.00 10.00 O ATOM 224 CB CYS A 14 -10.748 -7.455 -4.888 1.00 10.00 C ATOM 225 SG CYS A 14 -9.171 -6.671 -5.358 1.00 10.00 S ATOM 0 H CYS A 14 -12.165 -5.372 -5.562 1.00 10.00 H new ATOM 0 HA CYS A 14 -11.614 -8.025 -6.775 1.00 10.00 H new ATOM 0 HB2 CYS A 14 -11.104 -6.985 -3.972 1.00 10.00 H new ATOM 0 HB3 CYS A 14 -10.554 -8.502 -4.654 1.00 10.00 H new ATOM 230 N ALA A 15 -13.876 -7.118 -4.526 1.00 10.00 N ATOM 231 CA ALA A 15 -15.198 -7.458 -3.978 1.00 10.00 C ATOM 232 C ALA A 15 -16.298 -7.697 -5.039 1.00 10.00 C ATOM 233 O ALA A 15 -17.329 -8.294 -4.728 1.00 10.00 O ATOM 234 CB ALA A 15 -15.619 -6.379 -2.979 1.00 10.00 C ATOM 0 H ALA A 15 -13.533 -6.205 -4.226 1.00 10.00 H new ATOM 0 HA ALA A 15 -15.090 -8.421 -3.479 1.00 10.00 H new ATOM 0 HB1 ALA A 15 -16.598 -6.625 -2.569 1.00 10.00 H new ATOM 0 HB2 ALA A 15 -14.890 -6.327 -2.171 1.00 10.00 H new ATOM 0 HB3 ALA A 15 -15.669 -5.415 -3.485 1.00 10.00 H new ATOM 240 N GLN A 16 -16.069 -7.298 -6.299 1.00 10.00 N ATOM 241 CA GLN A 16 -16.871 -7.652 -7.471 1.00 10.00 C ATOM 242 C GLN A 16 -16.833 -9.147 -7.852 1.00 10.00 C ATOM 243 O GLN A 16 -17.598 -9.572 -8.714 1.00 10.00 O ATOM 244 CB GLN A 16 -16.395 -6.796 -8.655 1.00 10.00 C ATOM 245 CG GLN A 16 -14.957 -7.096 -9.110 1.00 10.00 C ATOM 246 CD GLN A 16 -14.633 -6.419 -10.437 1.00 10.00 C ATOM 247 OE1 GLN A 16 -14.211 -5.274 -10.492 1.00 10.00 O ATOM 248 NE2 GLN A 16 -14.830 -7.099 -11.550 1.00 10.00 N ATOM 0 H GLN A 16 -15.283 -6.692 -6.535 1.00 10.00 H new ATOM 0 HA GLN A 16 -17.912 -7.452 -7.216 1.00 10.00 H new ATOM 0 HB2 GLN A 16 -17.070 -6.951 -9.496 1.00 10.00 H new ATOM 0 HB3 GLN A 16 -16.465 -5.744 -8.380 1.00 10.00 H new ATOM 0 HG2 GLN A 16 -14.256 -6.757 -8.348 1.00 10.00 H new ATOM 0 HG3 GLN A 16 -14.824 -8.173 -9.209 1.00 10.00 H new ATOM 0 HE21 GLN A 16 -15.182 -8.055 -11.508 1.00 10.00 H new ATOM 0 HE22 GLN A 16 -14.630 -6.669 -12.453 1.00 10.00 H new ATOM 257 N CYS A 17 -15.937 -9.932 -7.240 1.00 10.00 N ATOM 258 CA CYS A 17 -15.689 -11.331 -7.576 1.00 10.00 C ATOM 259 C CYS A 17 -15.383 -12.200 -6.343 1.00 10.00 C ATOM 260 O CYS A 17 -15.789 -13.363 -6.307 1.00 10.00 O ATOM 261 CB CYS A 17 -14.507 -11.384 -8.548 1.00 10.00 C ATOM 262 SG CYS A 17 -14.835 -10.861 -10.263 1.00 10.00 S ATOM 0 H CYS A 17 -15.350 -9.597 -6.476 1.00 10.00 H new ATOM 0 HA CYS A 17 -16.595 -11.737 -8.025 1.00 10.00 H new ATOM 0 HB2 CYS A 17 -13.709 -10.758 -8.148 1.00 10.00 H new ATOM 0 HB3 CYS A 17 -14.130 -12.406 -8.570 1.00 10.00 H new ATOM 267 N HIS A 18 -14.699 -11.627 -5.345 1.00 10.00 N ATOM 268 CA HIS A 18 -14.277 -12.238 -4.090 1.00 10.00 C ATOM 269 C HIS A 18 -14.979 -11.602 -2.875 1.00 10.00 C ATOM 270 O HIS A 18 -15.786 -10.684 -3.012 1.00 10.00 O ATOM 271 CB HIS A 18 -12.761 -12.032 -3.968 1.00 10.00 C ATOM 272 CG HIS A 18 -11.936 -12.648 -5.050 1.00 10.00 C ATOM 273 ND1 HIS A 18 -11.541 -13.950 -5.042 1.00 10.00 N ATOM 274 CD2 HIS A 18 -11.254 -12.004 -6.041 1.00 10.00 C ATOM 275 CE1 HIS A 18 -10.605 -14.090 -5.994 1.00 10.00 C ATOM 276 NE2 HIS A 18 -10.420 -12.946 -6.661 1.00 10.00 N ATOM 0 H HIS A 18 -14.407 -10.651 -5.404 1.00 10.00 H new ATOM 0 HA HIS A 18 -14.543 -13.295 -4.098 1.00 10.00 H new ATOM 0 HB2 HIS A 18 -12.559 -10.961 -3.947 1.00 10.00 H new ATOM 0 HB3 HIS A 18 -12.433 -12.437 -3.011 1.00 10.00 H new ATOM 0 HD1 HIS A 18 -11.891 -14.684 -4.426 1.00 10.00 H new ATOM 0 HD2 HIS A 18 -11.341 -10.959 -6.301 1.00 10.00 H new ATOM 0 HE1 HIS A 18 -10.071 -15.007 -6.195 1.00 10.00 H new ATOM 284 N THR A 19 -14.590 -12.028 -1.671 1.00 10.00 N ATOM 285 CA THR A 19 -14.644 -11.195 -0.466 1.00 10.00 C ATOM 286 C THR A 19 -13.478 -11.523 0.474 1.00 10.00 C ATOM 287 O THR A 19 -12.704 -12.438 0.200 1.00 10.00 O ATOM 288 CB THR A 19 -16.003 -11.327 0.233 1.00 10.00 C ATOM 289 OG1 THR A 19 -16.156 -10.273 1.147 1.00 10.00 O ATOM 290 CG2 THR A 19 -16.182 -12.626 1.013 1.00 10.00 C ATOM 0 H THR A 19 -14.226 -12.966 -1.503 1.00 10.00 H new ATOM 0 HA THR A 19 -14.537 -10.152 -0.763 1.00 10.00 H new ATOM 0 HB THR A 19 -16.747 -11.311 -0.564 1.00 10.00 H new ATOM 0 HG1 THR A 19 -17.087 -10.236 1.451 1.00 10.00 H new ATOM 0 HG21 THR A 19 -17.169 -12.639 1.476 1.00 10.00 H new ATOM 0 HG22 THR A 19 -16.088 -13.474 0.334 1.00 10.00 H new ATOM 0 HG23 THR A 19 -15.417 -12.694 1.787 1.00 10.00 H new ATOM 298 N VAL A 20 -13.393 -10.771 1.576 1.00 10.00 N ATOM 299 CA VAL A 20 -12.739 -11.127 2.848 1.00 10.00 C ATOM 300 C VAL A 20 -13.239 -10.198 3.968 1.00 10.00 C ATOM 301 O VAL A 20 -13.587 -10.677 5.040 1.00 10.00 O ATOM 302 CB VAL A 20 -11.198 -11.175 2.735 1.00 10.00 C ATOM 303 CG1 VAL A 20 -10.559 -9.848 2.323 1.00 10.00 C ATOM 304 CG2 VAL A 20 -10.546 -11.665 4.033 1.00 10.00 C ATOM 0 H VAL A 20 -13.804 -9.838 1.610 1.00 10.00 H new ATOM 0 HA VAL A 20 -13.025 -12.146 3.109 1.00 10.00 H new ATOM 0 HB VAL A 20 -11.009 -11.889 1.933 1.00 10.00 H new ATOM 0 HG11 VAL A 20 -9.477 -9.967 2.267 1.00 10.00 H new ATOM 0 HG12 VAL A 20 -10.942 -9.547 1.348 1.00 10.00 H new ATOM 0 HG13 VAL A 20 -10.802 -9.083 3.060 1.00 10.00 H new ATOM 0 HG21 VAL A 20 -9.463 -11.684 3.911 1.00 10.00 H new ATOM 0 HG22 VAL A 20 -10.808 -10.991 4.849 1.00 10.00 H new ATOM 0 HG23 VAL A 20 -10.903 -12.669 4.263 1.00 10.00 H new ATOM 314 N GLU A 21 -13.383 -8.889 3.698 1.00 10.00 N ATOM 315 CA GLU A 21 -14.108 -7.944 4.565 1.00 10.00 C ATOM 316 C GLU A 21 -15.615 -8.256 4.586 1.00 10.00 C ATOM 317 O GLU A 21 -16.246 -8.326 5.641 1.00 10.00 O ATOM 318 CB GLU A 21 -13.886 -6.496 4.063 1.00 10.00 C ATOM 319 CG GLU A 21 -14.569 -5.429 4.945 1.00 10.00 C ATOM 320 CD GLU A 21 -14.738 -4.075 4.239 1.00 10.00 C ATOM 321 OE1 GLU A 21 -15.633 -3.986 3.362 1.00 10.00 O ATOM 322 OE2 GLU A 21 -14.013 -3.118 4.604 1.00 10.00 O ATOM 0 H GLU A 21 -12.995 -8.452 2.862 1.00 10.00 H new ATOM 0 HA GLU A 21 -13.721 -8.046 5.579 1.00 10.00 H new ATOM 0 HB2 GLU A 21 -12.816 -6.293 4.024 1.00 10.00 H new ATOM 0 HB3 GLU A 21 -14.264 -6.411 3.044 1.00 10.00 H new ATOM 0 HG2 GLU A 21 -15.548 -5.795 5.253 1.00 10.00 H new ATOM 0 HG3 GLU A 21 -13.982 -5.287 5.852 1.00 10.00 H new ATOM 329 N LYS A 22 -16.215 -8.367 3.396 1.00 10.00 N ATOM 330 CA LYS A 22 -17.660 -8.292 3.187 1.00 10.00 C ATOM 331 C LYS A 22 -18.298 -9.667 3.411 1.00 10.00 C ATOM 332 O LYS A 22 -18.494 -10.428 2.460 1.00 10.00 O ATOM 333 CB LYS A 22 -17.994 -7.649 1.817 1.00 10.00 C ATOM 334 CG LYS A 22 -16.988 -6.557 1.397 1.00 10.00 C ATOM 335 CD LYS A 22 -17.529 -5.569 0.358 1.00 10.00 C ATOM 336 CE LYS A 22 -18.434 -4.512 1.002 1.00 10.00 C ATOM 337 NZ LYS A 22 -17.644 -3.480 1.719 1.00 10.00 N ATOM 0 H LYS A 22 -15.694 -8.515 2.532 1.00 10.00 H new ATOM 0 HA LYS A 22 -18.104 -7.627 3.928 1.00 10.00 H new ATOM 0 HB2 LYS A 22 -18.016 -8.427 1.054 1.00 10.00 H new ATOM 0 HB3 LYS A 22 -18.993 -7.216 1.860 1.00 10.00 H new ATOM 0 HG2 LYS A 22 -16.680 -6.002 2.283 1.00 10.00 H new ATOM 0 HG3 LYS A 22 -16.095 -7.037 0.995 1.00 10.00 H new ATOM 0 HD2 LYS A 22 -16.697 -5.078 -0.146 1.00 10.00 H new ATOM 0 HD3 LYS A 22 -18.088 -6.112 -0.404 1.00 10.00 H new ATOM 0 HE2 LYS A 22 -19.043 -4.036 0.233 1.00 10.00 H new ATOM 0 HE3 LYS A 22 -19.120 -4.995 1.698 1.00 10.00 H new ATOM 0 HZ1 LYS A 22 -18.178 -3.147 2.547 1.00 10.00 H new ATOM 0 HZ2 LYS A 22 -16.740 -3.889 2.031 1.00 10.00 H new ATOM 0 HZ3 LYS A 22 -17.460 -2.679 1.082 1.00 10.00 H new ATOM 351 N GLY A 23 -18.558 -9.984 4.682 1.00 10.00 N ATOM 352 CA GLY A 23 -19.380 -11.098 5.172 1.00 10.00 C ATOM 353 C GLY A 23 -18.827 -12.503 4.903 1.00 10.00 C ATOM 354 O GLY A 23 -18.389 -13.179 5.828 1.00 10.00 O ATOM 0 H GLY A 23 -18.174 -9.433 5.450 1.00 10.00 H new ATOM 0 HA2 GLY A 23 -19.514 -10.980 6.247 1.00 10.00 H new ATOM 0 HA3 GLY A 23 -20.368 -11.023 4.717 1.00 10.00 H new ATOM 358 N GLY A 24 -18.899 -12.952 3.648 1.00 10.00 N ATOM 359 CA GLY A 24 -18.561 -14.309 3.219 1.00 10.00 C ATOM 360 C GLY A 24 -19.296 -14.704 1.939 1.00 10.00 C ATOM 361 O GLY A 24 -20.520 -14.810 1.928 1.00 10.00 O ATOM 0 H GLY A 24 -19.205 -12.359 2.876 1.00 10.00 H new ATOM 0 HA2 GLY A 24 -17.486 -14.381 3.056 1.00 10.00 H new ATOM 0 HA3 GLY A 24 -18.811 -15.013 4.013 1.00 10.00 H new ATOM 365 N LYS A 25 -18.534 -14.917 0.863 1.00 10.00 N ATOM 366 CA LYS A 25 -18.988 -15.370 -0.459 1.00 10.00 C ATOM 367 C LYS A 25 -17.806 -15.874 -1.296 1.00 10.00 C ATOM 368 O LYS A 25 -16.660 -15.493 -1.065 1.00 10.00 O ATOM 369 CB LYS A 25 -19.746 -14.245 -1.205 1.00 10.00 C ATOM 370 CG LYS A 25 -18.894 -13.004 -1.525 1.00 10.00 C ATOM 371 CD LYS A 25 -19.672 -11.952 -2.327 1.00 10.00 C ATOM 372 CE LYS A 25 -18.699 -10.873 -2.822 1.00 10.00 C ATOM 373 NZ LYS A 25 -19.364 -9.794 -3.584 1.00 10.00 N ATOM 0 H LYS A 25 -17.525 -14.770 0.890 1.00 10.00 H new ATOM 0 HA LYS A 25 -19.680 -16.199 -0.309 1.00 10.00 H new ATOM 0 HB2 LYS A 25 -20.143 -14.648 -2.137 1.00 10.00 H new ATOM 0 HB3 LYS A 25 -20.600 -13.938 -0.601 1.00 10.00 H new ATOM 0 HG2 LYS A 25 -18.540 -12.560 -0.595 1.00 10.00 H new ATOM 0 HG3 LYS A 25 -18.012 -13.308 -2.089 1.00 10.00 H new ATOM 0 HD2 LYS A 25 -20.175 -12.421 -3.173 1.00 10.00 H new ATOM 0 HD3 LYS A 25 -20.446 -11.503 -1.705 1.00 10.00 H new ATOM 0 HE2 LYS A 25 -18.182 -10.439 -1.966 1.00 10.00 H new ATOM 0 HE3 LYS A 25 -17.940 -11.338 -3.451 1.00 10.00 H new ATOM 0 HZ1 LYS A 25 -18.644 -9.182 -4.019 1.00 10.00 H new ATOM 0 HZ2 LYS A 25 -19.959 -10.211 -4.328 1.00 10.00 H new ATOM 0 HZ3 LYS A 25 -19.956 -9.230 -2.942 1.00 10.00 H new ATOM 387 N HIS A 26 -18.109 -16.718 -2.279 1.00 10.00 N ATOM 388 CA HIS A 26 -17.174 -17.342 -3.217 1.00 10.00 C ATOM 389 C HIS A 26 -17.969 -17.716 -4.476 1.00 10.00 C ATOM 390 O HIS A 26 -18.844 -18.586 -4.420 1.00 10.00 O ATOM 391 CB HIS A 26 -16.487 -18.563 -2.569 1.00 10.00 C ATOM 392 CG HIS A 26 -17.385 -19.348 -1.646 1.00 10.00 C ATOM 393 ND1 HIS A 26 -18.609 -19.874 -1.986 1.00 10.00 N ATOM 394 CD2 HIS A 26 -17.225 -19.499 -0.296 1.00 10.00 C ATOM 395 CE1 HIS A 26 -19.185 -20.329 -0.860 1.00 10.00 C ATOM 396 NE2 HIS A 26 -18.382 -20.110 0.193 1.00 10.00 N ATOM 0 H HIS A 26 -19.072 -17.003 -2.454 1.00 10.00 H new ATOM 0 HA HIS A 26 -16.372 -16.656 -3.488 1.00 10.00 H new ATOM 0 HB2 HIS A 26 -16.124 -19.224 -3.356 1.00 10.00 H new ATOM 0 HB3 HIS A 26 -15.615 -18.223 -2.010 1.00 10.00 H new ATOM 0 HD1 HIS A 26 -19.008 -19.912 -2.924 1.00 10.00 H new ATOM 0 HD2 HIS A 26 -16.364 -19.201 0.284 1.00 10.00 H new ATOM 0 HE1 HIS A 26 -20.154 -20.803 -0.810 1.00 10.00 H new ATOM 404 N LYS A 27 -17.744 -16.985 -5.575 1.00 10.00 N ATOM 405 CA LYS A 27 -18.585 -17.023 -6.783 1.00 10.00 C ATOM 406 C LYS A 27 -17.736 -16.863 -8.042 1.00 10.00 C ATOM 407 O LYS A 27 -17.410 -17.858 -8.677 1.00 10.00 O ATOM 408 CB LYS A 27 -19.698 -15.955 -6.723 1.00 10.00 C ATOM 409 CG LYS A 27 -20.866 -16.329 -5.799 1.00 10.00 C ATOM 410 CD LYS A 27 -21.944 -15.237 -5.683 1.00 10.00 C ATOM 411 CE LYS A 27 -22.669 -14.882 -6.994 1.00 10.00 C ATOM 412 NZ LYS A 27 -21.930 -13.882 -7.804 1.00 10.00 N ATOM 0 H LYS A 27 -16.959 -16.338 -5.653 1.00 10.00 H new ATOM 0 HA LYS A 27 -19.067 -18.000 -6.824 1.00 10.00 H new ATOM 0 HB2 LYS A 27 -19.267 -15.013 -6.385 1.00 10.00 H new ATOM 0 HB3 LYS A 27 -20.082 -15.787 -7.729 1.00 10.00 H new ATOM 0 HG2 LYS A 27 -21.329 -17.245 -6.167 1.00 10.00 H new ATOM 0 HG3 LYS A 27 -20.475 -16.547 -4.805 1.00 10.00 H new ATOM 0 HD2 LYS A 27 -22.686 -15.559 -4.953 1.00 10.00 H new ATOM 0 HD3 LYS A 27 -21.480 -14.333 -5.288 1.00 10.00 H new ATOM 0 HE2 LYS A 27 -22.810 -15.788 -7.583 1.00 10.00 H new ATOM 0 HE3 LYS A 27 -23.661 -14.494 -6.762 1.00 10.00 H new ATOM 0 HZ1 LYS A 27 -22.597 -13.177 -8.178 1.00 10.00 H new ATOM 0 HZ2 LYS A 27 -21.223 -13.407 -7.208 1.00 10.00 H new ATOM 0 HZ3 LYS A 27 -21.452 -14.360 -8.594 1.00 10.00 H new ATOM 426 N THR A 28 -17.388 -15.628 -8.410 1.00 10.00 N ATOM 427 CA THR A 28 -16.523 -15.362 -9.568 1.00 10.00 C ATOM 428 C THR A 28 -15.049 -15.586 -9.214 1.00 10.00 C ATOM 429 O THR A 28 -14.258 -15.896 -10.095 1.00 10.00 O ATOM 430 CB THR A 28 -16.723 -13.939 -10.111 1.00 10.00 C ATOM 431 OG1 THR A 28 -18.038 -13.467 -9.891 1.00 10.00 O ATOM 432 CG2 THR A 28 -16.452 -13.876 -11.615 1.00 10.00 C ATOM 0 H THR A 28 -17.694 -14.788 -7.919 1.00 10.00 H new ATOM 0 HA THR A 28 -16.809 -16.066 -10.350 1.00 10.00 H new ATOM 0 HB THR A 28 -16.014 -13.311 -9.571 1.00 10.00 H new ATOM 0 HG1 THR A 28 -18.124 -12.559 -10.249 1.00 10.00 H new ATOM 0 HG21 THR A 28 -16.602 -12.856 -11.969 1.00 10.00 H new ATOM 0 HG22 THR A 28 -15.425 -14.181 -11.813 1.00 10.00 H new ATOM 0 HG23 THR A 28 -17.136 -14.545 -12.136 1.00 10.00 H new ATOM 440 N GLY A 29 -14.700 -15.490 -7.924 1.00 10.00 N ATOM 441 CA GLY A 29 -13.499 -16.036 -7.300 1.00 10.00 C ATOM 442 C GLY A 29 -13.798 -16.520 -5.864 1.00 10.00 C ATOM 443 O GLY A 29 -14.925 -16.347 -5.385 1.00 10.00 O ATOM 0 H GLY A 29 -15.288 -14.998 -7.252 1.00 10.00 H new ATOM 0 HA2 GLY A 29 -13.119 -16.866 -7.896 1.00 10.00 H new ATOM 0 HA3 GLY A 29 -12.718 -15.276 -7.277 1.00 10.00 H new ATOM 447 N PRO A 30 -12.814 -17.130 -5.174 1.00 10.00 N ATOM 448 CA PRO A 30 -12.925 -17.623 -3.796 1.00 10.00 C ATOM 449 C PRO A 30 -12.919 -16.508 -2.730 1.00 10.00 C ATOM 450 O PRO A 30 -12.824 -15.319 -3.021 1.00 10.00 O ATOM 451 CB PRO A 30 -11.736 -18.576 -3.626 1.00 10.00 C ATOM 452 CG PRO A 30 -10.684 -17.983 -4.550 1.00 10.00 C ATOM 453 CD PRO A 30 -11.520 -17.501 -5.726 1.00 10.00 C ATOM 0 HA PRO A 30 -13.886 -18.114 -3.642 1.00 10.00 H new ATOM 0 HB2 PRO A 30 -11.391 -18.610 -2.592 1.00 10.00 H new ATOM 0 HB3 PRO A 30 -11.993 -19.596 -3.910 1.00 10.00 H new ATOM 0 HG2 PRO A 30 -10.140 -17.166 -4.076 1.00 10.00 H new ATOM 0 HG3 PRO A 30 -9.945 -18.724 -4.853 1.00 10.00 H new ATOM 0 HD2 PRO A 30 -11.048 -16.651 -6.218 1.00 10.00 H new ATOM 0 HD3 PRO A 30 -11.626 -18.285 -6.476 1.00 10.00 H new ATOM 461 N ASN A 31 -13.001 -16.919 -1.465 1.00 10.00 N ATOM 462 CA ASN A 31 -13.237 -16.118 -0.264 1.00 10.00 C ATOM 463 C ASN A 31 -11.970 -15.642 0.486 1.00 10.00 C ATOM 464 O ASN A 31 -12.078 -15.275 1.654 1.00 10.00 O ATOM 465 CB ASN A 31 -14.167 -16.959 0.646 1.00 10.00 C ATOM 466 CG ASN A 31 -13.640 -18.358 0.985 1.00 10.00 C ATOM 467 OD1 ASN A 31 -13.300 -19.150 0.115 1.00 10.00 O ATOM 468 ND2 ASN A 31 -13.606 -18.733 2.246 1.00 10.00 N ATOM 0 H ASN A 31 -12.895 -17.907 -1.234 1.00 10.00 H new ATOM 0 HA ASN A 31 -13.694 -15.176 -0.566 1.00 10.00 H new ATOM 0 HB2 ASN A 31 -14.333 -16.414 1.575 1.00 10.00 H new ATOM 0 HB3 ASN A 31 -15.136 -17.060 0.158 1.00 10.00 H new ATOM 0 HD21 ASN A 31 -13.299 -19.675 2.490 1.00 10.00 H new ATOM 0 HD22 ASN A 31 -13.887 -18.082 2.979 1.00 10.00 H new ATOM 475 N LEU A 32 -10.787 -15.688 -0.150 1.00 10.00 N ATOM 476 CA LEU A 32 -9.462 -15.346 0.410 1.00 10.00 C ATOM 477 C LEU A 32 -9.288 -15.813 1.873 1.00 10.00 C ATOM 478 O LEU A 32 -8.945 -15.056 2.780 1.00 10.00 O ATOM 479 CB LEU A 32 -9.125 -13.852 0.188 1.00 10.00 C ATOM 480 CG LEU A 32 -8.688 -13.517 -1.255 1.00 10.00 C ATOM 481 CD1 LEU A 32 -9.875 -13.260 -2.181 1.00 10.00 C ATOM 482 CD2 LEU A 32 -7.821 -12.257 -1.261 1.00 10.00 C ATOM 0 H LEU A 32 -10.723 -15.981 -1.125 1.00 10.00 H new ATOM 0 HA LEU A 32 -8.718 -15.914 -0.148 1.00 10.00 H new ATOM 0 HB2 LEU A 32 -9.998 -13.251 0.441 1.00 10.00 H new ATOM 0 HB3 LEU A 32 -8.329 -13.563 0.875 1.00 10.00 H new ATOM 0 HG LEU A 32 -8.136 -14.384 -1.618 1.00 10.00 H new ATOM 0 HD11 LEU A 32 -9.512 -13.029 -3.182 1.00 10.00 H new ATOM 0 HD12 LEU A 32 -10.506 -14.148 -2.219 1.00 10.00 H new ATOM 0 HD13 LEU A 32 -10.456 -12.419 -1.803 1.00 10.00 H new ATOM 0 HD21 LEU A 32 -7.518 -12.029 -2.283 1.00 10.00 H new ATOM 0 HD22 LEU A 32 -8.391 -11.421 -0.857 1.00 10.00 H new ATOM 0 HD23 LEU A 32 -6.935 -12.422 -0.648 1.00 10.00 H new ATOM 494 N HIS A 33 -9.508 -17.115 2.069 1.00 10.00 N ATOM 495 CA HIS A 33 -9.455 -17.870 3.318 1.00 10.00 C ATOM 496 C HIS A 33 -8.103 -17.775 4.055 1.00 10.00 C ATOM 497 O HIS A 33 -7.249 -18.654 3.922 1.00 10.00 O ATOM 498 CB HIS A 33 -9.839 -19.324 2.989 1.00 10.00 C ATOM 499 CG HIS A 33 -9.162 -19.871 1.750 1.00 10.00 C ATOM 500 ND1 HIS A 33 -7.825 -19.773 1.441 1.00 10.00 N ATOM 501 CD2 HIS A 33 -9.784 -20.470 0.695 1.00 10.00 C ATOM 502 CE1 HIS A 33 -7.643 -20.325 0.229 1.00 10.00 C ATOM 503 NE2 HIS A 33 -8.811 -20.776 -0.267 1.00 10.00 N ATOM 0 H HIS A 33 -9.750 -17.720 1.284 1.00 10.00 H new ATOM 0 HA HIS A 33 -10.161 -17.433 4.024 1.00 10.00 H new ATOM 0 HB2 HIS A 33 -9.586 -19.958 3.839 1.00 10.00 H new ATOM 0 HB3 HIS A 33 -10.919 -19.383 2.857 1.00 10.00 H new ATOM 0 HD1 HIS A 33 -7.101 -19.356 2.027 1.00 10.00 H new ATOM 0 HD2 HIS A 33 -10.842 -20.673 0.614 1.00 10.00 H new ATOM 0 HE1 HIS A 33 -6.692 -20.397 -0.277 1.00 10.00 H new ATOM 511 N GLY A 34 -7.924 -16.719 4.858 1.00 10.00 N ATOM 512 CA GLY A 34 -6.847 -16.574 5.846 1.00 10.00 C ATOM 513 C GLY A 34 -5.429 -16.707 5.281 1.00 10.00 C ATOM 514 O GLY A 34 -4.547 -17.223 5.962 1.00 10.00 O ATOM 0 H GLY A 34 -8.548 -15.912 4.837 1.00 10.00 H new ATOM 0 HA2 GLY A 34 -6.942 -15.599 6.324 1.00 10.00 H new ATOM 0 HA3 GLY A 34 -6.984 -17.325 6.624 1.00 10.00 H new ATOM 518 N LEU A 35 -5.214 -16.290 4.028 1.00 10.00 N ATOM 519 CA LEU A 35 -3.922 -16.372 3.344 1.00 10.00 C ATOM 520 C LEU A 35 -2.837 -15.494 3.982 1.00 10.00 C ATOM 521 O LEU A 35 -3.067 -14.800 4.969 1.00 10.00 O ATOM 522 CB LEU A 35 -4.110 -16.016 1.860 1.00 10.00 C ATOM 523 CG LEU A 35 -4.689 -17.107 0.952 1.00 10.00 C ATOM 524 CD1 LEU A 35 -4.484 -18.557 1.409 1.00 10.00 C ATOM 525 CD2 LEU A 35 -6.174 -16.866 0.694 1.00 10.00 C ATOM 0 H LEU A 35 -5.948 -15.879 3.452 1.00 10.00 H new ATOM 0 HA LEU A 35 -3.567 -17.398 3.442 1.00 10.00 H new ATOM 0 HB2 LEU A 35 -4.762 -15.144 1.800 1.00 10.00 H new ATOM 0 HB3 LEU A 35 -3.142 -15.718 1.457 1.00 10.00 H new ATOM 0 HG LEU A 35 -4.104 -17.011 0.037 1.00 10.00 H new ATOM 0 HD11 LEU A 35 -4.937 -19.234 0.685 1.00 10.00 H new ATOM 0 HD12 LEU A 35 -3.417 -18.767 1.484 1.00 10.00 H new ATOM 0 HD13 LEU A 35 -4.952 -18.701 2.383 1.00 10.00 H new ATOM 0 HD21 LEU A 35 -6.563 -17.652 0.047 1.00 10.00 H new ATOM 0 HD22 LEU A 35 -6.714 -16.874 1.641 1.00 10.00 H new ATOM 0 HD23 LEU A 35 -6.307 -15.899 0.209 1.00 10.00 H new ATOM 537 N PHE A 36 -1.627 -15.538 3.410 1.00 10.00 N ATOM 538 CA PHE A 36 -0.402 -15.011 4.008 1.00 10.00 C ATOM 539 C PHE A 36 -0.192 -15.573 5.425 1.00 10.00 C ATOM 540 O PHE A 36 0.127 -14.851 6.381 1.00 10.00 O ATOM 541 CB PHE A 36 -0.335 -13.485 3.960 1.00 10.00 C ATOM 542 CG PHE A 36 -0.590 -12.767 2.650 1.00 10.00 C ATOM 543 CD1 PHE A 36 -1.867 -12.756 2.067 1.00 10.00 C ATOM 544 CD2 PHE A 36 0.426 -11.966 2.097 1.00 10.00 C ATOM 545 CE1 PHE A 36 -2.096 -12.021 0.897 1.00 10.00 C ATOM 546 CE2 PHE A 36 0.180 -11.189 0.956 1.00 10.00 C ATOM 547 CZ PHE A 36 -1.078 -11.228 0.340 1.00 10.00 C ATOM 0 H PHE A 36 -1.473 -15.954 2.492 1.00 10.00 H new ATOM 0 HA PHE A 36 0.433 -15.357 3.399 1.00 10.00 H new ATOM 0 HB2 PHE A 36 -1.053 -13.104 4.686 1.00 10.00 H new ATOM 0 HB3 PHE A 36 0.656 -13.191 4.306 1.00 10.00 H new ATOM 0 HD1 PHE A 36 -2.673 -13.314 2.521 1.00 10.00 H new ATOM 0 HD2 PHE A 36 1.404 -11.949 2.555 1.00 10.00 H new ATOM 0 HE1 PHE A 36 -3.063 -12.064 0.419 1.00 10.00 H new ATOM 0 HE2 PHE A 36 0.960 -10.561 0.552 1.00 10.00 H new ATOM 0 HZ PHE A 36 -1.264 -10.653 -0.555 1.00 10.00 H new ATOM 557 N GLY A 37 -0.450 -16.883 5.511 1.00 10.00 N ATOM 558 CA GLY A 37 -0.676 -17.657 6.733 1.00 10.00 C ATOM 559 C GLY A 37 -1.421 -18.993 6.536 1.00 10.00 C ATOM 560 O GLY A 37 -1.636 -19.699 7.519 1.00 10.00 O ATOM 0 H GLY A 37 -0.510 -17.466 4.676 1.00 10.00 H new ATOM 0 HA2 GLY A 37 0.288 -17.862 7.197 1.00 10.00 H new ATOM 0 HA3 GLY A 37 -1.243 -17.043 7.433 1.00 10.00 H new ATOM 564 N ARG A 38 -1.779 -19.379 5.297 1.00 10.00 N ATOM 565 CA ARG A 38 -2.497 -20.615 4.947 1.00 10.00 C ATOM 566 C ARG A 38 -2.150 -21.063 3.521 1.00 10.00 C ATOM 567 O ARG A 38 -1.618 -20.292 2.721 1.00 10.00 O ATOM 568 CB ARG A 38 -4.025 -20.403 5.042 1.00 10.00 C ATOM 569 CG ARG A 38 -4.550 -20.376 6.486 1.00 10.00 C ATOM 570 CD ARG A 38 -6.088 -20.411 6.561 1.00 10.00 C ATOM 571 NE ARG A 38 -6.671 -21.637 5.967 1.00 10.00 N ATOM 572 CZ ARG A 38 -6.490 -22.872 6.433 1.00 10.00 C ATOM 573 NH1 ARG A 38 -5.876 -23.104 7.570 1.00 10.00 N ATOM 574 NH2 ARG A 38 -6.881 -23.933 5.774 1.00 10.00 N ATOM 0 H ARG A 38 -1.565 -18.811 4.477 1.00 10.00 H new ATOM 0 HA ARG A 38 -2.189 -21.385 5.655 1.00 10.00 H new ATOM 0 HB2 ARG A 38 -4.285 -19.465 4.551 1.00 10.00 H new ATOM 0 HB3 ARG A 38 -4.529 -21.200 4.495 1.00 10.00 H new ATOM 0 HG2 ARG A 38 -4.144 -21.228 7.032 1.00 10.00 H new ATOM 0 HG3 ARG A 38 -4.187 -19.477 6.983 1.00 10.00 H new ATOM 0 HD2 ARG A 38 -6.397 -20.337 7.604 1.00 10.00 H new ATOM 0 HD3 ARG A 38 -6.491 -19.538 6.047 1.00 10.00 H new ATOM 0 HE ARG A 38 -7.255 -21.527 5.138 1.00 10.00 H new ATOM 0 HH11 ARG A 38 -5.521 -22.326 8.126 1.00 10.00 H new ATOM 0 HH12 ARG A 38 -5.754 -24.062 7.898 1.00 10.00 H new ATOM 0 HH21 ARG A 38 -7.342 -23.831 4.870 1.00 10.00 H new ATOM 0 HH22 ARG A 38 -6.724 -24.862 6.164 1.00 10.00 H new ATOM 588 N LYS A 39 -2.463 -22.332 3.232 1.00 10.00 N ATOM 589 CA LYS A 39 -2.258 -23.024 1.953 1.00 10.00 C ATOM 590 C LYS A 39 -3.390 -22.766 0.941 1.00 10.00 C ATOM 591 O LYS A 39 -4.409 -22.158 1.266 1.00 10.00 O ATOM 592 CB LYS A 39 -2.036 -24.520 2.251 1.00 10.00 C ATOM 593 CG LYS A 39 -3.306 -25.263 2.710 1.00 10.00 C ATOM 594 CD LYS A 39 -2.975 -26.468 3.603 1.00 10.00 C ATOM 595 CE LYS A 39 -4.239 -27.299 3.851 1.00 10.00 C ATOM 596 NZ LYS A 39 -4.085 -28.218 5.000 1.00 10.00 N ATOM 0 H LYS A 39 -2.893 -22.941 3.928 1.00 10.00 H new ATOM 0 HA LYS A 39 -1.373 -22.622 1.460 1.00 10.00 H new ATOM 0 HB2 LYS A 39 -1.648 -25.005 1.355 1.00 10.00 H new ATOM 0 HB3 LYS A 39 -1.272 -24.617 3.022 1.00 10.00 H new ATOM 0 HG2 LYS A 39 -3.952 -24.575 3.255 1.00 10.00 H new ATOM 0 HG3 LYS A 39 -3.864 -25.601 1.837 1.00 10.00 H new ATOM 0 HD2 LYS A 39 -2.212 -27.084 3.128 1.00 10.00 H new ATOM 0 HD3 LYS A 39 -2.563 -26.126 4.552 1.00 10.00 H new ATOM 0 HE2 LYS A 39 -5.081 -26.631 4.032 1.00 10.00 H new ATOM 0 HE3 LYS A 39 -4.475 -27.875 2.956 1.00 10.00 H new ATOM 0 HZ1 LYS A 39 -4.963 -28.760 5.131 1.00 10.00 H new ATOM 0 HZ2 LYS A 39 -3.298 -28.873 4.818 1.00 10.00 H new ATOM 0 HZ3 LYS A 39 -3.886 -27.668 5.860 1.00 10.00 H new ATOM 610 N THR A 40 -3.204 -23.238 -0.296 1.00 10.00 N ATOM 611 CA THR A 40 -4.189 -23.137 -1.386 1.00 10.00 C ATOM 612 C THR A 40 -5.261 -24.235 -1.301 1.00 10.00 C ATOM 613 O THR A 40 -5.274 -25.055 -0.383 1.00 10.00 O ATOM 614 CB THR A 40 -3.491 -23.180 -2.757 1.00 10.00 C ATOM 615 OG1 THR A 40 -2.898 -24.442 -2.954 1.00 10.00 O ATOM 616 CG2 THR A 40 -2.421 -22.094 -2.894 1.00 10.00 C ATOM 0 H THR A 40 -2.346 -23.712 -0.577 1.00 10.00 H new ATOM 0 HA THR A 40 -4.692 -22.177 -1.273 1.00 10.00 H new ATOM 0 HB THR A 40 -4.254 -22.998 -3.514 1.00 10.00 H new ATOM 0 HG1 THR A 40 -3.379 -24.923 -3.660 1.00 10.00 H new ATOM 0 HG21 THR A 40 -1.956 -22.164 -3.877 1.00 10.00 H new ATOM 0 HG22 THR A 40 -2.882 -21.113 -2.779 1.00 10.00 H new ATOM 0 HG23 THR A 40 -1.663 -22.231 -2.123 1.00 10.00 H new ATOM 624 N GLY A 41 -6.215 -24.238 -2.237 1.00 10.00 N ATOM 625 CA GLY A 41 -7.257 -25.267 -2.337 1.00 10.00 C ATOM 626 C GLY A 41 -8.497 -24.999 -1.483 1.00 10.00 C ATOM 627 O GLY A 41 -9.597 -25.342 -1.914 1.00 10.00 O ATOM 0 H GLY A 41 -6.287 -23.518 -2.956 1.00 10.00 H new ATOM 0 HA2 GLY A 41 -7.562 -25.357 -3.380 1.00 10.00 H new ATOM 0 HA3 GLY A 41 -6.831 -26.227 -2.045 1.00 10.00 H new ATOM 631 N GLN A 42 -8.319 -24.348 -0.326 1.00 10.00 N ATOM 632 CA GLN A 42 -9.219 -24.276 0.839 1.00 10.00 C ATOM 633 C GLN A 42 -10.577 -23.568 0.623 1.00 10.00 C ATOM 634 O GLN A 42 -11.307 -23.351 1.589 1.00 10.00 O ATOM 635 CB GLN A 42 -8.473 -23.603 2.017 1.00 10.00 C ATOM 636 CG GLN A 42 -7.038 -24.081 2.280 1.00 10.00 C ATOM 637 CD GLN A 42 -6.984 -25.570 2.587 1.00 10.00 C ATOM 638 OE1 GLN A 42 -7.354 -26.000 3.667 1.00 10.00 O ATOM 639 NE2 GLN A 42 -6.515 -26.396 1.671 1.00 10.00 N ATOM 0 H GLN A 42 -7.468 -23.810 -0.164 1.00 10.00 H new ATOM 0 HA GLN A 42 -9.483 -25.313 1.047 1.00 10.00 H new ATOM 0 HB2 GLN A 42 -8.447 -22.529 1.835 1.00 10.00 H new ATOM 0 HB3 GLN A 42 -9.057 -23.759 2.924 1.00 10.00 H new ATOM 0 HG2 GLN A 42 -6.419 -23.867 1.409 1.00 10.00 H new ATOM 0 HG3 GLN A 42 -6.617 -23.522 3.116 1.00 10.00 H new ATOM 0 HE21 GLN A 42 -6.206 -26.035 0.769 1.00 10.00 H new ATOM 0 HE22 GLN A 42 -6.461 -27.396 1.865 1.00 10.00 H new ATOM 648 N ALA A 43 -10.925 -23.177 -0.607 1.00 10.00 N ATOM 649 CA ALA A 43 -12.257 -22.668 -0.930 1.00 10.00 C ATOM 650 C ALA A 43 -13.245 -23.849 -0.980 1.00 10.00 C ATOM 651 O ALA A 43 -12.854 -24.932 -1.425 1.00 10.00 O ATOM 652 CB ALA A 43 -12.191 -21.910 -2.258 1.00 10.00 C ATOM 0 H ALA A 43 -10.290 -23.205 -1.405 1.00 10.00 H new ATOM 0 HA ALA A 43 -12.608 -21.973 -0.168 1.00 10.00 H new ATOM 0 HB1 ALA A 43 -13.180 -21.526 -2.508 1.00 10.00 H new ATOM 0 HB2 ALA A 43 -11.492 -21.079 -2.168 1.00 10.00 H new ATOM 0 HB3 ALA A 43 -11.854 -22.584 -3.045 1.00 10.00 H new ATOM 658 N PRO A 44 -14.517 -23.680 -0.561 1.00 10.00 N ATOM 659 CA PRO A 44 -15.502 -24.763 -0.516 1.00 10.00 C ATOM 660 C PRO A 44 -16.004 -25.123 -1.928 1.00 10.00 C ATOM 661 O PRO A 44 -17.138 -24.837 -2.318 1.00 10.00 O ATOM 662 CB PRO A 44 -16.596 -24.273 0.436 1.00 10.00 C ATOM 663 CG PRO A 44 -16.564 -22.763 0.231 1.00 10.00 C ATOM 664 CD PRO A 44 -15.083 -22.464 0.005 1.00 10.00 C ATOM 0 HA PRO A 44 -15.085 -25.700 -0.147 1.00 10.00 H new ATOM 0 HB2 PRO A 44 -17.569 -24.695 0.186 1.00 10.00 H new ATOM 0 HB3 PRO A 44 -16.386 -24.546 1.470 1.00 10.00 H new ATOM 0 HG2 PRO A 44 -17.169 -22.461 -0.624 1.00 10.00 H new ATOM 0 HG3 PRO A 44 -16.952 -22.232 1.100 1.00 10.00 H new ATOM 0 HD2 PRO A 44 -14.953 -21.620 -0.672 1.00 10.00 H new ATOM 0 HD3 PRO A 44 -14.589 -22.201 0.941 1.00 10.00 H new ATOM 672 N GLY A 45 -15.121 -25.735 -2.721 1.00 10.00 N ATOM 673 CA GLY A 45 -15.314 -26.053 -4.130 1.00 10.00 C ATOM 674 C GLY A 45 -15.357 -24.796 -5.000 1.00 10.00 C ATOM 675 O GLY A 45 -14.374 -24.480 -5.666 1.00 10.00 O ATOM 0 H GLY A 45 -14.209 -26.035 -2.377 1.00 10.00 H new ATOM 0 HA2 GLY A 45 -14.506 -26.701 -4.469 1.00 10.00 H new ATOM 0 HA3 GLY A 45 -16.243 -26.610 -4.252 1.00 10.00 H new ATOM 679 N PHE A 46 -16.508 -24.114 -5.016 1.00 10.00 N ATOM 680 CA PHE A 46 -16.939 -22.977 -5.861 1.00 10.00 C ATOM 681 C PHE A 46 -16.731 -23.093 -7.397 1.00 10.00 C ATOM 682 O PHE A 46 -17.359 -22.342 -8.137 1.00 10.00 O ATOM 683 CB PHE A 46 -16.435 -21.643 -5.261 1.00 10.00 C ATOM 684 CG PHE A 46 -15.329 -20.948 -6.033 1.00 10.00 C ATOM 685 CD1 PHE A 46 -15.656 -20.098 -7.104 1.00 10.00 C ATOM 686 CD2 PHE A 46 -13.978 -21.174 -5.716 1.00 10.00 C ATOM 687 CE1 PHE A 46 -14.649 -19.548 -7.911 1.00 10.00 C ATOM 688 CE2 PHE A 46 -12.967 -20.591 -6.502 1.00 10.00 C ATOM 689 CZ PHE A 46 -13.303 -19.811 -7.623 1.00 10.00 C ATOM 0 H PHE A 46 -17.250 -24.370 -4.365 1.00 10.00 H new ATOM 0 HA PHE A 46 -18.028 -23.006 -5.818 1.00 10.00 H new ATOM 0 HB2 PHE A 46 -17.281 -20.960 -5.181 1.00 10.00 H new ATOM 0 HB3 PHE A 46 -16.081 -21.833 -4.248 1.00 10.00 H new ATOM 0 HD1 PHE A 46 -16.691 -19.867 -7.307 1.00 10.00 H new ATOM 0 HD2 PHE A 46 -13.717 -21.794 -4.871 1.00 10.00 H new ATOM 0 HE1 PHE A 46 -14.910 -18.923 -8.752 1.00 10.00 H new ATOM 0 HE2 PHE A 46 -11.929 -20.743 -6.244 1.00 10.00 H new ATOM 0 HZ PHE A 46 -12.526 -19.416 -8.260 1.00 10.00 H new ATOM 699 N THR A 47 -15.925 -24.056 -7.866 1.00 10.00 N ATOM 700 CA THR A 47 -15.432 -24.289 -9.234 1.00 10.00 C ATOM 701 C THR A 47 -14.306 -23.316 -9.614 1.00 10.00 C ATOM 702 O THR A 47 -14.481 -22.401 -10.417 1.00 10.00 O ATOM 703 CB THR A 47 -16.562 -24.370 -10.284 1.00 10.00 C ATOM 704 OG1 THR A 47 -17.543 -25.299 -9.871 1.00 10.00 O ATOM 705 CG2 THR A 47 -16.066 -24.882 -11.639 1.00 10.00 C ATOM 0 H THR A 47 -15.563 -24.767 -7.230 1.00 10.00 H new ATOM 0 HA THR A 47 -14.984 -25.283 -9.236 1.00 10.00 H new ATOM 0 HB THR A 47 -16.952 -23.356 -10.378 1.00 10.00 H new ATOM 0 HG1 THR A 47 -18.256 -25.342 -10.542 1.00 10.00 H new ATOM 0 HG21 THR A 47 -16.899 -24.920 -12.341 1.00 10.00 H new ATOM 0 HG22 THR A 47 -15.298 -24.210 -12.023 1.00 10.00 H new ATOM 0 HG23 THR A 47 -15.647 -25.881 -11.519 1.00 10.00 H new ATOM 713 N TYR A 48 -13.113 -23.586 -9.072 1.00 10.00 N ATOM 714 CA TYR A 48 -11.828 -23.100 -9.585 1.00 10.00 C ATOM 715 C TYR A 48 -11.282 -24.001 -10.713 1.00 10.00 C ATOM 716 O TYR A 48 -11.795 -25.096 -10.937 1.00 10.00 O ATOM 717 CB TYR A 48 -10.832 -22.989 -8.422 1.00 10.00 C ATOM 718 CG TYR A 48 -10.803 -24.094 -7.368 1.00 10.00 C ATOM 719 CD1 TYR A 48 -10.078 -25.282 -7.593 1.00 10.00 C ATOM 720 CD2 TYR A 48 -11.343 -23.849 -6.090 1.00 10.00 C ATOM 721 CE1 TYR A 48 -9.832 -26.177 -6.533 1.00 10.00 C ATOM 722 CE2 TYR A 48 -11.086 -24.731 -5.021 1.00 10.00 C ATOM 723 CZ TYR A 48 -10.297 -25.879 -5.233 1.00 10.00 C ATOM 724 OH TYR A 48 -9.930 -26.660 -4.180 1.00 10.00 O ATOM 0 H TYR A 48 -13.013 -24.166 -8.239 1.00 10.00 H new ATOM 0 HA TYR A 48 -11.976 -22.114 -10.026 1.00 10.00 H new ATOM 0 HB2 TYR A 48 -9.832 -22.915 -8.850 1.00 10.00 H new ATOM 0 HB3 TYR A 48 -11.029 -22.048 -7.908 1.00 10.00 H new ATOM 0 HD1 TYR A 48 -9.709 -25.507 -8.583 1.00 10.00 H new ATOM 0 HD2 TYR A 48 -11.960 -22.977 -5.928 1.00 10.00 H new ATOM 0 HE1 TYR A 48 -9.287 -27.092 -6.715 1.00 10.00 H new ATOM 0 HE2 TYR A 48 -11.493 -24.527 -4.042 1.00 10.00 H new ATOM 0 HH TYR A 48 -10.066 -26.167 -3.344 1.00 10.00 H new ATOM 734 N THR A 49 -10.221 -23.571 -11.416 1.00 10.00 N ATOM 735 CA THR A 49 -9.693 -24.250 -12.625 1.00 10.00 C ATOM 736 C THR A 49 -9.016 -25.604 -12.399 1.00 10.00 C ATOM 737 O THR A 49 -8.512 -26.192 -13.353 1.00 10.00 O ATOM 738 CB THR A 49 -8.677 -23.370 -13.379 1.00 10.00 C ATOM 739 OG1 THR A 49 -7.535 -23.031 -12.608 1.00 10.00 O ATOM 740 CG2 THR A 49 -9.329 -22.084 -13.881 1.00 10.00 C ATOM 0 H THR A 49 -9.696 -22.734 -11.163 1.00 10.00 H new ATOM 0 HA THR A 49 -10.601 -24.425 -13.201 1.00 10.00 H new ATOM 0 HB THR A 49 -8.341 -23.979 -14.219 1.00 10.00 H new ATOM 0 HG1 THR A 49 -7.012 -23.839 -12.425 1.00 10.00 H new ATOM 0 HG21 THR A 49 -8.589 -21.483 -14.409 1.00 10.00 H new ATOM 0 HG22 THR A 49 -10.146 -22.331 -14.559 1.00 10.00 H new ATOM 0 HG23 THR A 49 -9.718 -21.519 -13.034 1.00 10.00 H new ATOM 748 N ASP A 50 -8.922 -26.062 -11.151 1.00 10.00 N ATOM 749 CA ASP A 50 -7.792 -26.861 -10.666 1.00 10.00 C ATOM 750 C ASP A 50 -6.438 -26.232 -11.105 1.00 10.00 C ATOM 751 O ASP A 50 -6.358 -25.011 -11.312 1.00 10.00 O ATOM 752 CB ASP A 50 -8.024 -28.337 -11.057 1.00 10.00 C ATOM 753 CG ASP A 50 -7.245 -29.299 -10.162 1.00 10.00 C ATOM 754 OD1 ASP A 50 -6.066 -29.554 -10.482 1.00 10.00 O ATOM 755 OD2 ASP A 50 -7.781 -29.708 -9.109 1.00 10.00 O ATOM 0 H ASP A 50 -9.633 -25.889 -10.440 1.00 10.00 H new ATOM 0 HA ASP A 50 -7.728 -26.853 -9.578 1.00 10.00 H new ATOM 0 HB2 ASP A 50 -9.088 -28.565 -10.994 1.00 10.00 H new ATOM 0 HB3 ASP A 50 -7.727 -28.487 -12.095 1.00 10.00 H new ATOM 760 N ALA A 51 -5.359 -27.023 -11.164 1.00 10.00 N ATOM 761 CA ALA A 51 -3.957 -26.636 -11.327 1.00 10.00 C ATOM 762 C ALA A 51 -3.446 -25.727 -10.198 1.00 10.00 C ATOM 763 O ALA A 51 -2.747 -26.219 -9.316 1.00 10.00 O ATOM 764 CB ALA A 51 -3.703 -26.095 -12.742 1.00 10.00 C ATOM 0 H ALA A 51 -5.456 -28.036 -11.093 1.00 10.00 H new ATOM 0 HA ALA A 51 -3.348 -27.535 -11.227 1.00 10.00 H new ATOM 0 HB1 ALA A 51 -2.655 -25.813 -12.841 1.00 10.00 H new ATOM 0 HB2 ALA A 51 -3.943 -26.866 -13.475 1.00 10.00 H new ATOM 0 HB3 ALA A 51 -4.331 -25.221 -12.916 1.00 10.00 H new ATOM 770 N ASN A 52 -3.808 -24.435 -10.195 1.00 10.00 N ATOM 771 CA ASN A 52 -3.433 -23.430 -9.189 1.00 10.00 C ATOM 772 C ASN A 52 -3.702 -23.936 -7.764 1.00 10.00 C ATOM 773 O ASN A 52 -2.779 -24.246 -7.006 1.00 10.00 O ATOM 774 CB ASN A 52 -4.205 -22.123 -9.503 1.00 10.00 C ATOM 775 CG ASN A 52 -4.282 -21.120 -8.345 1.00 10.00 C ATOM 776 OD1 ASN A 52 -3.484 -21.105 -7.423 1.00 10.00 O ATOM 777 ND2 ASN A 52 -5.282 -20.269 -8.338 1.00 10.00 N ATOM 0 H ASN A 52 -4.398 -24.044 -10.929 1.00 10.00 H new ATOM 0 HA ASN A 52 -2.362 -23.234 -9.236 1.00 10.00 H new ATOM 0 HB2 ASN A 52 -3.732 -21.635 -10.355 1.00 10.00 H new ATOM 0 HB3 ASN A 52 -5.219 -22.382 -9.807 1.00 10.00 H new ATOM 0 HD21 ASN A 52 -5.383 -19.607 -7.568 1.00 10.00 H new ATOM 0 HD22 ASN A 52 -5.957 -20.270 -9.102 1.00 10.00 H new ATOM 784 N LYS A 53 -4.993 -24.012 -7.424 1.00 10.00 N ATOM 785 CA LYS A 53 -5.529 -24.313 -6.098 1.00 10.00 C ATOM 786 C LYS A 53 -5.012 -25.659 -5.583 1.00 10.00 C ATOM 787 O LYS A 53 -4.618 -25.749 -4.419 1.00 10.00 O ATOM 788 CB LYS A 53 -7.063 -24.248 -6.186 1.00 10.00 C ATOM 789 CG LYS A 53 -7.610 -22.833 -6.457 1.00 10.00 C ATOM 790 CD LYS A 53 -7.526 -21.852 -5.284 1.00 10.00 C ATOM 791 CE LYS A 53 -8.469 -22.195 -4.118 1.00 10.00 C ATOM 792 NZ LYS A 53 -8.494 -21.095 -3.121 1.00 10.00 N ATOM 0 H LYS A 53 -5.732 -23.855 -8.109 1.00 10.00 H new ATOM 0 HA LYS A 53 -5.188 -23.579 -5.368 1.00 10.00 H new ATOM 0 HB2 LYS A 53 -7.401 -24.916 -6.978 1.00 10.00 H new ATOM 0 HB3 LYS A 53 -7.487 -24.619 -5.253 1.00 10.00 H new ATOM 0 HG2 LYS A 53 -7.066 -22.409 -7.301 1.00 10.00 H new ATOM 0 HG3 LYS A 53 -8.653 -22.919 -6.761 1.00 10.00 H new ATOM 0 HD2 LYS A 53 -6.501 -21.829 -4.915 1.00 10.00 H new ATOM 0 HD3 LYS A 53 -7.758 -20.850 -5.644 1.00 10.00 H new ATOM 0 HE2 LYS A 53 -9.475 -22.371 -4.498 1.00 10.00 H new ATOM 0 HE3 LYS A 53 -8.143 -23.118 -3.640 1.00 10.00 H new ATOM 0 HZ1 LYS A 53 -8.859 -21.455 -2.216 1.00 10.00 H new ATOM 0 HZ2 LYS A 53 -7.530 -20.728 -2.985 1.00 10.00 H new ATOM 0 HZ3 LYS A 53 -9.110 -20.330 -3.463 1.00 10.00 H new ATOM 806 N ASN A 54 -4.980 -26.653 -6.475 1.00 10.00 N ATOM 807 CA ASN A 54 -4.507 -28.018 -6.270 1.00 10.00 C ATOM 808 C ASN A 54 -2.996 -28.081 -5.974 1.00 10.00 C ATOM 809 O ASN A 54 -2.613 -28.540 -4.902 1.00 10.00 O ATOM 810 CB ASN A 54 -4.913 -28.822 -7.518 1.00 10.00 C ATOM 811 CG ASN A 54 -4.844 -30.331 -7.321 1.00 10.00 C ATOM 812 OD1 ASN A 54 -3.868 -30.873 -6.829 1.00 10.00 O ATOM 813 ND2 ASN A 54 -5.879 -31.046 -7.703 1.00 10.00 N ATOM 0 H ASN A 54 -5.310 -26.510 -7.430 1.00 10.00 H new ATOM 0 HA ASN A 54 -4.966 -28.453 -5.382 1.00 10.00 H new ATOM 0 HB2 ASN A 54 -5.929 -28.547 -7.802 1.00 10.00 H new ATOM 0 HB3 ASN A 54 -4.263 -28.542 -8.347 1.00 10.00 H new ATOM 0 HD21 ASN A 54 -5.869 -32.060 -7.589 1.00 10.00 H new ATOM 0 HD22 ASN A 54 -6.692 -30.587 -8.114 1.00 10.00 H new ATOM 820 N LYS A 55 -2.146 -27.599 -6.898 1.00 10.00 N ATOM 821 CA LYS A 55 -0.682 -27.615 -6.754 1.00 10.00 C ATOM 822 C LYS A 55 -0.226 -26.780 -5.556 1.00 10.00 C ATOM 823 O LYS A 55 0.565 -27.247 -4.740 1.00 10.00 O ATOM 824 CB LYS A 55 -0.026 -27.098 -8.050 1.00 10.00 C ATOM 825 CG LYS A 55 1.511 -27.174 -8.004 1.00 10.00 C ATOM 826 CD LYS A 55 2.156 -26.331 -9.108 1.00 10.00 C ATOM 827 CE LYS A 55 3.669 -26.280 -8.868 1.00 10.00 C ATOM 828 NZ LYS A 55 4.349 -25.387 -9.834 1.00 10.00 N ATOM 0 H LYS A 55 -2.461 -27.183 -7.775 1.00 10.00 H new ATOM 0 HA LYS A 55 -0.369 -28.644 -6.575 1.00 10.00 H new ATOM 0 HB2 LYS A 55 -0.390 -27.682 -8.896 1.00 10.00 H new ATOM 0 HB3 LYS A 55 -0.331 -26.065 -8.221 1.00 10.00 H new ATOM 0 HG2 LYS A 55 1.863 -26.830 -7.031 1.00 10.00 H new ATOM 0 HG3 LYS A 55 1.827 -28.212 -8.108 1.00 10.00 H new ATOM 0 HD2 LYS A 55 1.943 -26.763 -10.086 1.00 10.00 H new ATOM 0 HD3 LYS A 55 1.739 -25.324 -9.106 1.00 10.00 H new ATOM 0 HE2 LYS A 55 3.865 -25.934 -7.853 1.00 10.00 H new ATOM 0 HE3 LYS A 55 4.084 -27.285 -8.948 1.00 10.00 H new ATOM 0 HZ1 LYS A 55 5.371 -25.379 -9.640 1.00 10.00 H new ATOM 0 HZ2 LYS A 55 4.183 -25.732 -10.801 1.00 10.00 H new ATOM 0 HZ3 LYS A 55 3.971 -24.423 -9.741 1.00 10.00 H new ATOM 842 N GLY A 56 -0.688 -25.529 -5.496 1.00 10.00 N ATOM 843 CA GLY A 56 -0.245 -24.540 -4.528 1.00 10.00 C ATOM 844 C GLY A 56 1.200 -24.059 -4.701 1.00 10.00 C ATOM 845 O GLY A 56 1.929 -24.472 -5.600 1.00 10.00 O ATOM 0 H GLY A 56 -1.397 -25.174 -6.137 1.00 10.00 H new ATOM 0 HA2 GLY A 56 -0.908 -23.677 -4.585 1.00 10.00 H new ATOM 0 HA3 GLY A 56 -0.354 -24.960 -3.528 1.00 10.00 H new ATOM 849 N ILE A 57 1.569 -23.151 -3.792 1.00 10.00 N ATOM 850 CA ILE A 57 2.784 -22.310 -3.765 1.00 10.00 C ATOM 851 C ILE A 57 2.947 -21.543 -2.426 1.00 10.00 C ATOM 852 O ILE A 57 3.953 -20.867 -2.246 1.00 10.00 O ATOM 853 CB ILE A 57 2.796 -21.261 -4.927 1.00 10.00 C ATOM 854 CG1 ILE A 57 1.417 -20.722 -5.372 1.00 10.00 C ATOM 855 CG2 ILE A 57 3.545 -21.775 -6.166 1.00 10.00 C ATOM 856 CD1 ILE A 57 0.615 -20.056 -4.251 1.00 10.00 C ATOM 0 H ILE A 57 0.977 -22.965 -2.982 1.00 10.00 H new ATOM 0 HA ILE A 57 3.614 -23.006 -3.885 1.00 10.00 H new ATOM 0 HB ILE A 57 3.324 -20.421 -4.476 1.00 10.00 H new ATOM 0 HG12 ILE A 57 1.563 -20.002 -6.177 1.00 10.00 H new ATOM 0 HG13 ILE A 57 0.832 -21.545 -5.783 1.00 10.00 H new ATOM 0 HG21 ILE A 57 3.526 -21.013 -6.945 1.00 10.00 H new ATOM 0 HG22 ILE A 57 4.579 -21.997 -5.900 1.00 10.00 H new ATOM 0 HG23 ILE A 57 3.062 -22.681 -6.533 1.00 10.00 H new ATOM 0 HD11 ILE A 57 -0.339 -19.705 -4.645 1.00 10.00 H new ATOM 0 HD12 ILE A 57 0.435 -20.778 -3.454 1.00 10.00 H new ATOM 0 HD13 ILE A 57 1.177 -19.210 -3.855 1.00 10.00 H new ATOM 868 N THR A 58 2.011 -21.673 -1.466 1.00 10.00 N ATOM 869 CA THR A 58 1.804 -20.784 -0.303 1.00 10.00 C ATOM 870 C THR A 58 1.599 -19.314 -0.695 1.00 10.00 C ATOM 871 O THR A 58 2.535 -18.605 -1.070 1.00 10.00 O ATOM 872 CB THR A 58 2.921 -20.924 0.747 1.00 10.00 C ATOM 873 OG1 THR A 58 3.063 -22.282 1.090 1.00 10.00 O ATOM 874 CG2 THR A 58 2.591 -20.167 2.038 1.00 10.00 C ATOM 0 H THR A 58 1.342 -22.443 -1.481 1.00 10.00 H new ATOM 0 HA THR A 58 0.874 -21.121 0.154 1.00 10.00 H new ATOM 0 HB THR A 58 3.831 -20.513 0.310 1.00 10.00 H new ATOM 0 HG1 THR A 58 3.774 -22.378 1.757 1.00 10.00 H new ATOM 0 HG21 THR A 58 3.405 -20.292 2.752 1.00 10.00 H new ATOM 0 HG22 THR A 58 2.463 -19.108 1.816 1.00 10.00 H new ATOM 0 HG23 THR A 58 1.670 -20.562 2.466 1.00 10.00 H new ATOM 882 N TRP A 59 0.356 -18.829 -0.595 1.00 10.00 N ATOM 883 CA TRP A 59 0.048 -17.409 -0.781 1.00 10.00 C ATOM 884 C TRP A 59 0.642 -16.551 0.336 1.00 10.00 C ATOM 885 O TRP A 59 0.327 -16.764 1.507 1.00 10.00 O ATOM 886 CB TRP A 59 -1.462 -17.191 -0.872 1.00 10.00 C ATOM 887 CG TRP A 59 -2.106 -17.681 -2.130 1.00 10.00 C ATOM 888 CD1 TRP A 59 -3.249 -18.398 -2.193 1.00 10.00 C ATOM 889 CD2 TRP A 59 -1.676 -17.499 -3.517 1.00 10.00 C ATOM 890 NE1 TRP A 59 -3.555 -18.667 -3.507 1.00 10.00 N ATOM 891 CE2 TRP A 59 -2.608 -18.166 -4.366 1.00 10.00 C ATOM 892 CE3 TRP A 59 -0.584 -16.862 -4.149 1.00 10.00 C ATOM 893 CZ2 TRP A 59 -2.462 -18.224 -5.756 1.00 10.00 C ATOM 894 CZ3 TRP A 59 -0.404 -16.951 -5.537 1.00 10.00 C ATOM 895 CH2 TRP A 59 -1.338 -17.625 -6.340 1.00 10.00 C ATOM 0 H TRP A 59 -0.458 -19.406 -0.384 1.00 10.00 H new ATOM 0 HA TRP A 59 0.506 -17.097 -1.720 1.00 10.00 H new ATOM 0 HB2 TRP A 59 -1.935 -17.687 -0.025 1.00 10.00 H new ATOM 0 HB3 TRP A 59 -1.665 -16.125 -0.771 1.00 10.00 H new ATOM 0 HD1 TRP A 59 -3.834 -18.712 -1.341 1.00 10.00 H new ATOM 0 HE1 TRP A 59 -4.386 -19.177 -3.807 1.00 10.00 H new ATOM 0 HE3 TRP A 59 0.121 -16.299 -3.555 1.00 10.00 H new ATOM 0 HZ2 TRP A 59 -3.201 -18.721 -6.367 1.00 10.00 H new ATOM 0 HZ3 TRP A 59 0.463 -16.496 -5.993 1.00 10.00 H new ATOM 0 HH2 TRP A 59 -1.190 -17.682 -7.408 1.00 10.00 H new ATOM 906 N LYS A 60 1.466 -15.567 -0.050 1.00 10.00 N ATOM 907 CA LYS A 60 2.209 -14.641 0.815 1.00 10.00 C ATOM 908 C LYS A 60 2.688 -13.410 0.020 1.00 10.00 C ATOM 909 O LYS A 60 2.472 -13.332 -1.192 1.00 10.00 O ATOM 910 CB LYS A 60 3.391 -15.391 1.471 1.00 10.00 C ATOM 911 CG LYS A 60 4.420 -15.937 0.456 1.00 10.00 C ATOM 912 CD LYS A 60 5.866 -15.542 0.770 1.00 10.00 C ATOM 913 CE LYS A 60 6.449 -16.253 1.995 1.00 10.00 C ATOM 914 NZ LYS A 60 7.793 -15.711 2.304 1.00 10.00 N ATOM 0 H LYS A 60 1.642 -15.385 -1.038 1.00 10.00 H new ATOM 0 HA LYS A 60 1.550 -14.274 1.602 1.00 10.00 H new ATOM 0 HB2 LYS A 60 3.898 -14.718 2.163 1.00 10.00 H new ATOM 0 HB3 LYS A 60 3.001 -16.220 2.061 1.00 10.00 H new ATOM 0 HG2 LYS A 60 4.348 -17.024 0.429 1.00 10.00 H new ATOM 0 HG3 LYS A 60 4.162 -15.575 -0.539 1.00 10.00 H new ATOM 0 HD2 LYS A 60 6.489 -15.762 -0.097 1.00 10.00 H new ATOM 0 HD3 LYS A 60 5.912 -14.465 0.931 1.00 10.00 H new ATOM 0 HE2 LYS A 60 5.788 -16.120 2.852 1.00 10.00 H new ATOM 0 HE3 LYS A 60 6.515 -17.325 1.807 1.00 10.00 H new ATOM 0 HZ1 LYS A 60 8.501 -16.468 2.217 1.00 10.00 H new ATOM 0 HZ2 LYS A 60 8.020 -14.946 1.637 1.00 10.00 H new ATOM 0 HZ3 LYS A 60 7.802 -15.338 3.275 1.00 10.00 H new ATOM 928 N GLU A 61 3.349 -12.465 0.704 1.00 10.00 N ATOM 929 CA GLU A 61 3.822 -11.138 0.246 1.00 10.00 C ATOM 930 C GLU A 61 4.998 -11.219 -0.762 1.00 10.00 C ATOM 931 O GLU A 61 5.935 -10.431 -0.715 1.00 10.00 O ATOM 932 CB GLU A 61 4.095 -10.282 1.514 1.00 10.00 C ATOM 933 CG GLU A 61 4.265 -8.761 1.309 1.00 10.00 C ATOM 934 CD GLU A 61 3.796 -7.932 2.527 1.00 10.00 C ATOM 935 OE1 GLU A 61 4.522 -7.824 3.545 1.00 10.00 O ATOM 936 OE2 GLU A 61 2.665 -7.391 2.504 1.00 10.00 O ATOM 0 H GLU A 61 3.592 -12.618 1.683 1.00 10.00 H new ATOM 0 HA GLU A 61 3.054 -10.642 -0.348 1.00 10.00 H new ATOM 0 HB2 GLU A 61 3.274 -10.440 2.213 1.00 10.00 H new ATOM 0 HB3 GLU A 61 4.998 -10.663 1.992 1.00 10.00 H new ATOM 0 HG2 GLU A 61 5.314 -8.542 1.109 1.00 10.00 H new ATOM 0 HG3 GLU A 61 3.702 -8.453 0.428 1.00 10.00 H new ATOM 943 N GLU A 62 4.909 -12.164 -1.706 1.00 10.00 N ATOM 944 CA GLU A 62 5.870 -12.534 -2.752 1.00 10.00 C ATOM 945 C GLU A 62 5.123 -13.335 -3.838 1.00 10.00 C ATOM 946 O GLU A 62 4.958 -12.866 -4.959 1.00 10.00 O ATOM 947 CB GLU A 62 7.008 -13.431 -2.212 1.00 10.00 C ATOM 948 CG GLU A 62 7.954 -12.808 -1.179 1.00 10.00 C ATOM 949 CD GLU A 62 9.051 -13.804 -0.786 1.00 10.00 C ATOM 950 OE1 GLU A 62 10.101 -13.819 -1.460 1.00 10.00 O ATOM 951 OE2 GLU A 62 8.814 -14.571 0.179 1.00 10.00 O ATOM 0 H GLU A 62 4.075 -12.749 -1.761 1.00 10.00 H new ATOM 0 HA GLU A 62 6.308 -11.614 -3.140 1.00 10.00 H new ATOM 0 HB2 GLU A 62 6.558 -14.319 -1.767 1.00 10.00 H new ATOM 0 HB3 GLU A 62 7.606 -13.767 -3.059 1.00 10.00 H new ATOM 0 HG2 GLU A 62 8.405 -11.904 -1.589 1.00 10.00 H new ATOM 0 HG3 GLU A 62 7.391 -12.510 -0.294 1.00 10.00 H new ATOM 958 N THR A 63 4.599 -14.521 -3.503 1.00 10.00 N ATOM 959 CA THR A 63 3.842 -15.401 -4.410 1.00 10.00 C ATOM 960 C THR A 63 2.563 -14.755 -4.909 1.00 10.00 C ATOM 961 O THR A 63 2.287 -14.807 -6.105 1.00 10.00 O ATOM 962 CB THR A 63 3.538 -16.744 -3.724 1.00 10.00 C ATOM 963 OG1 THR A 63 2.783 -16.539 -2.549 1.00 10.00 O ATOM 964 CG2 THR A 63 4.818 -17.477 -3.317 1.00 10.00 C ATOM 0 H THR A 63 4.692 -14.909 -2.564 1.00 10.00 H new ATOM 0 HA THR A 63 4.470 -15.580 -5.283 1.00 10.00 H new ATOM 0 HB THR A 63 2.984 -17.342 -4.448 1.00 10.00 H new ATOM 0 HG1 THR A 63 2.531 -17.405 -2.167 1.00 10.00 H new ATOM 0 HG21 THR A 63 4.560 -18.420 -2.836 1.00 10.00 H new ATOM 0 HG22 THR A 63 5.422 -17.675 -4.203 1.00 10.00 H new ATOM 0 HG23 THR A 63 5.386 -16.859 -2.622 1.00 10.00 H new ATOM 972 N LEU A 64 1.806 -14.098 -4.029 1.00 10.00 N ATOM 973 CA LEU A 64 0.631 -13.332 -4.408 1.00 10.00 C ATOM 974 C LEU A 64 1.016 -12.026 -5.097 1.00 10.00 C ATOM 975 O LEU A 64 0.252 -11.545 -5.919 1.00 10.00 O ATOM 976 CB LEU A 64 -0.246 -13.087 -3.166 1.00 10.00 C ATOM 977 CG LEU A 64 -1.742 -13.338 -3.413 1.00 10.00 C ATOM 978 CD1 LEU A 64 -2.489 -13.232 -2.086 1.00 10.00 C ATOM 979 CD2 LEU A 64 -2.378 -12.335 -4.382 1.00 10.00 C ATOM 0 H LEU A 64 1.997 -14.086 -3.027 1.00 10.00 H new ATOM 0 HA LEU A 64 0.053 -13.906 -5.132 1.00 10.00 H new ATOM 0 HB2 LEU A 64 0.094 -13.734 -2.357 1.00 10.00 H new ATOM 0 HB3 LEU A 64 -0.109 -12.059 -2.831 1.00 10.00 H new ATOM 0 HG LEU A 64 -1.819 -14.330 -3.858 1.00 10.00 H new ATOM 0 HD11 LEU A 64 -3.552 -13.409 -2.252 1.00 10.00 H new ATOM 0 HD12 LEU A 64 -2.102 -13.976 -1.390 1.00 10.00 H new ATOM 0 HD13 LEU A 64 -2.348 -12.235 -1.668 1.00 10.00 H new ATOM 0 HD21 LEU A 64 -3.434 -12.572 -4.510 1.00 10.00 H new ATOM 0 HD22 LEU A 64 -2.279 -11.327 -3.979 1.00 10.00 H new ATOM 0 HD23 LEU A 64 -1.874 -12.392 -5.347 1.00 10.00 H new ATOM 991 N MET A 65 2.208 -11.481 -4.841 1.00 10.00 N ATOM 992 CA MET A 65 2.719 -10.353 -5.612 1.00 10.00 C ATOM 993 C MET A 65 2.923 -10.787 -7.066 1.00 10.00 C ATOM 994 O MET A 65 2.346 -10.179 -7.961 1.00 10.00 O ATOM 995 CB MET A 65 3.996 -9.801 -4.957 1.00 10.00 C ATOM 996 CG MET A 65 4.251 -8.355 -5.372 1.00 10.00 C ATOM 997 SD MET A 65 5.795 -7.630 -4.746 1.00 10.00 S ATOM 998 CE MET A 65 5.529 -7.724 -2.952 1.00 10.00 C ATOM 0 H MET A 65 2.835 -11.805 -4.105 1.00 10.00 H new ATOM 0 HA MET A 65 1.999 -9.534 -5.618 1.00 10.00 H new ATOM 0 HB2 MET A 65 3.906 -9.860 -3.872 1.00 10.00 H new ATOM 0 HB3 MET A 65 4.849 -10.419 -5.240 1.00 10.00 H new ATOM 0 HG2 MET A 65 4.259 -8.303 -6.461 1.00 10.00 H new ATOM 0 HG3 MET A 65 3.416 -7.743 -5.030 1.00 10.00 H new ATOM 0 HE1 MET A 65 6.317 -7.174 -2.438 1.00 10.00 H new ATOM 0 HE2 MET A 65 4.561 -7.288 -2.704 1.00 10.00 H new ATOM 0 HE3 MET A 65 5.549 -8.767 -2.635 1.00 10.00 H new ATOM 1008 N GLU A 66 3.651 -11.888 -7.291 1.00 10.00 N ATOM 1009 CA GLU A 66 3.899 -12.435 -8.629 1.00 10.00 C ATOM 1010 C GLU A 66 2.593 -12.825 -9.315 1.00 10.00 C ATOM 1011 O GLU A 66 2.374 -12.524 -10.492 1.00 10.00 O ATOM 1012 CB GLU A 66 4.803 -13.676 -8.527 1.00 10.00 C ATOM 1013 CG GLU A 66 5.276 -14.198 -9.894 1.00 10.00 C ATOM 1014 CD GLU A 66 5.822 -13.120 -10.839 1.00 10.00 C ATOM 1015 OE1 GLU A 66 6.630 -12.286 -10.381 1.00 10.00 O ATOM 1016 OE2 GLU A 66 5.412 -13.148 -12.025 1.00 10.00 O ATOM 0 H GLU A 66 4.087 -12.428 -6.543 1.00 10.00 H new ATOM 0 HA GLU A 66 4.389 -11.663 -9.222 1.00 10.00 H new ATOM 0 HB2 GLU A 66 5.673 -13.434 -7.917 1.00 10.00 H new ATOM 0 HB3 GLU A 66 4.263 -14.469 -8.010 1.00 10.00 H new ATOM 0 HG2 GLU A 66 6.051 -14.947 -9.733 1.00 10.00 H new ATOM 0 HG3 GLU A 66 4.443 -14.702 -10.383 1.00 10.00 H new ATOM 1023 N TYR A 67 1.715 -13.493 -8.562 1.00 10.00 N ATOM 1024 CA TYR A 67 0.426 -13.900 -9.091 1.00 10.00 C ATOM 1025 C TYR A 67 -0.447 -12.689 -9.452 1.00 10.00 C ATOM 1026 O TYR A 67 -0.980 -12.661 -10.553 1.00 10.00 O ATOM 1027 CB TYR A 67 -0.269 -14.824 -8.102 1.00 10.00 C ATOM 1028 CG TYR A 67 -1.714 -15.149 -8.455 1.00 10.00 C ATOM 1029 CD1 TYR A 67 -2.010 -16.156 -9.399 1.00 10.00 C ATOM 1030 CD2 TYR A 67 -2.765 -14.436 -7.848 1.00 10.00 C ATOM 1031 CE1 TYR A 67 -3.350 -16.461 -9.710 1.00 10.00 C ATOM 1032 CE2 TYR A 67 -4.104 -14.714 -8.177 1.00 10.00 C ATOM 1033 CZ TYR A 67 -4.400 -15.733 -9.107 1.00 10.00 C ATOM 1034 OH TYR A 67 -5.692 -16.003 -9.436 1.00 10.00 O ATOM 0 H TYR A 67 1.879 -13.759 -7.591 1.00 10.00 H new ATOM 0 HA TYR A 67 0.589 -14.449 -10.018 1.00 10.00 H new ATOM 0 HB2 TYR A 67 0.294 -15.755 -8.035 1.00 10.00 H new ATOM 0 HB3 TYR A 67 -0.243 -14.364 -7.114 1.00 10.00 H new ATOM 0 HD1 TYR A 67 -1.208 -16.693 -9.884 1.00 10.00 H new ATOM 0 HD2 TYR A 67 -2.541 -13.668 -7.123 1.00 10.00 H new ATOM 0 HE1 TYR A 67 -3.575 -17.252 -10.410 1.00 10.00 H new ATOM 0 HE2 TYR A 67 -4.903 -14.149 -7.719 1.00 10.00 H new ATOM 0 HH TYR A 67 -6.179 -15.163 -9.566 1.00 10.00 H new ATOM 1044 N LEU A 68 -0.595 -11.680 -8.576 1.00 10.00 N ATOM 1045 CA LEU A 68 -1.397 -10.491 -8.892 1.00 10.00 C ATOM 1046 C LEU A 68 -0.811 -9.733 -10.091 1.00 10.00 C ATOM 1047 O LEU A 68 -1.572 -9.340 -10.969 1.00 10.00 O ATOM 1048 CB LEU A 68 -1.555 -9.586 -7.648 1.00 10.00 C ATOM 1049 CG LEU A 68 -2.864 -8.784 -7.509 1.00 10.00 C ATOM 1050 CD1 LEU A 68 -3.239 -7.924 -8.717 1.00 10.00 C ATOM 1051 CD2 LEU A 68 -4.035 -9.709 -7.167 1.00 10.00 C ATOM 0 H LEU A 68 -0.171 -11.666 -7.648 1.00 10.00 H new ATOM 0 HA LEU A 68 -2.396 -10.817 -9.180 1.00 10.00 H new ATOM 0 HB2 LEU A 68 -1.449 -10.212 -6.762 1.00 10.00 H new ATOM 0 HB3 LEU A 68 -0.726 -8.879 -7.640 1.00 10.00 H new ATOM 0 HG LEU A 68 -2.665 -8.087 -6.695 1.00 10.00 H new ATOM 0 HD11 LEU A 68 -4.175 -7.402 -8.516 1.00 10.00 H new ATOM 0 HD12 LEU A 68 -2.450 -7.195 -8.904 1.00 10.00 H new ATOM 0 HD13 LEU A 68 -3.360 -8.561 -9.593 1.00 10.00 H new ATOM 0 HD21 LEU A 68 -4.948 -9.121 -7.074 1.00 10.00 H new ATOM 0 HD22 LEU A 68 -4.158 -10.448 -7.959 1.00 10.00 H new ATOM 0 HD23 LEU A 68 -3.833 -10.218 -6.224 1.00 10.00 H new ATOM 1063 N GLU A 69 0.520 -9.570 -10.174 1.00 10.00 N ATOM 1064 CA GLU A 69 1.188 -8.990 -11.340 1.00 10.00 C ATOM 1065 C GLU A 69 0.831 -9.727 -12.644 1.00 10.00 C ATOM 1066 O GLU A 69 0.509 -9.079 -13.640 1.00 10.00 O ATOM 1067 CB GLU A 69 2.708 -9.011 -11.115 1.00 10.00 C ATOM 1068 CG GLU A 69 3.218 -8.073 -10.010 1.00 10.00 C ATOM 1069 CD GLU A 69 3.369 -6.607 -10.410 1.00 10.00 C ATOM 1070 OE1 GLU A 69 2.687 -6.121 -11.337 1.00 10.00 O ATOM 1071 OE2 GLU A 69 4.169 -5.900 -9.746 1.00 10.00 O ATOM 0 H GLU A 69 1.161 -9.840 -9.428 1.00 10.00 H new ATOM 0 HA GLU A 69 0.840 -7.963 -11.451 1.00 10.00 H new ATOM 0 HB2 GLU A 69 3.009 -10.030 -10.872 1.00 10.00 H new ATOM 0 HB3 GLU A 69 3.201 -8.747 -12.050 1.00 10.00 H new ATOM 0 HG2 GLU A 69 2.534 -8.132 -9.163 1.00 10.00 H new ATOM 0 HG3 GLU A 69 4.185 -8.439 -9.665 1.00 10.00 H new ATOM 1078 N ASN A 70 0.850 -11.072 -12.640 1.00 10.00 N ATOM 1079 CA ASN A 70 0.878 -11.908 -13.842 1.00 10.00 C ATOM 1080 C ASN A 70 0.411 -13.361 -13.524 1.00 10.00 C ATOM 1081 O ASN A 70 1.244 -14.279 -13.452 1.00 10.00 O ATOM 1082 CB ASN A 70 2.326 -11.908 -14.376 1.00 10.00 C ATOM 1083 CG ASN A 70 2.757 -10.620 -15.054 1.00 10.00 C ATOM 1084 OD1 ASN A 70 2.295 -10.290 -16.134 1.00 10.00 O ATOM 1085 ND2 ASN A 70 3.709 -9.909 -14.484 1.00 10.00 N ATOM 0 H ASN A 70 0.846 -11.616 -11.777 1.00 10.00 H new ATOM 0 HA ASN A 70 0.194 -11.509 -14.591 1.00 10.00 H new ATOM 0 HB2 ASN A 70 3.004 -12.109 -13.546 1.00 10.00 H new ATOM 0 HB3 ASN A 70 2.437 -12.729 -15.084 1.00 10.00 H new ATOM 0 HD21 ASN A 70 4.067 -9.073 -14.946 1.00 10.00 H new ATOM 0 HD22 ASN A 70 4.088 -10.195 -13.581 1.00 10.00 H new ATOM 1092 N PRO A 71 -0.915 -13.592 -13.366 1.00 10.00 N ATOM 1093 CA PRO A 71 -1.481 -14.777 -12.700 1.00 10.00 C ATOM 1094 C PRO A 71 -1.350 -16.075 -13.505 1.00 10.00 C ATOM 1095 O PRO A 71 -0.590 -16.964 -13.122 1.00 10.00 O ATOM 1096 CB PRO A 71 -2.943 -14.422 -12.385 1.00 10.00 C ATOM 1097 CG PRO A 71 -3.291 -13.325 -13.386 1.00 10.00 C ATOM 1098 CD PRO A 71 -1.963 -12.598 -13.576 1.00 10.00 C ATOM 0 HA PRO A 71 -0.917 -14.999 -11.794 1.00 10.00 H new ATOM 0 HB2 PRO A 71 -3.596 -15.287 -12.501 1.00 10.00 H new ATOM 0 HB3 PRO A 71 -3.055 -14.073 -11.358 1.00 10.00 H new ATOM 0 HG2 PRO A 71 -3.663 -13.738 -14.324 1.00 10.00 H new ATOM 0 HG3 PRO A 71 -4.064 -12.659 -13.002 1.00 10.00 H new ATOM 0 HD2 PRO A 71 -1.895 -12.168 -14.575 1.00 10.00 H new ATOM 0 HD3 PRO A 71 -1.866 -11.775 -12.867 1.00 10.00 H new ATOM 1106 N LYS A 72 -2.051 -16.176 -14.645 1.00 10.00 N ATOM 1107 CA LYS A 72 -2.043 -17.318 -15.570 1.00 10.00 C ATOM 1108 C LYS A 72 -0.642 -17.641 -16.125 1.00 10.00 C ATOM 1109 O LYS A 72 -0.395 -18.745 -16.598 1.00 10.00 O ATOM 1110 CB LYS A 72 -3.007 -17.008 -16.720 1.00 10.00 C ATOM 1111 CG LYS A 72 -4.471 -16.796 -16.287 1.00 10.00 C ATOM 1112 CD LYS A 72 -5.393 -16.538 -17.489 1.00 10.00 C ATOM 1113 CE LYS A 72 -5.202 -15.124 -18.053 1.00 10.00 C ATOM 1114 NZ LYS A 72 -5.910 -14.952 -19.342 1.00 10.00 N ATOM 0 H LYS A 72 -2.668 -15.428 -14.961 1.00 10.00 H new ATOM 0 HA LYS A 72 -2.358 -18.203 -15.017 1.00 10.00 H new ATOM 0 HB2 LYS A 72 -2.661 -16.113 -17.236 1.00 10.00 H new ATOM 0 HB3 LYS A 72 -2.969 -17.826 -17.440 1.00 10.00 H new ATOM 0 HG2 LYS A 72 -4.820 -17.674 -15.744 1.00 10.00 H new ATOM 0 HG3 LYS A 72 -4.527 -15.953 -15.599 1.00 10.00 H new ATOM 0 HD2 LYS A 72 -5.190 -17.272 -18.269 1.00 10.00 H new ATOM 0 HD3 LYS A 72 -6.432 -16.673 -17.187 1.00 10.00 H new ATOM 0 HE2 LYS A 72 -5.570 -14.392 -17.334 1.00 10.00 H new ATOM 0 HE3 LYS A 72 -4.139 -14.927 -18.192 1.00 10.00 H new ATOM 0 HZ1 LYS A 72 -5.760 -13.985 -19.694 1.00 10.00 H new ATOM 0 HZ2 LYS A 72 -5.541 -15.634 -20.035 1.00 10.00 H new ATOM 0 HZ3 LYS A 72 -6.928 -15.115 -19.204 1.00 10.00 H new ATOM 1128 N LYS A 73 0.269 -16.662 -16.065 1.00 10.00 N ATOM 1129 CA LYS A 73 1.705 -16.779 -16.341 1.00 10.00 C ATOM 1130 C LYS A 73 2.440 -17.468 -15.192 1.00 10.00 C ATOM 1131 O LYS A 73 3.258 -18.348 -15.437 1.00 10.00 O ATOM 1132 CB LYS A 73 2.250 -15.367 -16.604 1.00 10.00 C ATOM 1133 CG LYS A 73 3.685 -15.278 -17.150 1.00 10.00 C ATOM 1134 CD LYS A 73 4.843 -15.405 -16.142 1.00 10.00 C ATOM 1135 CE LYS A 73 4.920 -14.289 -15.088 1.00 10.00 C ATOM 1136 NZ LYS A 73 4.162 -14.580 -13.846 1.00 10.00 N ATOM 0 H LYS A 73 0.007 -15.711 -15.807 1.00 10.00 H new ATOM 0 HA LYS A 73 1.868 -17.405 -17.219 1.00 10.00 H new ATOM 0 HB2 LYS A 73 1.585 -14.870 -17.310 1.00 10.00 H new ATOM 0 HB3 LYS A 73 2.204 -14.804 -15.672 1.00 10.00 H new ATOM 0 HG2 LYS A 73 3.807 -16.058 -17.901 1.00 10.00 H new ATOM 0 HG3 LYS A 73 3.790 -14.322 -17.663 1.00 10.00 H new ATOM 0 HD2 LYS A 73 4.753 -16.362 -15.628 1.00 10.00 H new ATOM 0 HD3 LYS A 73 5.783 -15.427 -16.694 1.00 10.00 H new ATOM 0 HE2 LYS A 73 5.965 -14.117 -14.832 1.00 10.00 H new ATOM 0 HE3 LYS A 73 4.542 -13.364 -15.524 1.00 10.00 H new ATOM 0 HZ1 LYS A 73 4.493 -13.956 -13.083 1.00 10.00 H new ATOM 0 HZ2 LYS A 73 3.148 -14.416 -14.011 1.00 10.00 H new ATOM 0 HZ3 LYS A 73 4.312 -15.572 -13.572 1.00 10.00 H new ATOM 1150 N TYR A 74 2.192 -17.037 -13.948 1.00 10.00 N ATOM 1151 CA TYR A 74 2.829 -17.597 -12.753 1.00 10.00 C ATOM 1152 C TYR A 74 2.519 -19.083 -12.555 1.00 10.00 C ATOM 1153 O TYR A 74 3.411 -19.849 -12.193 1.00 10.00 O ATOM 1154 CB TYR A 74 2.455 -16.792 -11.502 1.00 10.00 C ATOM 1155 CG TYR A 74 3.170 -17.228 -10.231 1.00 10.00 C ATOM 1156 CD1 TYR A 74 4.565 -17.448 -10.217 1.00 10.00 C ATOM 1157 CD2 TYR A 74 2.437 -17.379 -9.040 1.00 10.00 C ATOM 1158 CE1 TYR A 74 5.214 -17.815 -9.024 1.00 10.00 C ATOM 1159 CE2 TYR A 74 3.087 -17.700 -7.834 1.00 10.00 C ATOM 1160 CZ TYR A 74 4.477 -17.941 -7.829 1.00 10.00 C ATOM 1161 OH TYR A 74 5.108 -18.310 -6.683 1.00 10.00 O ATOM 0 H TYR A 74 1.537 -16.282 -13.743 1.00 10.00 H new ATOM 0 HA TYR A 74 3.905 -17.519 -12.911 1.00 10.00 H new ATOM 0 HB2 TYR A 74 2.674 -15.740 -11.684 1.00 10.00 H new ATOM 0 HB3 TYR A 74 1.379 -16.871 -11.343 1.00 10.00 H new ATOM 0 HD1 TYR A 74 5.136 -17.334 -11.126 1.00 10.00 H new ATOM 0 HD2 TYR A 74 1.365 -17.247 -9.051 1.00 10.00 H new ATOM 0 HE1 TYR A 74 6.278 -18.000 -9.024 1.00 10.00 H new ATOM 0 HE2 TYR A 74 2.523 -17.762 -6.915 1.00 10.00 H new ATOM 0 HH TYR A 74 6.037 -17.998 -6.706 1.00 10.00 H new ATOM 1171 N ILE A 75 1.266 -19.487 -12.796 1.00 10.00 N ATOM 1172 CA ILE A 75 0.792 -20.854 -12.559 1.00 10.00 C ATOM 1173 C ILE A 75 -0.141 -21.326 -13.694 1.00 10.00 C ATOM 1174 O ILE A 75 -1.006 -20.559 -14.116 1.00 10.00 O ATOM 1175 CB ILE A 75 0.133 -20.974 -11.165 1.00 10.00 C ATOM 1176 CG1 ILE A 75 -0.929 -19.875 -10.906 1.00 10.00 C ATOM 1177 CG2 ILE A 75 1.229 -20.995 -10.081 1.00 10.00 C ATOM 1178 CD1 ILE A 75 -1.431 -19.858 -9.464 1.00 10.00 C ATOM 0 H ILE A 75 0.546 -18.866 -13.165 1.00 10.00 H new ATOM 0 HA ILE A 75 1.653 -21.522 -12.564 1.00 10.00 H new ATOM 0 HB ILE A 75 -0.417 -21.914 -11.127 1.00 10.00 H new ATOM 0 HG12 ILE A 75 -0.503 -18.901 -11.148 1.00 10.00 H new ATOM 0 HG13 ILE A 75 -1.774 -20.029 -11.577 1.00 10.00 H new ATOM 0 HG21 ILE A 75 0.767 -21.080 -9.098 1.00 10.00 H new ATOM 0 HG22 ILE A 75 1.888 -21.847 -10.246 1.00 10.00 H new ATOM 0 HG23 ILE A 75 1.808 -20.073 -10.131 1.00 10.00 H new ATOM 0 HD11 ILE A 75 -2.172 -19.067 -9.346 1.00 10.00 H new ATOM 0 HD12 ILE A 75 -1.885 -20.820 -9.226 1.00 10.00 H new ATOM 0 HD13 ILE A 75 -0.594 -19.675 -8.790 1.00 10.00 H new ATOM 1190 N PRO A 76 0.018 -22.572 -14.196 1.00 10.00 N ATOM 1191 CA PRO A 76 -0.626 -23.062 -15.421 1.00 10.00 C ATOM 1192 C PRO A 76 -2.103 -23.447 -15.206 1.00 10.00 C ATOM 1193 O PRO A 76 -2.493 -24.606 -15.321 1.00 10.00 O ATOM 1194 CB PRO A 76 0.250 -24.238 -15.875 1.00 10.00 C ATOM 1195 CG PRO A 76 0.717 -24.833 -14.550 1.00 10.00 C ATOM 1196 CD PRO A 76 0.951 -23.582 -13.705 1.00 10.00 C ATOM 0 HA PRO A 76 -0.684 -22.290 -16.188 1.00 10.00 H new ATOM 0 HB2 PRO A 76 -0.314 -24.959 -16.467 1.00 10.00 H new ATOM 0 HB3 PRO A 76 1.088 -23.907 -16.489 1.00 10.00 H new ATOM 0 HG2 PRO A 76 -0.035 -25.488 -14.110 1.00 10.00 H new ATOM 0 HG3 PRO A 76 1.626 -25.423 -14.666 1.00 10.00 H new ATOM 0 HD2 PRO A 76 0.779 -23.789 -12.649 1.00 10.00 H new ATOM 0 HD3 PRO A 76 1.981 -23.237 -13.798 1.00 10.00 H new ATOM 1204 N GLY A 77 -2.932 -22.450 -14.903 1.00 10.00 N ATOM 1205 CA GLY A 77 -4.376 -22.546 -14.737 1.00 10.00 C ATOM 1206 C GLY A 77 -4.985 -21.147 -14.731 1.00 10.00 C ATOM 1207 O GLY A 77 -4.483 -20.249 -15.407 1.00 10.00 O ATOM 0 H GLY A 77 -2.591 -21.499 -14.759 1.00 10.00 H new ATOM 0 HA2 GLY A 77 -4.806 -23.137 -15.545 1.00 10.00 H new ATOM 0 HA3 GLY A 77 -4.612 -23.060 -13.805 1.00 10.00 H new ATOM 1211 N THR A 78 -6.050 -20.975 -13.942 1.00 10.00 N ATOM 1212 CA THR A 78 -6.672 -19.704 -13.563 1.00 10.00 C ATOM 1213 C THR A 78 -7.506 -19.043 -14.672 1.00 10.00 C ATOM 1214 O THR A 78 -7.203 -19.111 -15.861 1.00 10.00 O ATOM 1215 CB THR A 78 -5.616 -18.771 -12.930 1.00 10.00 C ATOM 1216 OG1 THR A 78 -5.068 -19.386 -11.784 1.00 10.00 O ATOM 1217 CG2 THR A 78 -6.151 -17.410 -12.493 1.00 10.00 C ATOM 0 H THR A 78 -6.531 -21.772 -13.524 1.00 10.00 H new ATOM 0 HA THR A 78 -7.423 -19.925 -12.805 1.00 10.00 H new ATOM 0 HB THR A 78 -4.879 -18.602 -13.715 1.00 10.00 H new ATOM 0 HG1 THR A 78 -5.789 -19.621 -11.163 1.00 10.00 H new ATOM 0 HG21 THR A 78 -5.341 -16.823 -12.060 1.00 10.00 H new ATOM 0 HG22 THR A 78 -6.559 -16.885 -13.357 1.00 10.00 H new ATOM 0 HG23 THR A 78 -6.936 -17.549 -11.749 1.00 10.00 H new ATOM 1225 N LYS A 79 -8.565 -18.343 -14.240 1.00 10.00 N ATOM 1226 CA LYS A 79 -9.524 -17.586 -15.066 1.00 10.00 C ATOM 1227 C LYS A 79 -9.943 -16.271 -14.388 1.00 10.00 C ATOM 1228 O LYS A 79 -10.947 -15.662 -14.740 1.00 10.00 O ATOM 1229 CB LYS A 79 -10.748 -18.464 -15.420 1.00 10.00 C ATOM 1230 CG LYS A 79 -10.480 -19.580 -16.446 1.00 10.00 C ATOM 1231 CD LYS A 79 -9.970 -19.045 -17.790 1.00 10.00 C ATOM 1232 CE LYS A 79 -9.881 -20.158 -18.837 1.00 10.00 C ATOM 1233 NZ LYS A 79 -9.090 -19.704 -20.002 1.00 10.00 N ATOM 0 H LYS A 79 -8.790 -18.285 -13.247 1.00 10.00 H new ATOM 0 HA LYS A 79 -9.026 -17.314 -15.997 1.00 10.00 H new ATOM 0 HB2 LYS A 79 -11.126 -18.918 -14.504 1.00 10.00 H new ATOM 0 HB3 LYS A 79 -11.538 -17.820 -15.806 1.00 10.00 H new ATOM 0 HG2 LYS A 79 -9.748 -20.275 -16.036 1.00 10.00 H new ATOM 0 HG3 LYS A 79 -11.398 -20.144 -16.610 1.00 10.00 H new ATOM 0 HD2 LYS A 79 -10.636 -18.260 -18.147 1.00 10.00 H new ATOM 0 HD3 LYS A 79 -8.988 -18.592 -17.654 1.00 10.00 H new ATOM 0 HE2 LYS A 79 -9.420 -21.043 -18.399 1.00 10.00 H new ATOM 0 HE3 LYS A 79 -10.882 -20.446 -19.158 1.00 10.00 H new ATOM 0 HZ1 LYS A 79 -9.037 -20.469 -20.705 1.00 10.00 H new ATOM 0 HZ2 LYS A 79 -9.546 -18.872 -20.428 1.00 10.00 H new ATOM 0 HZ3 LYS A 79 -8.130 -19.452 -19.693 1.00 10.00 H new ATOM 1247 N MET A 80 -9.114 -15.790 -13.458 1.00 10.00 N ATOM 1248 CA MET A 80 -9.062 -14.401 -13.017 1.00 10.00 C ATOM 1249 C MET A 80 -8.737 -13.492 -14.215 1.00 10.00 C ATOM 1250 O MET A 80 -7.578 -13.376 -14.616 1.00 10.00 O ATOM 1251 CB MET A 80 -8.001 -14.299 -11.908 1.00 10.00 C ATOM 1252 CG MET A 80 -7.804 -12.878 -11.388 1.00 10.00 C ATOM 1253 SD MET A 80 -6.965 -12.837 -9.787 1.00 10.00 S ATOM 1254 CE MET A 80 -6.468 -11.097 -9.765 1.00 10.00 C ATOM 0 H MET A 80 -8.437 -16.382 -12.976 1.00 10.00 H new ATOM 0 HA MET A 80 -10.022 -14.073 -12.618 1.00 10.00 H new ATOM 0 HB2 MET A 80 -8.289 -14.945 -11.079 1.00 10.00 H new ATOM 0 HB3 MET A 80 -7.051 -14.674 -12.289 1.00 10.00 H new ATOM 0 HG2 MET A 80 -7.225 -12.306 -12.113 1.00 10.00 H new ATOM 0 HG3 MET A 80 -8.774 -12.389 -11.299 1.00 10.00 H new ATOM 0 HE1 MET A 80 -6.226 -10.801 -8.744 1.00 10.00 H new ATOM 0 HE2 MET A 80 -5.592 -10.961 -10.400 1.00 10.00 H new ATOM 0 HE3 MET A 80 -7.286 -10.480 -10.138 1.00 10.00 H new ATOM 1264 N ILE A 81 -9.760 -12.870 -14.815 1.00 10.00 N ATOM 1265 CA ILE A 81 -9.616 -11.944 -15.952 1.00 10.00 C ATOM 1266 C ILE A 81 -9.075 -10.579 -15.467 1.00 10.00 C ATOM 1267 O ILE A 81 -9.703 -9.537 -15.644 1.00 10.00 O ATOM 1268 CB ILE A 81 -10.930 -11.823 -16.779 1.00 10.00 C ATOM 1269 CG1 ILE A 81 -11.653 -13.170 -17.036 1.00 10.00 C ATOM 1270 CG2 ILE A 81 -10.607 -11.204 -18.154 1.00 10.00 C ATOM 1271 CD1 ILE A 81 -12.784 -13.445 -16.037 1.00 10.00 C ATOM 0 H ILE A 81 -10.728 -12.996 -14.521 1.00 10.00 H new ATOM 0 HA ILE A 81 -8.880 -12.357 -16.642 1.00 10.00 H new ATOM 0 HB ILE A 81 -11.597 -11.203 -16.180 1.00 10.00 H new ATOM 0 HG12 ILE A 81 -12.061 -13.170 -18.047 1.00 10.00 H new ATOM 0 HG13 ILE A 81 -10.927 -13.981 -16.986 1.00 10.00 H new ATOM 0 HG21 ILE A 81 -11.523 -11.117 -18.738 1.00 10.00 H new ATOM 0 HG22 ILE A 81 -10.170 -10.215 -18.014 1.00 10.00 H new ATOM 0 HG23 ILE A 81 -9.899 -11.842 -18.683 1.00 10.00 H new ATOM 0 HD11 ILE A 81 -13.251 -14.402 -16.270 1.00 10.00 H new ATOM 0 HD12 ILE A 81 -12.377 -13.476 -15.026 1.00 10.00 H new ATOM 0 HD13 ILE A 81 -13.529 -12.652 -16.104 1.00 10.00 H new ATOM 1283 N PHE A 82 -7.901 -10.587 -14.821 1.00 10.00 N ATOM 1284 CA PHE A 82 -7.296 -9.411 -14.197 1.00 10.00 C ATOM 1285 C PHE A 82 -5.801 -9.638 -13.900 1.00 10.00 C ATOM 1286 O PHE A 82 -5.449 -10.414 -13.014 1.00 10.00 O ATOM 1287 CB PHE A 82 -8.063 -9.048 -12.912 1.00 10.00 C ATOM 1288 CG PHE A 82 -7.972 -7.589 -12.543 1.00 10.00 C ATOM 1289 CD1 PHE A 82 -8.620 -6.605 -13.314 1.00 10.00 C ATOM 1290 CD2 PHE A 82 -7.253 -7.224 -11.403 1.00 10.00 C ATOM 1291 CE1 PHE A 82 -8.522 -5.252 -12.942 1.00 10.00 C ATOM 1292 CE2 PHE A 82 -7.138 -5.873 -11.035 1.00 10.00 C ATOM 1293 CZ PHE A 82 -7.776 -4.884 -11.808 1.00 10.00 C ATOM 0 H PHE A 82 -7.337 -11.430 -14.718 1.00 10.00 H new ATOM 0 HA PHE A 82 -7.364 -8.578 -14.896 1.00 10.00 H new ATOM 0 HB2 PHE A 82 -9.112 -9.317 -13.037 1.00 10.00 H new ATOM 0 HB3 PHE A 82 -7.677 -9.647 -12.087 1.00 10.00 H new ATOM 0 HD1 PHE A 82 -9.190 -6.888 -14.187 1.00 10.00 H new ATOM 0 HD2 PHE A 82 -6.782 -7.986 -10.800 1.00 10.00 H new ATOM 0 HE1 PHE A 82 -9.021 -4.494 -13.528 1.00 10.00 H new ATOM 0 HE2 PHE A 82 -6.563 -5.595 -10.164 1.00 10.00 H new ATOM 0 HZ PHE A 82 -7.693 -3.844 -11.530 1.00 10.00 H new ATOM 1303 N ALA A 83 -4.922 -8.996 -14.679 1.00 10.00 N ATOM 1304 CA ALA A 83 -3.483 -8.881 -14.411 1.00 10.00 C ATOM 1305 C ALA A 83 -3.182 -7.845 -13.297 1.00 10.00 C ATOM 1306 O ALA A 83 -4.079 -7.474 -12.538 1.00 10.00 O ATOM 1307 CB ALA A 83 -2.786 -8.553 -15.740 1.00 10.00 C ATOM 0 H ALA A 83 -5.201 -8.527 -15.541 1.00 10.00 H new ATOM 0 HA ALA A 83 -3.093 -9.823 -14.025 1.00 10.00 H new ATOM 0 HB1 ALA A 83 -1.713 -8.461 -15.575 1.00 10.00 H new ATOM 0 HB2 ALA A 83 -2.975 -9.352 -16.457 1.00 10.00 H new ATOM 0 HB3 ALA A 83 -3.175 -7.613 -16.133 1.00 10.00 H new ATOM 1313 N GLY A 84 -1.927 -7.373 -13.207 1.00 10.00 N ATOM 1314 CA GLY A 84 -1.395 -6.423 -12.219 1.00 10.00 C ATOM 1315 C GLY A 84 -2.025 -5.025 -12.186 1.00 10.00 C ATOM 1316 O GLY A 84 -1.312 -4.032 -12.321 1.00 10.00 O ATOM 0 H GLY A 84 -1.209 -7.666 -13.869 1.00 10.00 H new ATOM 0 HA2 GLY A 84 -1.504 -6.867 -11.230 1.00 10.00 H new ATOM 0 HA3 GLY A 84 -0.326 -6.309 -12.401 1.00 10.00 H new ATOM 1320 N ILE A 85 -3.336 -4.949 -11.921 1.00 10.00 N ATOM 1321 CA ILE A 85 -4.159 -3.748 -11.733 1.00 10.00 C ATOM 1322 C ILE A 85 -3.864 -2.670 -12.800 1.00 10.00 C ATOM 1323 O ILE A 85 -4.033 -2.959 -13.986 1.00 10.00 O ATOM 1324 CB ILE A 85 -4.172 -3.353 -10.229 1.00 10.00 C ATOM 1325 CG1 ILE A 85 -5.135 -2.198 -9.879 1.00 10.00 C ATOM 1326 CG2 ILE A 85 -2.777 -3.082 -9.643 1.00 10.00 C ATOM 1327 CD1 ILE A 85 -5.701 -2.343 -8.461 1.00 10.00 C ATOM 0 H ILE A 85 -3.894 -5.797 -11.825 1.00 10.00 H new ATOM 0 HA ILE A 85 -5.212 -3.937 -11.943 1.00 10.00 H new ATOM 0 HB ILE A 85 -4.563 -4.250 -9.748 1.00 10.00 H new ATOM 0 HG12 ILE A 85 -4.610 -1.247 -9.966 1.00 10.00 H new ATOM 0 HG13 ILE A 85 -5.954 -2.176 -10.598 1.00 10.00 H new ATOM 0 HG21 ILE A 85 -2.870 -2.813 -8.591 1.00 10.00 H new ATOM 0 HG22 ILE A 85 -2.163 -3.978 -9.735 1.00 10.00 H new ATOM 0 HG23 ILE A 85 -2.307 -2.263 -10.187 1.00 10.00 H new ATOM 0 HD11 ILE A 85 -6.374 -1.512 -8.251 1.00 10.00 H new ATOM 0 HD12 ILE A 85 -6.248 -3.282 -8.382 1.00 10.00 H new ATOM 0 HD13 ILE A 85 -4.883 -2.338 -7.741 1.00 10.00 H new ATOM 1339 N LYS A 86 -3.470 -1.442 -12.424 1.00 10.00 N ATOM 1340 CA LYS A 86 -3.079 -0.352 -13.342 1.00 10.00 C ATOM 1341 C LYS A 86 -1.913 0.439 -12.753 1.00 10.00 C ATOM 1342 O LYS A 86 -0.773 0.256 -13.169 1.00 10.00 O ATOM 1343 CB LYS A 86 -4.282 0.558 -13.697 1.00 10.00 C ATOM 1344 CG LYS A 86 -5.454 -0.145 -14.401 1.00 10.00 C ATOM 1345 CD LYS A 86 -5.141 -0.638 -15.826 1.00 10.00 C ATOM 1346 CE LYS A 86 -6.035 -1.817 -16.236 1.00 10.00 C ATOM 1347 NZ LYS A 86 -7.478 -1.482 -16.196 1.00 10.00 N ATOM 0 H LYS A 86 -3.412 -1.169 -11.443 1.00 10.00 H new ATOM 0 HA LYS A 86 -2.745 -0.795 -14.280 1.00 10.00 H new ATOM 0 HB2 LYS A 86 -4.653 1.016 -12.780 1.00 10.00 H new ATOM 0 HB3 LYS A 86 -3.928 1.367 -14.337 1.00 10.00 H new ATOM 0 HG2 LYS A 86 -5.766 -0.996 -13.796 1.00 10.00 H new ATOM 0 HG3 LYS A 86 -6.299 0.542 -14.445 1.00 10.00 H new ATOM 0 HD2 LYS A 86 -5.276 0.182 -16.531 1.00 10.00 H new ATOM 0 HD3 LYS A 86 -4.095 -0.939 -15.884 1.00 10.00 H new ATOM 0 HE2 LYS A 86 -5.768 -2.137 -17.243 1.00 10.00 H new ATOM 0 HE3 LYS A 86 -5.844 -2.661 -15.573 1.00 10.00 H new ATOM 0 HZ1 LYS A 86 -8.034 -2.302 -16.514 1.00 10.00 H new ATOM 0 HZ2 LYS A 86 -7.750 -1.236 -15.223 1.00 10.00 H new ATOM 0 HZ3 LYS A 86 -7.664 -0.673 -16.823 1.00 10.00 H new ATOM 1361 N LYS A 87 -2.186 1.259 -11.732 1.00 10.00 N ATOM 1362 CA LYS A 87 -1.174 1.788 -10.815 1.00 10.00 C ATOM 1363 C LYS A 87 -0.500 0.611 -10.104 1.00 10.00 C ATOM 1364 O LYS A 87 -1.160 -0.067 -9.317 1.00 10.00 O ATOM 1365 CB LYS A 87 -1.846 2.712 -9.774 1.00 10.00 C ATOM 1366 CG LYS A 87 -2.024 4.185 -10.189 1.00 10.00 C ATOM 1367 CD LYS A 87 -0.957 5.107 -9.568 1.00 10.00 C ATOM 1368 CE LYS A 87 0.416 4.806 -10.168 1.00 10.00 C ATOM 1369 NZ LYS A 87 1.553 5.258 -9.333 1.00 10.00 N ATOM 0 H LYS A 87 -3.131 1.578 -11.518 1.00 10.00 H new ATOM 0 HA LYS A 87 -0.432 2.364 -11.369 1.00 10.00 H new ATOM 0 HB2 LYS A 87 -2.827 2.302 -9.535 1.00 10.00 H new ATOM 0 HB3 LYS A 87 -1.256 2.683 -8.858 1.00 10.00 H new ATOM 0 HG2 LYS A 87 -1.977 4.261 -11.275 1.00 10.00 H new ATOM 0 HG3 LYS A 87 -3.014 4.527 -9.888 1.00 10.00 H new ATOM 0 HD2 LYS A 87 -1.219 6.150 -9.746 1.00 10.00 H new ATOM 0 HD3 LYS A 87 -0.928 4.966 -8.488 1.00 10.00 H new ATOM 0 HE2 LYS A 87 0.502 3.732 -10.330 1.00 10.00 H new ATOM 0 HE3 LYS A 87 0.486 5.282 -11.146 1.00 10.00 H new ATOM 0 HZ1 LYS A 87 2.407 5.336 -9.922 1.00 10.00 H new ATOM 0 HZ2 LYS A 87 1.332 6.186 -8.919 1.00 10.00 H new ATOM 0 HZ3 LYS A 87 1.720 4.570 -8.572 1.00 10.00 H new ATOM 1383 N LYS A 88 0.803 0.381 -10.315 1.00 10.00 N ATOM 1384 CA LYS A 88 1.541 -0.605 -9.507 1.00 10.00 C ATOM 1385 C LYS A 88 1.599 -0.188 -8.032 1.00 10.00 C ATOM 1386 O LYS A 88 1.684 -1.060 -7.178 1.00 10.00 O ATOM 1387 CB LYS A 88 2.946 -0.878 -10.062 1.00 10.00 C ATOM 1388 CG LYS A 88 2.925 -1.369 -11.521 1.00 10.00 C ATOM 1389 CD LYS A 88 4.340 -1.628 -12.062 1.00 10.00 C ATOM 1390 CE LYS A 88 5.048 -2.782 -11.343 1.00 10.00 C ATOM 1391 NZ LYS A 88 4.460 -4.095 -11.689 1.00 10.00 N ATOM 0 H LYS A 88 1.362 0.854 -11.025 1.00 10.00 H new ATOM 0 HA LYS A 88 0.987 -1.541 -9.570 1.00 10.00 H new ATOM 0 HB2 LYS A 88 3.540 0.033 -9.999 1.00 10.00 H new ATOM 0 HB3 LYS A 88 3.439 -1.624 -9.439 1.00 10.00 H new ATOM 0 HG2 LYS A 88 2.338 -2.285 -11.587 1.00 10.00 H new ATOM 0 HG3 LYS A 88 2.428 -0.627 -12.146 1.00 10.00 H new ATOM 0 HD2 LYS A 88 4.282 -1.851 -13.127 1.00 10.00 H new ATOM 0 HD3 LYS A 88 4.936 -0.721 -11.958 1.00 10.00 H new ATOM 0 HE2 LYS A 88 6.106 -2.778 -11.606 1.00 10.00 H new ATOM 0 HE3 LYS A 88 4.986 -2.630 -10.265 1.00 10.00 H new ATOM 0 HZ1 LYS A 88 4.770 -4.807 -10.998 1.00 10.00 H new ATOM 0 HZ2 LYS A 88 3.422 -4.026 -11.673 1.00 10.00 H new ATOM 0 HZ3 LYS A 88 4.774 -4.376 -12.640 1.00 10.00 H new ATOM 1405 N THR A 89 1.421 1.106 -7.729 1.00 10.00 N ATOM 1406 CA THR A 89 1.130 1.604 -6.378 1.00 10.00 C ATOM 1407 C THR A 89 -0.070 0.901 -5.746 1.00 10.00 C ATOM 1408 O THR A 89 0.071 0.347 -4.665 1.00 10.00 O ATOM 1409 CB THR A 89 0.935 3.127 -6.352 1.00 10.00 C ATOM 1410 OG1 THR A 89 2.015 3.756 -7.004 1.00 10.00 O ATOM 1411 CG2 THR A 89 0.883 3.687 -4.929 1.00 10.00 C ATOM 0 H THR A 89 1.476 1.847 -8.427 1.00 10.00 H new ATOM 0 HA THR A 89 2.008 1.367 -5.777 1.00 10.00 H new ATOM 0 HB THR A 89 -0.014 3.325 -6.850 1.00 10.00 H new ATOM 0 HG1 THR A 89 2.125 4.664 -6.653 1.00 10.00 H new ATOM 0 HG21 THR A 89 0.744 4.767 -4.968 1.00 10.00 H new ATOM 0 HG22 THR A 89 0.052 3.233 -4.390 1.00 10.00 H new ATOM 0 HG23 THR A 89 1.817 3.460 -4.414 1.00 10.00 H new ATOM 1419 N GLU A 90 -1.220 0.815 -6.428 1.00 10.00 N ATOM 1420 CA GLU A 90 -2.381 0.084 -5.904 1.00 10.00 C ATOM 1421 C GLU A 90 -2.036 -1.388 -5.625 1.00 10.00 C ATOM 1422 O GLU A 90 -2.574 -1.976 -4.693 1.00 10.00 O ATOM 1423 CB GLU A 90 -3.555 0.168 -6.891 1.00 10.00 C ATOM 1424 CG GLU A 90 -4.131 1.578 -7.099 1.00 10.00 C ATOM 1425 CD GLU A 90 -5.155 1.971 -6.027 1.00 10.00 C ATOM 1426 OE1 GLU A 90 -4.856 1.771 -4.830 1.00 10.00 O ATOM 1427 OE2 GLU A 90 -6.237 2.457 -6.429 1.00 10.00 O ATOM 0 H GLU A 90 -1.371 1.242 -7.342 1.00 10.00 H new ATOM 0 HA GLU A 90 -2.670 0.550 -4.962 1.00 10.00 H new ATOM 0 HB2 GLU A 90 -3.227 -0.220 -7.855 1.00 10.00 H new ATOM 0 HB3 GLU A 90 -4.353 -0.486 -6.539 1.00 10.00 H new ATOM 0 HG2 GLU A 90 -3.316 2.301 -7.097 1.00 10.00 H new ATOM 0 HG3 GLU A 90 -4.602 1.631 -8.080 1.00 10.00 H new ATOM 1434 N ARG A 91 -1.097 -1.974 -6.389 1.00 10.00 N ATOM 1435 CA ARG A 91 -0.555 -3.318 -6.157 1.00 10.00 C ATOM 1436 C ARG A 91 0.438 -3.395 -4.984 1.00 10.00 C ATOM 1437 O ARG A 91 0.657 -4.487 -4.461 1.00 10.00 O ATOM 1438 CB ARG A 91 0.063 -3.845 -7.469 1.00 10.00 C ATOM 1439 CG ARG A 91 0.070 -5.384 -7.588 1.00 10.00 C ATOM 1440 CD ARG A 91 1.492 -5.952 -7.617 1.00 10.00 C ATOM 1441 NE ARG A 91 2.212 -5.611 -6.388 1.00 10.00 N ATOM 1442 CZ ARG A 91 3.471 -5.244 -6.217 1.00 10.00 C ATOM 1443 NH1 ARG A 91 4.388 -5.281 -7.158 1.00 10.00 N ATOM 1444 NH2 ARG A 91 3.822 -4.819 -5.028 1.00 10.00 N ATOM 0 H ARG A 91 -0.687 -1.514 -7.202 1.00 10.00 H new ATOM 0 HA ARG A 91 -1.383 -3.960 -5.856 1.00 10.00 H new ATOM 0 HB2 ARG A 91 -0.489 -3.429 -8.311 1.00 10.00 H new ATOM 0 HB3 ARG A 91 1.087 -3.480 -7.548 1.00 10.00 H new ATOM 0 HG2 ARG A 91 -0.475 -5.815 -6.748 1.00 10.00 H new ATOM 0 HG3 ARG A 91 -0.457 -5.680 -8.495 1.00 10.00 H new ATOM 0 HD2 ARG A 91 1.454 -7.035 -7.733 1.00 10.00 H new ATOM 0 HD3 ARG A 91 2.029 -5.558 -8.480 1.00 10.00 H new ATOM 0 HE ARG A 91 1.658 -5.665 -5.533 1.00 10.00 H new ATOM 0 HH11 ARG A 91 4.146 -5.609 -8.093 1.00 10.00 H new ATOM 0 HH12 ARG A 91 5.341 -4.982 -6.953 1.00 10.00 H new ATOM 0 HH21 ARG A 91 3.134 -4.781 -4.276 1.00 10.00 H new ATOM 0 HH22 ARG A 91 4.784 -4.527 -4.854 1.00 10.00 H new ATOM 1458 N GLU A 92 1.038 -2.288 -4.531 1.00 10.00 N ATOM 1459 CA GLU A 92 1.655 -2.214 -3.200 1.00 10.00 C ATOM 1460 C GLU A 92 0.549 -2.341 -2.154 1.00 10.00 C ATOM 1461 O GLU A 92 0.531 -3.298 -1.384 1.00 10.00 O ATOM 1462 CB GLU A 92 2.408 -0.893 -2.935 1.00 10.00 C ATOM 1463 CG GLU A 92 3.463 -0.409 -3.937 1.00 10.00 C ATOM 1464 CD GLU A 92 3.759 1.087 -3.709 1.00 10.00 C ATOM 1465 OE1 GLU A 92 3.654 1.535 -2.538 1.00 10.00 O ATOM 1466 OE2 GLU A 92 4.033 1.783 -4.717 1.00 10.00 O ATOM 0 H GLU A 92 1.110 -1.425 -5.070 1.00 10.00 H new ATOM 0 HA GLU A 92 2.387 -3.020 -3.145 1.00 10.00 H new ATOM 0 HB2 GLU A 92 1.661 -0.105 -2.842 1.00 10.00 H new ATOM 0 HB3 GLU A 92 2.897 -0.985 -1.965 1.00 10.00 H new ATOM 0 HG2 GLU A 92 4.378 -0.991 -3.824 1.00 10.00 H new ATOM 0 HG3 GLU A 92 3.109 -0.567 -4.956 1.00 10.00 H new ATOM 1473 N ASP A 93 -0.371 -1.369 -2.153 1.00 10.00 N ATOM 1474 CA ASP A 93 -1.426 -1.176 -1.166 1.00 10.00 C ATOM 1475 C ASP A 93 -2.271 -2.438 -1.007 1.00 10.00 C ATOM 1476 O ASP A 93 -2.447 -2.926 0.098 1.00 10.00 O ATOM 1477 CB ASP A 93 -2.241 0.070 -1.561 1.00 10.00 C ATOM 1478 CG ASP A 93 -1.413 1.346 -1.362 1.00 10.00 C ATOM 1479 OD1 ASP A 93 -0.407 1.537 -2.074 1.00 10.00 O ATOM 1480 OD2 ASP A 93 -1.649 2.072 -0.375 1.00 10.00 O ATOM 0 H ASP A 93 -0.396 -0.659 -2.885 1.00 10.00 H new ATOM 0 HA ASP A 93 -0.999 -0.998 -0.179 1.00 10.00 H new ATOM 0 HB2 ASP A 93 -2.552 -0.008 -2.603 1.00 10.00 H new ATOM 0 HB3 ASP A 93 -3.149 0.122 -0.960 1.00 10.00 H new ATOM 1485 N LEU A 94 -2.724 -3.038 -2.103 1.00 10.00 N ATOM 1486 CA LEU A 94 -3.525 -4.257 -2.093 1.00 10.00 C ATOM 1487 C LEU A 94 -2.821 -5.468 -1.450 1.00 10.00 C ATOM 1488 O LEU A 94 -3.421 -6.173 -0.637 1.00 10.00 O ATOM 1489 CB LEU A 94 -3.882 -4.524 -3.559 1.00 10.00 C ATOM 1490 CG LEU A 94 -4.783 -5.737 -3.772 1.00 10.00 C ATOM 1491 CD1 LEU A 94 -6.205 -5.403 -3.326 1.00 10.00 C ATOM 1492 CD2 LEU A 94 -4.733 -6.105 -5.255 1.00 10.00 C ATOM 0 H LEU A 94 -2.541 -2.683 -3.042 1.00 10.00 H new ATOM 0 HA LEU A 94 -4.407 -4.115 -1.469 1.00 10.00 H new ATOM 0 HB2 LEU A 94 -4.376 -3.642 -3.967 1.00 10.00 H new ATOM 0 HB3 LEU A 94 -2.962 -4.665 -4.126 1.00 10.00 H new ATOM 0 HG LEU A 94 -4.444 -6.587 -3.180 1.00 10.00 H new ATOM 0 HD11 LEU A 94 -6.847 -6.270 -3.479 1.00 10.00 H new ATOM 0 HD12 LEU A 94 -6.202 -5.136 -2.269 1.00 10.00 H new ATOM 0 HD13 LEU A 94 -6.582 -4.564 -3.911 1.00 10.00 H new ATOM 0 HD21 LEU A 94 -5.369 -6.971 -5.437 1.00 10.00 H new ATOM 0 HD22 LEU A 94 -5.087 -5.263 -5.851 1.00 10.00 H new ATOM 0 HD23 LEU A 94 -3.707 -6.343 -5.536 1.00 10.00 H new ATOM 1504 N ILE A 95 -1.565 -5.734 -1.825 1.00 10.00 N ATOM 1505 CA ILE A 95 -0.768 -6.819 -1.236 1.00 10.00 C ATOM 1506 C ILE A 95 -0.491 -6.525 0.247 1.00 10.00 C ATOM 1507 O ILE A 95 -0.663 -7.405 1.097 1.00 10.00 O ATOM 1508 CB ILE A 95 0.520 -7.037 -2.064 1.00 10.00 C ATOM 1509 CG1 ILE A 95 0.224 -7.513 -3.509 1.00 10.00 C ATOM 1510 CG2 ILE A 95 1.486 -8.014 -1.375 1.00 10.00 C ATOM 1511 CD1 ILE A 95 -0.418 -8.901 -3.646 1.00 10.00 C ATOM 0 H ILE A 95 -1.072 -5.205 -2.544 1.00 10.00 H new ATOM 0 HA ILE A 95 -1.326 -7.755 -1.270 1.00 10.00 H new ATOM 0 HB ILE A 95 1.001 -6.061 -2.126 1.00 10.00 H new ATOM 0 HG12 ILE A 95 -0.433 -6.783 -3.983 1.00 10.00 H new ATOM 0 HG13 ILE A 95 1.159 -7.511 -4.069 1.00 10.00 H new ATOM 0 HG21 ILE A 95 2.377 -8.139 -1.990 1.00 10.00 H new ATOM 0 HG22 ILE A 95 1.770 -7.618 -0.400 1.00 10.00 H new ATOM 0 HG23 ILE A 95 0.996 -8.979 -1.246 1.00 10.00 H new ATOM 0 HD11 ILE A 95 -0.578 -9.125 -4.701 1.00 10.00 H new ATOM 0 HD12 ILE A 95 0.242 -9.652 -3.211 1.00 10.00 H new ATOM 0 HD13 ILE A 95 -1.375 -8.913 -3.124 1.00 10.00 H new ATOM 1523 N ALA A 96 -0.124 -5.275 0.557 1.00 10.00 N ATOM 1524 CA ALA A 96 0.143 -4.810 1.917 1.00 10.00 C ATOM 1525 C ALA A 96 -1.112 -4.882 2.795 1.00 10.00 C ATOM 1526 O ALA A 96 -1.019 -5.248 3.964 1.00 10.00 O ATOM 1527 CB ALA A 96 0.709 -3.383 1.856 1.00 10.00 C ATOM 0 H ALA A 96 -0.003 -4.547 -0.147 1.00 10.00 H new ATOM 0 HA ALA A 96 0.880 -5.467 2.380 1.00 10.00 H new ATOM 0 HB1 ALA A 96 0.911 -3.028 2.867 1.00 10.00 H new ATOM 0 HB2 ALA A 96 1.634 -3.383 1.280 1.00 10.00 H new ATOM 0 HB3 ALA A 96 -0.016 -2.724 1.378 1.00 10.00 H new ATOM 1533 N TYR A 97 -2.289 -4.622 2.224 1.00 10.00 N ATOM 1534 CA TYR A 97 -3.580 -4.933 2.813 1.00 10.00 C ATOM 1535 C TYR A 97 -3.692 -6.422 3.127 1.00 10.00 C ATOM 1536 O TYR A 97 -3.735 -6.767 4.303 1.00 10.00 O ATOM 1537 CB TYR A 97 -4.685 -4.384 1.902 1.00 10.00 C ATOM 1538 CG TYR A 97 -6.022 -5.087 1.917 1.00 10.00 C ATOM 1539 CD1 TYR A 97 -6.820 -5.105 3.067 1.00 10.00 C ATOM 1540 CD2 TYR A 97 -6.479 -5.721 0.758 1.00 10.00 C ATOM 1541 CE1 TYR A 97 -8.068 -5.753 3.075 1.00 10.00 C ATOM 1542 CE2 TYR A 97 -7.699 -6.409 0.771 1.00 10.00 C ATOM 1543 CZ TYR A 97 -8.523 -6.393 1.911 1.00 10.00 C ATOM 1544 OH TYR A 97 -9.760 -6.950 1.866 1.00 10.00 O ATOM 0 H TYR A 97 -2.366 -4.175 1.310 1.00 10.00 H new ATOM 0 HA TYR A 97 -3.695 -4.441 3.779 1.00 10.00 H new ATOM 0 HB2 TYR A 97 -4.852 -3.340 2.169 1.00 10.00 H new ATOM 0 HB3 TYR A 97 -4.312 -4.395 0.878 1.00 10.00 H new ATOM 0 HD1 TYR A 97 -6.471 -4.613 3.963 1.00 10.00 H new ATOM 0 HD2 TYR A 97 -5.891 -5.680 -0.147 1.00 10.00 H new ATOM 0 HE1 TYR A 97 -8.672 -5.758 3.970 1.00 10.00 H new ATOM 0 HE2 TYR A 97 -8.011 -6.958 -0.105 1.00 10.00 H new ATOM 0 HH TYR A 97 -10.088 -6.945 0.942 1.00 10.00 H new ATOM 1554 N LEU A 98 -3.713 -7.313 2.129 1.00 10.00 N ATOM 1555 CA LEU A 98 -4.049 -8.722 2.373 1.00 10.00 C ATOM 1556 C LEU A 98 -3.071 -9.459 3.298 1.00 10.00 C ATOM 1557 O LEU A 98 -3.515 -10.323 4.054 1.00 10.00 O ATOM 1558 CB LEU A 98 -4.223 -9.471 1.048 1.00 10.00 C ATOM 1559 CG LEU A 98 -5.475 -9.033 0.284 1.00 10.00 C ATOM 1560 CD1 LEU A 98 -5.405 -9.467 -1.176 1.00 10.00 C ATOM 1561 CD2 LEU A 98 -6.757 -9.586 0.918 1.00 10.00 C ATOM 0 H LEU A 98 -3.504 -7.088 1.156 1.00 10.00 H new ATOM 0 HA LEU A 98 -4.996 -8.709 2.912 1.00 10.00 H new ATOM 0 HB2 LEU A 98 -3.345 -9.306 0.424 1.00 10.00 H new ATOM 0 HB3 LEU A 98 -4.278 -10.542 1.245 1.00 10.00 H new ATOM 0 HG LEU A 98 -5.507 -7.945 0.337 1.00 10.00 H new ATOM 0 HD11 LEU A 98 -6.307 -9.143 -1.695 1.00 10.00 H new ATOM 0 HD12 LEU A 98 -4.532 -9.016 -1.648 1.00 10.00 H new ATOM 0 HD13 LEU A 98 -5.326 -10.553 -1.229 1.00 10.00 H new ATOM 0 HD21 LEU A 98 -7.621 -9.251 0.344 1.00 10.00 H new ATOM 0 HD22 LEU A 98 -6.722 -10.675 0.918 1.00 10.00 H new ATOM 0 HD23 LEU A 98 -6.841 -9.226 1.943 1.00 10.00 H new ATOM 1573 N LYS A 99 -1.781 -9.087 3.329 1.00 10.00 N ATOM 1574 CA LYS A 99 -0.831 -9.644 4.309 1.00 10.00 C ATOM 1575 C LYS A 99 -1.312 -9.398 5.738 1.00 10.00 C ATOM 1576 O LYS A 99 -1.289 -10.309 6.567 1.00 10.00 O ATOM 1577 CB LYS A 99 0.590 -9.105 4.039 1.00 10.00 C ATOM 1578 CG LYS A 99 1.820 -9.706 4.779 1.00 10.00 C ATOM 1579 CD LYS A 99 1.739 -10.219 6.231 1.00 10.00 C ATOM 1580 CE LYS A 99 1.286 -11.681 6.178 1.00 10.00 C ATOM 1581 NZ LYS A 99 0.555 -12.162 7.368 1.00 10.00 N ATOM 0 H LYS A 99 -1.372 -8.406 2.690 1.00 10.00 H new ATOM 0 HA LYS A 99 -0.784 -10.727 4.192 1.00 10.00 H new ATOM 0 HB2 LYS A 99 0.776 -9.210 2.970 1.00 10.00 H new ATOM 0 HB3 LYS A 99 0.575 -8.037 4.256 1.00 10.00 H new ATOM 0 HG2 LYS A 99 2.173 -10.540 4.172 1.00 10.00 H new ATOM 0 HG3 LYS A 99 2.600 -8.944 4.759 1.00 10.00 H new ATOM 0 HD2 LYS A 99 2.709 -10.136 6.722 1.00 10.00 H new ATOM 0 HD3 LYS A 99 1.036 -9.621 6.810 1.00 10.00 H new ATOM 0 HE2 LYS A 99 0.650 -11.815 5.303 1.00 10.00 H new ATOM 0 HE3 LYS A 99 2.164 -12.311 6.033 1.00 10.00 H new ATOM 0 HZ1 LYS A 99 0.352 -13.177 7.264 1.00 10.00 H new ATOM 0 HZ2 LYS A 99 1.136 -12.010 8.217 1.00 10.00 H new ATOM 0 HZ3 LYS A 99 -0.339 -11.638 7.462 1.00 10.00 H new ATOM 1595 N LYS A 100 -1.732 -8.170 6.032 1.00 10.00 N ATOM 1596 CA LYS A 100 -2.065 -7.728 7.386 1.00 10.00 C ATOM 1597 C LYS A 100 -3.553 -7.944 7.704 1.00 10.00 C ATOM 1598 O LYS A 100 -3.842 -8.475 8.770 1.00 10.00 O ATOM 1599 CB LYS A 100 -1.523 -6.299 7.623 1.00 10.00 C ATOM 1600 CG LYS A 100 0.030 -6.246 7.688 1.00 10.00 C ATOM 1601 CD LYS A 100 0.725 -5.985 6.335 1.00 10.00 C ATOM 1602 CE LYS A 100 2.194 -6.443 6.267 1.00 10.00 C ATOM 1603 NZ LYS A 100 2.803 -6.234 4.920 1.00 10.00 N ATOM 0 H LYS A 100 -1.853 -7.443 5.327 1.00 10.00 H new ATOM 0 HA LYS A 100 -1.558 -8.353 8.121 1.00 10.00 H new ATOM 0 HB2 LYS A 100 -1.871 -5.646 6.823 1.00 10.00 H new ATOM 0 HB3 LYS A 100 -1.934 -5.909 8.554 1.00 10.00 H new ATOM 0 HG2 LYS A 100 0.324 -5.464 8.388 1.00 10.00 H new ATOM 0 HG3 LYS A 100 0.395 -7.190 8.092 1.00 10.00 H new ATOM 0 HD2 LYS A 100 0.164 -6.492 5.550 1.00 10.00 H new ATOM 0 HD3 LYS A 100 0.681 -4.917 6.119 1.00 10.00 H new ATOM 0 HE2 LYS A 100 2.775 -5.898 7.012 1.00 10.00 H new ATOM 0 HE3 LYS A 100 2.253 -7.500 6.527 1.00 10.00 H new ATOM 0 HZ1 LYS A 100 3.703 -6.751 4.862 1.00 10.00 H new ATOM 0 HZ2 LYS A 100 2.154 -6.585 4.187 1.00 10.00 H new ATOM 0 HZ3 LYS A 100 2.976 -5.219 4.771 1.00 10.00 H new ATOM 1617 N ALA A 101 -4.475 -7.728 6.756 1.00 10.00 N ATOM 1618 CA ALA A 101 -5.918 -7.986 6.883 1.00 10.00 C ATOM 1619 C ALA A 101 -6.294 -9.449 7.183 1.00 10.00 C ATOM 1620 O ALA A 101 -7.422 -9.735 7.572 1.00 10.00 O ATOM 1621 CB ALA A 101 -6.605 -7.537 5.590 1.00 10.00 C ATOM 0 H ALA A 101 -4.226 -7.353 5.841 1.00 10.00 H new ATOM 0 HA ALA A 101 -6.257 -7.419 7.750 1.00 10.00 H new ATOM 0 HB1 ALA A 101 -7.677 -7.720 5.665 1.00 10.00 H new ATOM 0 HB2 ALA A 101 -6.429 -6.473 5.435 1.00 10.00 H new ATOM 0 HB3 ALA A 101 -6.199 -8.098 4.748 1.00 10.00 H new ATOM 1627 N THR A 102 -5.346 -10.380 7.032 1.00 10.00 N ATOM 1628 CA THR A 102 -5.457 -11.767 7.503 1.00 10.00 C ATOM 1629 C THR A 102 -5.398 -11.898 9.044 1.00 10.00 C ATOM 1630 O THR A 102 -5.557 -12.996 9.569 1.00 10.00 O ATOM 1631 CB THR A 102 -4.395 -12.611 6.773 1.00 10.00 C ATOM 1632 OG1 THR A 102 -4.876 -13.898 6.496 1.00 10.00 O ATOM 1633 CG2 THR A 102 -3.068 -12.759 7.511 1.00 10.00 C ATOM 0 H THR A 102 -4.459 -10.187 6.568 1.00 10.00 H new ATOM 0 HA THR A 102 -6.447 -12.151 7.255 1.00 10.00 H new ATOM 0 HB THR A 102 -4.199 -12.049 5.860 1.00 10.00 H new ATOM 0 HG1 THR A 102 -4.463 -14.231 5.672 1.00 10.00 H new ATOM 0 HG21 THR A 102 -2.387 -13.369 6.917 1.00 10.00 H new ATOM 0 HG22 THR A 102 -2.628 -11.774 7.670 1.00 10.00 H new ATOM 0 HG23 THR A 102 -3.239 -13.239 8.474 1.00 10.00 H new ATOM 1641 N ASN A 103 -5.208 -10.785 9.774 1.00 10.00 N ATOM 1642 CA ASN A 103 -5.096 -10.702 11.236 1.00 10.00 C ATOM 1643 C ASN A 103 -5.581 -9.338 11.772 1.00 10.00 C ATOM 1644 O ASN A 103 -6.410 -9.314 12.679 1.00 10.00 O ATOM 1645 CB ASN A 103 -3.622 -10.873 11.659 1.00 10.00 C ATOM 1646 CG ASN A 103 -3.081 -12.282 11.503 1.00 10.00 C ATOM 1647 OD1 ASN A 103 -3.433 -13.203 12.221 1.00 10.00 O ATOM 1648 ND2 ASN A 103 -2.161 -12.482 10.582 1.00 10.00 N ATOM 0 H ASN A 103 -5.124 -9.869 9.332 1.00 10.00 H new ATOM 0 HA ASN A 103 -5.720 -11.494 11.650 1.00 10.00 H new ATOM 0 HB2 ASN A 103 -3.007 -10.194 11.069 1.00 10.00 H new ATOM 0 HB3 ASN A 103 -3.519 -10.571 12.701 1.00 10.00 H new ATOM 0 HD21 ASN A 103 -1.744 -13.406 10.470 1.00 10.00 H new ATOM 0 HD22 ASN A 103 -1.866 -11.713 9.981 1.00 10.00 H new ATOM 1655 N GLU A 104 -5.036 -8.233 11.247 1.00 10.00 N ATOM 1656 CA GLU A 104 -5.322 -6.842 11.634 1.00 10.00 C ATOM 1657 C GLU A 104 -6.668 -6.328 11.097 1.00 10.00 C ATOM 1658 O GLU A 104 -7.420 -5.751 11.912 1.00 10.00 O ATOM 1659 CB GLU A 104 -4.181 -5.904 11.183 1.00 10.00 C ATOM 1660 CG GLU A 104 -2.738 -6.425 11.339 1.00 10.00 C ATOM 1661 CD GLU A 104 -2.404 -7.031 12.710 1.00 10.00 C ATOM 1662 OE1 GLU A 104 -2.525 -6.301 13.718 1.00 10.00 O ATOM 1663 OE2 GLU A 104 -1.961 -8.205 12.717 1.00 10.00 O ATOM 1664 OXT GLU A 104 -6.899 -6.467 9.873 1.00 10.00 O ATOM 0 H GLU A 104 -4.345 -8.287 10.499 1.00 10.00 H new ATOM 0 HA GLU A 104 -5.391 -6.838 12.722 1.00 10.00 H new ATOM 0 HB2 GLU A 104 -4.340 -5.659 10.133 1.00 10.00 H new ATOM 0 HB3 GLU A 104 -4.267 -4.973 11.744 1.00 10.00 H new ATOM 0 HG2 GLU A 104 -2.557 -7.179 10.573 1.00 10.00 H new ATOM 0 HG3 GLU A 104 -2.049 -5.602 11.146 1.00 10.00 H new TER 1671 GLU A 104 HETATM 1672 FE HEC A 105 -9.004 -12.995 -8.065 1.00 10.00 FE HETATM 1673 CHA HEC A 105 -8.174 -16.271 -7.491 1.00 10.00 C HETATM 1674 CHB HEC A 105 -7.019 -12.047 -5.496 1.00 10.00 C HETATM 1675 CHC HEC A 105 -9.666 -9.786 -8.796 1.00 10.00 C HETATM 1676 CHD HEC A 105 -11.459 -14.011 -10.187 1.00 10.00 C HETATM 1677 NA HEC A 105 -7.826 -13.959 -6.778 1.00 10.00 N HETATM 1678 C1A HEC A 105 -7.551 -15.311 -6.716 1.00 10.00 C HETATM 1679 C2A HEC A 105 -6.621 -15.603 -5.640 1.00 10.00 C HETATM 1680 C3A HEC A 105 -6.383 -14.430 -5.010 1.00 10.00 C HETATM 1681 C4A HEC A 105 -7.083 -13.401 -5.763 1.00 10.00 C HETATM 1682 CMA HEC A 105 -5.575 -14.256 -3.746 1.00 10.00 C HETATM 1683 CAA HEC A 105 -6.150 -16.972 -5.196 1.00 10.00 C HETATM 1684 CBA HEC A 105 -7.263 -17.751 -4.478 1.00 10.00 C HETATM 1685 CGA HEC A 105 -6.806 -18.710 -3.389 1.00 10.00 C HETATM 1686 O1A HEC A 105 -6.098 -19.686 -3.713 1.00 10.00 O HETATM 1687 O2A HEC A 105 -7.294 -18.556 -2.255 1.00 10.00 O HETATM 1688 NB HEC A 105 -8.547 -11.283 -7.244 1.00 10.00 N HETATM 1689 C1B HEC A 105 -7.718 -11.067 -6.175 1.00 10.00 C HETATM 1690 C2B HEC A 105 -7.666 -9.659 -5.837 1.00 10.00 C HETATM 1691 C3B HEC A 105 -8.424 -9.000 -6.762 1.00 10.00 C HETATM 1692 C4B HEC A 105 -8.900 -10.026 -7.674 1.00 10.00 C HETATM 1693 CMB HEC A 105 -6.900 -9.118 -4.653 1.00 10.00 C HETATM 1694 CAB HEC A 105 -8.723 -7.510 -6.895 1.00 10.00 C HETATM 1695 CBB HEC A 105 -7.604 -6.781 -7.642 1.00 10.00 C HETATM 1696 NC HEC A 105 -10.337 -12.099 -9.170 1.00 10.00 N HETATM 1697 C1C HEC A 105 -10.406 -10.752 -9.441 1.00 10.00 C HETATM 1698 C2C HEC A 105 -11.510 -10.444 -10.324 1.00 10.00 C HETATM 1699 C3C HEC A 105 -12.180 -11.612 -10.501 1.00 10.00 C HETATM 1700 C4C HEC A 105 -11.337 -12.655 -9.930 1.00 10.00 C HETATM 1701 CMC HEC A 105 -11.890 -9.044 -10.761 1.00 10.00 C HETATM 1702 CAC HEC A 105 -13.549 -11.820 -11.118 1.00 10.00 C HETATM 1703 CBC HEC A 105 -13.557 -11.644 -12.642 1.00 10.00 C HETATM 1704 ND HEC A 105 -9.677 -14.775 -8.704 1.00 10.00 N HETATM 1705 C1D HEC A 105 -10.648 -15.000 -9.657 1.00 10.00 C HETATM 1706 C2D HEC A 105 -10.708 -16.413 -10.018 1.00 10.00 C HETATM 1707 C3D HEC A 105 -9.897 -17.066 -9.149 1.00 10.00 C HETATM 1708 C4D HEC A 105 -9.188 -16.033 -8.402 1.00 10.00 C HETATM 1709 CMD HEC A 105 -11.560 -17.041 -11.105 1.00 10.00 C HETATM 1710 CAD HEC A 105 -9.752 -18.574 -8.995 1.00 10.00 C HETATM 1711 CBD HEC A 105 -8.333 -19.154 -9.167 1.00 10.00 C HETATM 1712 CGD HEC A 105 -8.177 -20.337 -10.126 1.00 10.00 C HETATM 1713 O1D HEC A 105 -9.175 -21.010 -10.462 1.00 10.00 O HETATM 1714 O2D HEC A 105 -7.002 -20.549 -10.496 1.00 10.00 O HETATM 0 HMD3 HEC A 105 -12.613 -16.851 -10.897 1.00 10.00 H new HETATM 0 HMD2 HEC A 105 -11.297 -16.607 -12.070 1.00 10.00 H new HETATM 0 HMD1 HEC A 105 -11.383 -18.116 -11.130 1.00 10.00 H new HETATM 0 HMC3 HEC A 105 -12.136 -8.444 -9.885 1.00 10.00 H new HETATM 0 HMC2 HEC A 105 -11.053 -8.588 -11.290 1.00 10.00 H new HETATM 0 HMC1 HEC A 105 -12.755 -9.092 -11.423 1.00 10.00 H new HETATM 0 HMB3 HEC A 105 -7.288 -9.560 -3.736 1.00 10.00 H new HETATM 0 HMB2 HEC A 105 -5.844 -9.368 -4.758 1.00 10.00 H new HETATM 0 HMB1 HEC A 105 -7.014 -8.035 -4.610 1.00 10.00 H new HETATM 0 HMA3 HEC A 105 -6.031 -14.832 -2.941 1.00 10.00 H new HETATM 0 HMA2 HEC A 105 -4.557 -14.609 -3.913 1.00 10.00 H new HETATM 0 HMA1 HEC A 105 -5.553 -13.202 -3.470 1.00 10.00 H new HETATM 0 HBD2 HEC A 105 -7.679 -18.352 -9.509 1.00 10.00 H new HETATM 0 HBD1 HEC A 105 -7.972 -19.463 -8.186 1.00 10.00 H new HETATM 0 HBC3 HEC A 105 -13.233 -10.634 -12.893 1.00 10.00 H new HETATM 0 HBC2 HEC A 105 -12.878 -12.367 -13.095 1.00 10.00 H new HETATM 0 HBC1 HEC A 105 -14.566 -11.806 -13.022 1.00 10.00 H new HETATM 0 HBB3 HEC A 105 -6.667 -6.898 -7.098 1.00 10.00 H new HETATM 0 HBB2 HEC A 105 -7.499 -7.203 -8.641 1.00 10.00 H new HETATM 0 HBB1 HEC A 105 -7.848 -5.722 -7.719 1.00 10.00 H new HETATM 0 HBA2 HEC A 105 -7.955 -17.034 -4.037 1.00 10.00 H new HETATM 0 HBA1 HEC A 105 -7.822 -18.317 -5.223 1.00 10.00 H new HETATM 0 HAD2 HEC A 105 -10.116 -18.852 -8.006 1.00 10.00 H new HETATM 0 HAD1 HEC A 105 -10.407 -19.055 -9.722 1.00 10.00 H new HETATM 0 HAA2 HEC A 105 -5.810 -17.539 -6.063 1.00 10.00 H new HETATM 0 HAA1 HEC A 105 -5.294 -16.864 -4.530 1.00 10.00 H new HETATM 0 HHD HEC A 105 -12.257 -14.324 -10.860 1.00 10.00 H new HETATM 0 HHC HEC A 105 -9.687 -8.772 -9.196 1.00 10.00 H new HETATM 0 HHB HEC A 105 -6.365 -11.726 -4.685 1.00 10.00 H new HETATM 0 HHA HEC A 105 -7.839 -17.302 -7.375 1.00 10.00 H new HETATM 0 H2D HEC A 105 -6.992 -21.276 -11.153 1.00 10.00 H new