USER MOD reduce.3.24.130724 H: found=0, std=0, add=1187, rem=0, adj=47 USER MOD reduce.3.24.130724 removed 1192 hydrogens (9 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 117 LYS NZ :NH3+ -132:sc= -0.0461 (180deg=-0.406) USER MOD Set 1.2: A 120 GLN : amide:sc= -0.56 K(o=-0.61,f=-3!) USER MOD Set 2.1: A 74 ASN : amide:sc= 0.44 K(o=1.2,f=-5.8!) USER MOD Set 2.2: A 76 LYS NZ :NH3+ 157:sc= 0.743 (180deg=0) USER MOD Set 3.1: A 63 THR OG1 : rot 180:sc= 0.00894 USER MOD Set 3.2: A 70 TYR OH : rot -115:sc= 0.566 USER MOD Set 4.1: A 35 THR OG1 : rot -61:sc= 1.11 USER MOD Set 4.2: A 38 GLN : amide:sc= 1.43 K(o=2.5,f=-2.7!) USER MOD Single : A 1 MET CE :methyl 159:sc= -0.158 (180deg=-0.726) USER MOD Single : A 1 MET N :NH3+ -171:sc=-0.00267 (180deg=-0.1) USER MOD Single : A 2 GLN : amide:sc= -0.171 X(o=-0.17,f=-0.39) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 GLN : amide:sc= 0.845 K(o=0.84,f=0) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ -168:sc= -0.0248 (180deg=-0.2) USER MOD Single : A 12 SER OG : rot 82:sc= 0.00418 USER MOD Single : A 13 LYS NZ :NH3+ -168:sc= -0.0454 (180deg=-0.263) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 173:sc= 2.16 (180deg=2.08) USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 40 ASN : amide:sc= -0.135 K(o=-0.14,f=-3.2!) USER MOD Single : A 44 SER OG : rot -58:sc= -3.14! USER MOD Single : A 49 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 55 GLN : amide:sc= 0.1 X(o=0.1,f=-0.11) USER MOD Single : A 56 ASN : amide:sc= -0.324 X(o=-0.32,f=-0.23) USER MOD Single : A 58 SER OG : rot 88:sc= 1.19 USER MOD Single : A 62 HIS : no HE2:sc= 0.998 K(o=1,f=-3!) USER MOD Single : A 69 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 71 GLN :FLIP amide:sc= -1.92 F(o=-3.8!,f=-1.9) USER MOD Single : A 73 THR OG1 : rot -59:sc= 2.16 USER MOD Single : A 79 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0094) USER MOD Single : A 80 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.000227) USER MOD Single : A 82 SER OG : rot 67:sc= -0.774 USER MOD Single : A 83 MET CE :methyl 168:sc= -2.69! (180deg=-4.05!) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ -172:sc= 0.957 (180deg=0.563) USER MOD Single : A 90 ASN :FLIP amide:sc= -0.169 F(o=-2.5!,f=-0.17) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ -168:sc= 1.24 (180deg=1.05) USER MOD Single : A 95 TYR OH : rot -111:sc= 0.888 USER MOD Single : A 96 LYS NZ :NH3+ 154:sc= -0.115 (180deg=-0.571) USER MOD Single : A 97 MET CE :methyl -133:sc= -0.733 (180deg=-3.54!) USER MOD Single : A 98 THR OG1 : rot -7:sc= 0.663 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 104 LYS NZ :NH3+ -147:sc= 1.3 (180deg=1.06) USER MOD Single : A 106 THR OG1 : rot -36:sc= 1.09 USER MOD Single : A 114 GLN :FLIP amide:sc= -0.0202 F(o=-0.61,f=-0.02) USER MOD Single : A 115 LYS NZ :NH3+ -113:sc= 1.22 (180deg=0.325) USER MOD Single : A 119 LYS NZ :NH3+ -148:sc= 1.16 (180deg=0.441) USER MOD Single : A 122 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 THR OG1 : rot 150:sc= 0 USER MOD Single : A 129 TYR OH : rot 180:sc= -0.285 USER MOD Single : A 130 ASN : amide:sc= -1.51 K(o=-1.5,f=-9.9!) USER MOD Single : A 132 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.172) USER MOD Single : A 133 THR OG1 : rot 180:sc= 0 USER MOD Single : A 138 LYS NZ :NH3+ -154:sc= 1.17 (180deg=-0.385) USER MOD Single : A 140 LYS NZ :NH3+ -126:sc= 1.03 (180deg=-0.119) USER MOD Single : A 145 THR OG1 : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ 173:sc=-0.00721 (180deg=-0.103) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -4.654 -0.685 -10.739 1.00 0.00 N ATOM 2 CA MET A 1 -5.020 -0.159 -9.405 1.00 0.00 C ATOM 3 C MET A 1 -4.176 1.064 -9.072 1.00 0.00 C ATOM 4 O MET A 1 -3.003 1.135 -9.439 1.00 0.00 O ATOM 5 CB MET A 1 -4.810 -1.226 -8.325 1.00 0.00 C ATOM 6 CG MET A 1 -5.641 -2.484 -8.518 1.00 0.00 C ATOM 7 SD MET A 1 -5.383 -3.694 -7.206 1.00 0.00 S ATOM 8 CE MET A 1 -5.985 -2.787 -5.782 1.00 0.00 C ATOM 0 H1 MET A 1 -5.334 -1.420 -11.021 1.00 0.00 H new ATOM 0 H2 MET A 1 -4.672 0.088 -11.434 1.00 0.00 H new ATOM 0 H3 MET A 1 -3.698 -1.094 -10.701 1.00 0.00 H new ATOM 0 HA MET A 1 -6.073 0.120 -9.430 1.00 0.00 H new ATOM 0 HB2 MET A 1 -3.756 -1.501 -8.303 1.00 0.00 H new ATOM 0 HB3 MET A 1 -5.047 -0.794 -7.353 1.00 0.00 H new ATOM 0 HG2 MET A 1 -6.697 -2.215 -8.557 1.00 0.00 H new ATOM 0 HG3 MET A 1 -5.392 -2.936 -9.478 1.00 0.00 H new ATOM 0 HE1 MET A 1 -6.243 -3.487 -4.987 1.00 0.00 H new ATOM 0 HE2 MET A 1 -5.210 -2.107 -5.429 1.00 0.00 H new ATOM 0 HE3 MET A 1 -6.869 -2.215 -6.062 1.00 0.00 H new ATOM 17 N GLN A 2 -4.766 2.025 -8.375 1.00 0.00 N ATOM 18 CA GLN A 2 -4.037 3.219 -7.967 1.00 0.00 C ATOM 19 C GLN A 2 -3.696 3.165 -6.489 1.00 0.00 C ATOM 20 O GLN A 2 -4.143 2.272 -5.766 1.00 0.00 O ATOM 21 CB GLN A 2 -4.835 4.488 -8.256 1.00 0.00 C ATOM 22 CG GLN A 2 -4.961 4.816 -9.735 1.00 0.00 C ATOM 23 CD GLN A 2 -3.618 5.110 -10.375 1.00 0.00 C ATOM 24 OE1 GLN A 2 -2.944 4.212 -10.885 1.00 0.00 O ATOM 25 NE2 GLN A 2 -3.216 6.371 -10.346 1.00 0.00 N ATOM 0 H GLN A 2 -5.742 2.002 -8.081 1.00 0.00 H new ATOM 0 HA GLN A 2 -3.116 3.246 -8.549 1.00 0.00 H new ATOM 0 HB2 GLN A 2 -5.833 4.382 -7.832 1.00 0.00 H new ATOM 0 HB3 GLN A 2 -4.360 5.327 -7.747 1.00 0.00 H new ATOM 0 HG2 GLN A 2 -5.432 3.980 -10.252 1.00 0.00 H new ATOM 0 HG3 GLN A 2 -5.617 5.678 -9.859 1.00 0.00 H new ATOM 0 HE21 GLN A 2 -3.804 7.084 -9.914 1.00 0.00 H new ATOM 0 HE22 GLN A 2 -2.318 6.630 -10.756 1.00 0.00 H new ATOM 34 N ALA A 3 -2.904 4.127 -6.048 1.00 0.00 N ATOM 35 CA ALA A 3 -2.498 4.208 -4.660 1.00 0.00 C ATOM 36 C ALA A 3 -3.505 4.994 -3.839 1.00 0.00 C ATOM 37 O ALA A 3 -3.420 6.217 -3.727 1.00 0.00 O ATOM 38 CB ALA A 3 -1.127 4.835 -4.555 1.00 0.00 C ATOM 0 H ALA A 3 -2.528 4.868 -6.639 1.00 0.00 H new ATOM 0 HA ALA A 3 -2.456 3.196 -4.258 1.00 0.00 H new ATOM 0 HB1 ALA A 3 -0.832 4.891 -3.507 1.00 0.00 H new ATOM 0 HB2 ALA A 3 -0.406 4.228 -5.103 1.00 0.00 H new ATOM 0 HB3 ALA A 3 -1.153 5.839 -4.979 1.00 0.00 H new ATOM 44 N LYS A 4 -4.468 4.280 -3.289 1.00 0.00 N ATOM 45 CA LYS A 4 -5.452 4.874 -2.400 1.00 0.00 C ATOM 46 C LYS A 4 -5.154 4.479 -0.963 1.00 0.00 C ATOM 47 O LYS A 4 -5.422 3.349 -0.555 1.00 0.00 O ATOM 48 CB LYS A 4 -6.872 4.461 -2.787 1.00 0.00 C ATOM 49 CG LYS A 4 -7.363 5.114 -4.069 1.00 0.00 C ATOM 50 CD LYS A 4 -8.843 4.859 -4.300 1.00 0.00 C ATOM 51 CE LYS A 4 -9.118 3.419 -4.689 1.00 0.00 C ATOM 52 NZ LYS A 4 -10.571 3.178 -4.888 1.00 0.00 N ATOM 0 H LYS A 4 -4.592 3.279 -3.443 1.00 0.00 H new ATOM 0 HA LYS A 4 -5.388 5.958 -2.493 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -6.908 3.378 -2.903 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -7.551 4.718 -1.974 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -7.182 6.188 -4.023 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -6.792 4.731 -4.914 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -9.398 5.102 -3.394 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -9.207 5.522 -5.085 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -8.579 3.179 -5.606 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -8.740 2.753 -3.913 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -10.725 2.184 -5.153 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -11.081 3.384 -4.005 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -10.925 3.797 -5.645 1.00 0.00 H new ATOM 66 N PRO A 5 -4.552 5.399 -0.196 1.00 0.00 N ATOM 67 CA PRO A 5 -4.180 5.163 1.202 1.00 0.00 C ATOM 68 C PRO A 5 -5.374 4.768 2.060 1.00 0.00 C ATOM 69 O PRO A 5 -6.396 5.462 2.098 1.00 0.00 O ATOM 70 CB PRO A 5 -3.606 6.505 1.663 1.00 0.00 C ATOM 71 CG PRO A 5 -4.095 7.493 0.667 1.00 0.00 C ATOM 72 CD PRO A 5 -4.180 6.750 -0.632 1.00 0.00 C ATOM 0 HA PRO A 5 -3.476 4.336 1.297 1.00 0.00 H new ATOM 0 HB2 PRO A 5 -3.946 6.756 2.668 1.00 0.00 H new ATOM 0 HB3 PRO A 5 -2.517 6.480 1.692 1.00 0.00 H new ATOM 0 HG2 PRO A 5 -5.068 7.891 0.955 1.00 0.00 H new ATOM 0 HG3 PRO A 5 -3.414 8.341 0.590 1.00 0.00 H new ATOM 0 HD2 PRO A 5 -4.926 7.182 -1.299 1.00 0.00 H new ATOM 0 HD3 PRO A 5 -3.231 6.757 -1.168 1.00 0.00 H new ATOM 80 N GLN A 6 -5.227 3.653 2.747 1.00 0.00 N ATOM 81 CA GLN A 6 -6.296 3.084 3.540 1.00 0.00 C ATOM 82 C GLN A 6 -5.720 2.166 4.603 1.00 0.00 C ATOM 83 O GLN A 6 -4.565 1.746 4.517 1.00 0.00 O ATOM 84 CB GLN A 6 -7.261 2.317 2.634 1.00 0.00 C ATOM 85 CG GLN A 6 -6.580 1.244 1.798 1.00 0.00 C ATOM 86 CD GLN A 6 -7.483 0.681 0.718 1.00 0.00 C ATOM 87 OE1 GLN A 6 -8.191 -0.303 0.930 1.00 0.00 O ATOM 88 NE2 GLN A 6 -7.460 1.301 -0.451 1.00 0.00 N ATOM 0 H GLN A 6 -4.361 3.115 2.771 1.00 0.00 H new ATOM 0 HA GLN A 6 -6.844 3.886 4.035 1.00 0.00 H new ATOM 0 HB2 GLN A 6 -8.033 1.853 3.248 1.00 0.00 H new ATOM 0 HB3 GLN A 6 -7.762 3.021 1.970 1.00 0.00 H new ATOM 0 HG2 GLN A 6 -5.686 1.662 1.336 1.00 0.00 H new ATOM 0 HG3 GLN A 6 -6.253 0.434 2.450 1.00 0.00 H new ATOM 0 HE21 GLN A 6 -6.859 2.114 -0.585 1.00 0.00 H new ATOM 0 HE22 GLN A 6 -8.044 0.966 -1.217 1.00 0.00 H new ATOM 97 N ILE A 7 -6.525 1.873 5.601 1.00 0.00 N ATOM 98 CA ILE A 7 -6.112 1.035 6.708 1.00 0.00 C ATOM 99 C ILE A 7 -6.615 -0.395 6.523 1.00 0.00 C ATOM 100 O ILE A 7 -7.814 -0.627 6.352 1.00 0.00 O ATOM 101 CB ILE A 7 -6.622 1.640 8.029 1.00 0.00 C ATOM 102 CG1 ILE A 7 -5.807 2.894 8.351 1.00 0.00 C ATOM 103 CG2 ILE A 7 -6.558 0.634 9.170 1.00 0.00 C ATOM 104 CD1 ILE A 7 -6.558 3.908 9.174 1.00 0.00 C ATOM 0 H ILE A 7 -7.486 2.209 5.669 1.00 0.00 H new ATOM 0 HA ILE A 7 -5.023 0.995 6.740 1.00 0.00 H new ATOM 0 HB ILE A 7 -7.671 1.911 7.911 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -4.903 2.602 8.886 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -5.489 3.360 7.418 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -6.926 1.098 10.085 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -7.176 -0.231 8.928 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -5.526 0.314 9.315 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -5.918 4.769 9.363 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -7.448 4.229 8.632 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -6.853 3.460 10.123 1.00 0.00 H new ATOM 116 N PRO A 8 -5.688 -1.369 6.528 1.00 0.00 N ATOM 117 CA PRO A 8 -6.018 -2.779 6.330 1.00 0.00 C ATOM 118 C PRO A 8 -6.607 -3.435 7.577 1.00 0.00 C ATOM 119 O PRO A 8 -6.885 -2.771 8.576 1.00 0.00 O ATOM 120 CB PRO A 8 -4.666 -3.401 5.985 1.00 0.00 C ATOM 121 CG PRO A 8 -3.671 -2.556 6.703 1.00 0.00 C ATOM 122 CD PRO A 8 -4.240 -1.162 6.717 1.00 0.00 C ATOM 0 HA PRO A 8 -6.782 -2.914 5.565 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -4.613 -4.440 6.311 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -4.489 -3.395 4.909 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -3.509 -2.921 7.717 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -2.705 -2.578 6.199 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -4.028 -0.653 7.658 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -3.817 -0.549 5.921 1.00 0.00 H new ATOM 130 N LYS A 9 -6.788 -4.748 7.509 1.00 0.00 N ATOM 131 CA LYS A 9 -7.392 -5.498 8.603 1.00 0.00 C ATOM 132 C LYS A 9 -6.338 -6.012 9.579 1.00 0.00 C ATOM 133 O LYS A 9 -6.666 -6.439 10.684 1.00 0.00 O ATOM 134 CB LYS A 9 -8.202 -6.675 8.057 1.00 0.00 C ATOM 135 CG LYS A 9 -7.399 -7.588 7.140 1.00 0.00 C ATOM 136 CD LYS A 9 -8.136 -8.882 6.841 1.00 0.00 C ATOM 137 CE LYS A 9 -9.473 -8.635 6.160 1.00 0.00 C ATOM 138 NZ LYS A 9 -10.183 -9.907 5.878 1.00 0.00 N ATOM 0 H LYS A 9 -6.524 -5.317 6.705 1.00 0.00 H new ATOM 0 HA LYS A 9 -8.053 -4.818 9.140 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -8.588 -7.259 8.892 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -9.064 -6.291 7.511 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -7.186 -7.068 6.206 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -6.440 -7.816 7.604 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -7.516 -9.513 6.204 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -8.298 -9.429 7.770 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -10.094 -8.003 6.795 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -9.313 -8.092 5.228 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -11.091 -9.702 5.414 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -9.600 -10.499 5.253 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -10.357 -10.413 6.770 1.00 0.00 H new ATOM 152 N ASP A 10 -5.077 -5.980 9.167 1.00 0.00 N ATOM 153 CA ASP A 10 -3.999 -6.497 10.004 1.00 0.00 C ATOM 154 C ASP A 10 -3.355 -5.375 10.801 1.00 0.00 C ATOM 155 O ASP A 10 -3.230 -4.250 10.319 1.00 0.00 O ATOM 156 CB ASP A 10 -2.945 -7.227 9.163 1.00 0.00 C ATOM 157 CG ASP A 10 -1.851 -7.847 10.016 1.00 0.00 C ATOM 158 OD1 ASP A 10 -0.679 -7.830 9.597 1.00 0.00 O ATOM 159 OD2 ASP A 10 -2.160 -8.350 11.118 1.00 0.00 O ATOM 0 H ASP A 10 -4.776 -5.606 8.267 1.00 0.00 H new ATOM 0 HA ASP A 10 -4.433 -7.215 10.700 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -3.429 -8.007 8.575 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -2.499 -6.527 8.457 1.00 0.00 H new ATOM 164 N LYS A 11 -2.931 -5.701 12.013 1.00 0.00 N ATOM 165 CA LYS A 11 -2.393 -4.714 12.939 1.00 0.00 C ATOM 166 C LYS A 11 -0.870 -4.755 12.919 1.00 0.00 C ATOM 167 O LYS A 11 -0.206 -4.078 13.702 1.00 0.00 O ATOM 168 CB LYS A 11 -2.902 -5.004 14.353 1.00 0.00 C ATOM 169 CG LYS A 11 -4.411 -5.175 14.430 1.00 0.00 C ATOM 170 CD LYS A 11 -4.844 -5.755 15.768 1.00 0.00 C ATOM 171 CE LYS A 11 -4.240 -7.133 16.006 1.00 0.00 C ATOM 172 NZ LYS A 11 -4.618 -8.099 14.941 1.00 0.00 N ATOM 0 H LYS A 11 -2.950 -6.652 12.381 1.00 0.00 H new ATOM 0 HA LYS A 11 -2.723 -3.721 12.634 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -2.422 -5.909 14.725 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -2.602 -4.190 15.013 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -4.895 -4.210 14.278 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -4.745 -5.829 13.625 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -4.543 -5.082 16.571 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -5.931 -5.824 15.800 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -3.154 -7.050 16.051 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -4.571 -7.512 16.973 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -4.362 -9.062 15.239 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -5.643 -8.049 14.775 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -4.113 -7.863 14.063 1.00 0.00 H new ATOM 186 N SER A 12 -0.329 -5.564 12.020 1.00 0.00 N ATOM 187 CA SER A 12 1.110 -5.749 11.925 1.00 0.00 C ATOM 188 C SER A 12 1.645 -5.140 10.631 1.00 0.00 C ATOM 189 O SER A 12 2.808 -5.336 10.273 1.00 0.00 O ATOM 190 CB SER A 12 1.435 -7.244 11.971 1.00 0.00 C ATOM 191 OG SER A 12 0.611 -7.915 12.915 1.00 0.00 O ATOM 0 H SER A 12 -0.868 -6.105 11.344 1.00 0.00 H new ATOM 0 HA SER A 12 1.587 -5.245 12.766 1.00 0.00 H new ATOM 0 HB2 SER A 12 1.293 -7.681 10.983 1.00 0.00 H new ATOM 0 HB3 SER A 12 2.484 -7.384 12.234 1.00 0.00 H new ATOM 0 HG SER A 12 -0.260 -8.108 12.510 1.00 0.00 H new ATOM 197 N LYS A 13 0.791 -4.395 9.938 1.00 0.00 N ATOM 198 CA LYS A 13 1.152 -3.837 8.641 1.00 0.00 C ATOM 199 C LYS A 13 1.311 -2.331 8.705 1.00 0.00 C ATOM 200 O LYS A 13 0.983 -1.696 9.707 1.00 0.00 O ATOM 201 CB LYS A 13 0.108 -4.181 7.585 1.00 0.00 C ATOM 202 CG LYS A 13 -0.043 -5.665 7.344 1.00 0.00 C ATOM 203 CD LYS A 13 -0.843 -5.942 6.090 1.00 0.00 C ATOM 204 CE LYS A 13 -1.047 -7.436 5.884 1.00 0.00 C ATOM 205 NZ LYS A 13 0.243 -8.173 5.820 1.00 0.00 N ATOM 0 H LYS A 13 -0.152 -4.164 10.251 1.00 0.00 H new ATOM 0 HA LYS A 13 2.108 -4.282 8.365 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -0.855 -3.771 7.891 1.00 0.00 H new ATOM 0 HB3 LYS A 13 0.378 -3.695 6.648 1.00 0.00 H new ATOM 0 HG2 LYS A 13 0.942 -6.123 7.257 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -0.535 -6.126 8.200 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -1.811 -5.446 6.157 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -0.328 -5.521 5.227 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -1.652 -7.835 6.699 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -1.605 -7.602 4.962 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 0.073 -9.141 5.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 0.890 -7.685 5.168 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 0.670 -8.209 6.768 1.00 0.00 H new ATOM 219 N VAL A 14 1.798 -1.767 7.614 1.00 0.00 N ATOM 220 CA VAL A 14 2.038 -0.339 7.523 1.00 0.00 C ATOM 221 C VAL A 14 0.924 0.349 6.740 1.00 0.00 C ATOM 222 O VAL A 14 0.704 0.054 5.564 1.00 0.00 O ATOM 223 CB VAL A 14 3.393 -0.046 6.843 1.00 0.00 C ATOM 224 CG1 VAL A 14 3.635 1.451 6.738 1.00 0.00 C ATOM 225 CG2 VAL A 14 4.528 -0.722 7.599 1.00 0.00 C ATOM 0 H VAL A 14 2.037 -2.285 6.769 1.00 0.00 H new ATOM 0 HA VAL A 14 2.059 0.053 8.540 1.00 0.00 H new ATOM 0 HB VAL A 14 3.361 -0.454 5.833 1.00 0.00 H new ATOM 0 HG11 VAL A 14 4.596 1.631 6.256 1.00 0.00 H new ATOM 0 HG12 VAL A 14 2.841 1.907 6.147 1.00 0.00 H new ATOM 0 HG13 VAL A 14 3.642 1.889 7.736 1.00 0.00 H new ATOM 0 HG21 VAL A 14 5.475 -0.504 7.105 1.00 0.00 H new ATOM 0 HG22 VAL A 14 4.558 -0.347 8.622 1.00 0.00 H new ATOM 0 HG23 VAL A 14 4.365 -1.800 7.612 1.00 0.00 H new ATOM 235 N ALA A 15 0.215 1.252 7.403 1.00 0.00 N ATOM 236 CA ALA A 15 -0.823 2.038 6.744 1.00 0.00 C ATOM 237 C ALA A 15 -0.243 3.349 6.227 1.00 0.00 C ATOM 238 O ALA A 15 -0.754 3.944 5.278 1.00 0.00 O ATOM 239 CB ALA A 15 -1.974 2.310 7.700 1.00 0.00 C ATOM 0 H ALA A 15 0.338 1.459 8.394 1.00 0.00 H new ATOM 0 HA ALA A 15 -1.205 1.467 5.898 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -2.738 2.897 7.191 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -2.403 1.364 8.031 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -1.606 2.864 8.564 1.00 0.00 H new ATOM 245 N GLY A 16 0.836 3.784 6.861 1.00 0.00 N ATOM 246 CA GLY A 16 1.488 5.017 6.483 1.00 0.00 C ATOM 247 C GLY A 16 2.784 5.206 7.237 1.00 0.00 C ATOM 248 O GLY A 16 3.136 4.385 8.081 1.00 0.00 O ATOM 0 H GLY A 16 1.275 3.296 7.641 1.00 0.00 H new ATOM 0 HA2 GLY A 16 1.686 5.013 5.411 1.00 0.00 H new ATOM 0 HA3 GLY A 16 0.823 5.858 6.681 1.00 0.00 H new ATOM 252 N TYR A 17 3.492 6.281 6.943 1.00 0.00 N ATOM 253 CA TYR A 17 4.763 6.558 7.592 1.00 0.00 C ATOM 254 C TYR A 17 4.728 7.923 8.247 1.00 0.00 C ATOM 255 O TYR A 17 4.241 8.887 7.655 1.00 0.00 O ATOM 256 CB TYR A 17 5.914 6.516 6.586 1.00 0.00 C ATOM 257 CG TYR A 17 5.999 5.228 5.801 1.00 0.00 C ATOM 258 CD1 TYR A 17 5.397 5.114 4.556 1.00 0.00 C ATOM 259 CD2 TYR A 17 6.685 4.132 6.302 1.00 0.00 C ATOM 260 CE1 TYR A 17 5.475 3.942 3.832 1.00 0.00 C ATOM 261 CE2 TYR A 17 6.767 2.954 5.585 1.00 0.00 C ATOM 262 CZ TYR A 17 6.163 2.864 4.349 1.00 0.00 C ATOM 263 OH TYR A 17 6.245 1.693 3.628 1.00 0.00 O ATOM 0 H TYR A 17 3.208 6.980 6.256 1.00 0.00 H new ATOM 0 HA TYR A 17 4.926 5.789 8.348 1.00 0.00 H new ATOM 0 HB2 TYR A 17 5.804 7.347 5.889 1.00 0.00 H new ATOM 0 HB3 TYR A 17 6.853 6.668 7.118 1.00 0.00 H new ATOM 0 HD1 TYR A 17 4.859 5.956 4.147 1.00 0.00 H new ATOM 0 HD2 TYR A 17 7.163 4.200 7.268 1.00 0.00 H new ATOM 0 HE1 TYR A 17 5.000 3.869 2.865 1.00 0.00 H new ATOM 0 HE2 TYR A 17 7.302 2.108 5.991 1.00 0.00 H new ATOM 0 HH TYR A 17 6.765 1.034 4.133 1.00 0.00 H new ATOM 273 N ILE A 18 5.243 8.007 9.460 1.00 0.00 N ATOM 274 CA ILE A 18 5.321 9.274 10.152 1.00 0.00 C ATOM 275 C ILE A 18 6.777 9.727 10.255 1.00 0.00 C ATOM 276 O ILE A 18 7.580 9.194 11.027 1.00 0.00 O ATOM 277 CB ILE A 18 4.644 9.225 11.547 1.00 0.00 C ATOM 278 CG1 ILE A 18 4.705 10.595 12.225 1.00 0.00 C ATOM 279 CG2 ILE A 18 5.260 8.160 12.438 1.00 0.00 C ATOM 280 CD1 ILE A 18 3.921 11.659 11.492 1.00 0.00 C ATOM 0 H ILE A 18 5.612 7.213 9.983 1.00 0.00 H new ATOM 0 HA ILE A 18 4.766 10.007 9.567 1.00 0.00 H new ATOM 0 HB ILE A 18 3.599 8.957 11.392 1.00 0.00 H new ATOM 0 HG12 ILE A 18 4.322 10.507 13.242 1.00 0.00 H new ATOM 0 HG13 ILE A 18 5.746 10.909 12.302 1.00 0.00 H new ATOM 0 HG21 ILE A 18 4.757 8.159 13.405 1.00 0.00 H new ATOM 0 HG22 ILE A 18 5.146 7.183 11.969 1.00 0.00 H new ATOM 0 HG23 ILE A 18 6.320 8.373 12.580 1.00 0.00 H new ATOM 0 HD11 ILE A 18 4.006 12.606 12.025 1.00 0.00 H new ATOM 0 HD12 ILE A 18 4.318 11.774 10.483 1.00 0.00 H new ATOM 0 HD13 ILE A 18 2.873 11.366 11.438 1.00 0.00 H new ATOM 292 N GLU A 19 7.116 10.684 9.421 1.00 0.00 N ATOM 293 CA GLU A 19 8.463 11.218 9.367 1.00 0.00 C ATOM 294 C GLU A 19 8.480 12.678 9.791 1.00 0.00 C ATOM 295 O GLU A 19 7.996 13.557 9.081 1.00 0.00 O ATOM 296 CB GLU A 19 9.052 11.063 7.963 1.00 0.00 C ATOM 297 CG GLU A 19 9.377 9.623 7.599 1.00 0.00 C ATOM 298 CD GLU A 19 9.873 9.469 6.175 1.00 0.00 C ATOM 299 OE1 GLU A 19 10.622 10.343 5.698 1.00 0.00 O ATOM 300 OE2 GLU A 19 9.528 8.457 5.526 1.00 0.00 O ATOM 0 H GLU A 19 6.469 11.115 8.761 1.00 0.00 H new ATOM 0 HA GLU A 19 9.080 10.650 10.063 1.00 0.00 H new ATOM 0 HB2 GLU A 19 8.346 11.463 7.235 1.00 0.00 H new ATOM 0 HB3 GLU A 19 9.960 11.662 7.890 1.00 0.00 H new ATOM 0 HG2 GLU A 19 10.134 9.243 8.285 1.00 0.00 H new ATOM 0 HG3 GLU A 19 8.486 9.010 7.736 1.00 0.00 H new ATOM 307 N ILE A 20 9.031 12.915 10.965 1.00 0.00 N ATOM 308 CA ILE A 20 9.157 14.253 11.504 1.00 0.00 C ATOM 309 C ILE A 20 10.627 14.552 11.764 1.00 0.00 C ATOM 310 O ILE A 20 11.162 14.182 12.810 1.00 0.00 O ATOM 311 CB ILE A 20 8.362 14.409 12.819 1.00 0.00 C ATOM 312 CG1 ILE A 20 6.951 13.842 12.654 1.00 0.00 C ATOM 313 CG2 ILE A 20 8.300 15.875 13.236 1.00 0.00 C ATOM 314 CD1 ILE A 20 6.160 13.797 13.942 1.00 0.00 C ATOM 0 H ILE A 20 9.404 12.185 11.572 1.00 0.00 H new ATOM 0 HA ILE A 20 8.750 14.955 10.776 1.00 0.00 H new ATOM 0 HB ILE A 20 8.874 13.850 13.602 1.00 0.00 H new ATOM 0 HG12 ILE A 20 6.409 14.446 11.926 1.00 0.00 H new ATOM 0 HG13 ILE A 20 7.019 12.834 12.244 1.00 0.00 H new ATOM 0 HG21 ILE A 20 7.736 15.966 14.164 1.00 0.00 H new ATOM 0 HG22 ILE A 20 9.311 16.253 13.387 1.00 0.00 H new ATOM 0 HG23 ILE A 20 7.809 16.455 12.455 1.00 0.00 H new ATOM 0 HD11 ILE A 20 5.170 13.384 13.747 1.00 0.00 H new ATOM 0 HD12 ILE A 20 6.679 13.169 14.666 1.00 0.00 H new ATOM 0 HD13 ILE A 20 6.059 14.806 14.343 1.00 0.00 H new ATOM 326 N PRO A 21 11.309 15.199 10.805 1.00 0.00 N ATOM 327 CA PRO A 21 12.740 15.500 10.915 1.00 0.00 C ATOM 328 C PRO A 21 13.016 16.440 12.073 1.00 0.00 C ATOM 329 O PRO A 21 14.081 16.407 12.688 1.00 0.00 O ATOM 330 CB PRO A 21 13.083 16.177 9.581 1.00 0.00 C ATOM 331 CG PRO A 21 11.953 15.837 8.669 1.00 0.00 C ATOM 332 CD PRO A 21 10.742 15.697 9.544 1.00 0.00 C ATOM 0 HA PRO A 21 13.335 14.607 11.104 1.00 0.00 H new ATOM 0 HB2 PRO A 21 13.182 17.256 9.701 1.00 0.00 H new ATOM 0 HB3 PRO A 21 14.031 15.812 9.186 1.00 0.00 H new ATOM 0 HG2 PRO A 21 11.806 16.617 7.922 1.00 0.00 H new ATOM 0 HG3 PRO A 21 12.153 14.912 8.129 1.00 0.00 H new ATOM 0 HD2 PRO A 21 10.228 16.649 9.679 1.00 0.00 H new ATOM 0 HD3 PRO A 21 10.017 15.000 9.123 1.00 0.00 H new ATOM 340 N ASP A 22 12.014 17.245 12.378 1.00 0.00 N ATOM 341 CA ASP A 22 12.082 18.217 13.456 1.00 0.00 C ATOM 342 C ASP A 22 12.151 17.513 14.810 1.00 0.00 C ATOM 343 O ASP A 22 12.683 18.052 15.776 1.00 0.00 O ATOM 344 CB ASP A 22 10.851 19.119 13.376 1.00 0.00 C ATOM 345 CG ASP A 22 10.921 20.346 14.262 1.00 0.00 C ATOM 346 OD1 ASP A 22 11.874 21.140 14.113 1.00 0.00 O ATOM 347 OD2 ASP A 22 9.988 20.557 15.060 1.00 0.00 O ATOM 0 H ASP A 22 11.123 17.243 11.881 1.00 0.00 H new ATOM 0 HA ASP A 22 12.984 18.820 13.353 1.00 0.00 H new ATOM 0 HB2 ASP A 22 10.715 19.438 12.343 1.00 0.00 H new ATOM 0 HB3 ASP A 22 9.970 18.538 13.649 1.00 0.00 H new ATOM 352 N ALA A 23 11.640 16.286 14.864 1.00 0.00 N ATOM 353 CA ALA A 23 11.643 15.515 16.100 1.00 0.00 C ATOM 354 C ALA A 23 12.463 14.235 15.954 1.00 0.00 C ATOM 355 O ALA A 23 12.415 13.360 16.815 1.00 0.00 O ATOM 356 CB ALA A 23 10.218 15.187 16.509 1.00 0.00 C ATOM 0 H ALA A 23 11.220 15.807 14.068 1.00 0.00 H new ATOM 0 HA ALA A 23 12.108 16.120 16.878 1.00 0.00 H new ATOM 0 HB1 ALA A 23 10.229 14.610 17.434 1.00 0.00 H new ATOM 0 HB2 ALA A 23 9.662 16.112 16.664 1.00 0.00 H new ATOM 0 HB3 ALA A 23 9.739 14.603 15.723 1.00 0.00 H new ATOM 362 N ASP A 24 13.220 14.148 14.861 1.00 0.00 N ATOM 363 CA ASP A 24 14.077 12.988 14.570 1.00 0.00 C ATOM 364 C ASP A 24 13.247 11.697 14.478 1.00 0.00 C ATOM 365 O ASP A 24 13.733 10.596 14.740 1.00 0.00 O ATOM 366 CB ASP A 24 15.181 12.856 15.633 1.00 0.00 C ATOM 367 CG ASP A 24 16.259 11.854 15.253 1.00 0.00 C ATOM 368 OD1 ASP A 24 16.669 11.835 14.069 1.00 0.00 O ATOM 369 OD2 ASP A 24 16.713 11.094 16.137 1.00 0.00 O ATOM 0 H ASP A 24 13.260 14.877 14.149 1.00 0.00 H new ATOM 0 HA ASP A 24 14.550 13.148 13.601 1.00 0.00 H new ATOM 0 HB2 ASP A 24 15.640 13.831 15.794 1.00 0.00 H new ATOM 0 HB3 ASP A 24 14.732 12.555 16.579 1.00 0.00 H new ATOM 374 N ILE A 25 12.003 11.840 14.055 1.00 0.00 N ATOM 375 CA ILE A 25 11.078 10.717 13.962 1.00 0.00 C ATOM 376 C ILE A 25 11.015 10.172 12.532 1.00 0.00 C ATOM 377 O ILE A 25 10.717 10.915 11.599 1.00 0.00 O ATOM 378 CB ILE A 25 9.667 11.149 14.415 1.00 0.00 C ATOM 379 CG1 ILE A 25 9.685 11.527 15.899 1.00 0.00 C ATOM 380 CG2 ILE A 25 8.650 10.043 14.157 1.00 0.00 C ATOM 381 CD1 ILE A 25 8.366 12.069 16.407 1.00 0.00 C ATOM 0 H ILE A 25 11.604 12.733 13.767 1.00 0.00 H new ATOM 0 HA ILE A 25 11.443 9.927 14.618 1.00 0.00 H new ATOM 0 HB ILE A 25 9.369 12.021 13.833 1.00 0.00 H new ATOM 0 HG12 ILE A 25 9.956 10.649 16.485 1.00 0.00 H new ATOM 0 HG13 ILE A 25 10.462 12.273 16.065 1.00 0.00 H new ATOM 0 HG21 ILE A 25 7.664 10.372 14.485 1.00 0.00 H new ATOM 0 HG22 ILE A 25 8.621 9.816 13.091 1.00 0.00 H new ATOM 0 HG23 ILE A 25 8.937 9.149 14.710 1.00 0.00 H new ATOM 0 HD11 ILE A 25 8.457 12.314 17.465 1.00 0.00 H new ATOM 0 HD12 ILE A 25 8.102 12.967 15.848 1.00 0.00 H new ATOM 0 HD13 ILE A 25 7.588 11.317 16.274 1.00 0.00 H new ATOM 393 N LYS A 26 11.325 8.885 12.358 1.00 0.00 N ATOM 394 CA LYS A 26 11.303 8.252 11.036 1.00 0.00 C ATOM 395 C LYS A 26 10.840 6.797 11.144 1.00 0.00 C ATOM 396 O LYS A 26 11.671 5.890 11.155 1.00 0.00 O ATOM 397 CB LYS A 26 12.699 8.247 10.375 1.00 0.00 C ATOM 398 CG LYS A 26 13.377 9.607 10.222 1.00 0.00 C ATOM 399 CD LYS A 26 14.073 10.055 11.502 1.00 0.00 C ATOM 400 CE LYS A 26 15.171 9.091 11.930 1.00 0.00 C ATOM 401 NZ LYS A 26 15.757 9.475 13.241 1.00 0.00 N ATOM 0 H LYS A 26 11.595 8.259 13.117 1.00 0.00 H new ATOM 0 HA LYS A 26 10.613 8.836 10.427 1.00 0.00 H new ATOM 0 HB2 LYS A 26 13.353 7.602 10.961 1.00 0.00 H new ATOM 0 HB3 LYS A 26 12.609 7.796 9.387 1.00 0.00 H new ATOM 0 HG2 LYS A 26 14.106 9.558 9.413 1.00 0.00 H new ATOM 0 HG3 LYS A 26 12.633 10.351 9.936 1.00 0.00 H new ATOM 0 HD2 LYS A 26 14.501 11.046 11.353 1.00 0.00 H new ATOM 0 HD3 LYS A 26 13.337 10.143 12.302 1.00 0.00 H new ATOM 0 HE2 LYS A 26 14.765 8.082 11.994 1.00 0.00 H new ATOM 0 HE3 LYS A 26 15.954 9.072 11.172 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 16.416 8.735 13.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 16.269 10.375 13.142 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 14.997 9.585 13.942 1.00 0.00 H new ATOM 415 N GLU A 27 9.532 6.568 11.231 1.00 0.00 N ATOM 416 CA GLU A 27 8.999 5.206 11.354 1.00 0.00 C ATOM 417 C GLU A 27 7.571 5.111 10.812 1.00 0.00 C ATOM 418 O GLU A 27 6.876 6.120 10.695 1.00 0.00 O ATOM 419 CB GLU A 27 9.033 4.741 12.818 1.00 0.00 C ATOM 420 CG GLU A 27 10.340 4.073 13.228 1.00 0.00 C ATOM 421 CD GLU A 27 10.620 2.808 12.438 1.00 0.00 C ATOM 422 OE1 GLU A 27 11.388 2.872 11.451 1.00 0.00 O ATOM 423 OE2 GLU A 27 10.067 1.746 12.786 1.00 0.00 O ATOM 0 H GLU A 27 8.822 7.300 11.219 1.00 0.00 H new ATOM 0 HA GLU A 27 9.635 4.552 10.757 1.00 0.00 H new ATOM 0 HB2 GLU A 27 8.858 5.600 13.465 1.00 0.00 H new ATOM 0 HB3 GLU A 27 8.213 4.043 12.986 1.00 0.00 H new ATOM 0 HG2 GLU A 27 11.162 4.775 13.087 1.00 0.00 H new ATOM 0 HG3 GLU A 27 10.304 3.833 14.291 1.00 0.00 H new ATOM 430 N PRO A 28 7.123 3.891 10.457 1.00 0.00 N ATOM 431 CA PRO A 28 5.758 3.652 9.974 1.00 0.00 C ATOM 432 C PRO A 28 4.712 3.688 11.091 1.00 0.00 C ATOM 433 O PRO A 28 5.039 3.598 12.276 1.00 0.00 O ATOM 434 CB PRO A 28 5.841 2.245 9.380 1.00 0.00 C ATOM 435 CG PRO A 28 6.919 1.576 10.151 1.00 0.00 C ATOM 436 CD PRO A 28 7.920 2.648 10.475 1.00 0.00 C ATOM 0 HA PRO A 28 5.442 4.422 9.270 1.00 0.00 H new ATOM 0 HB2 PRO A 28 4.894 1.715 9.482 1.00 0.00 H new ATOM 0 HB3 PRO A 28 6.076 2.277 8.316 1.00 0.00 H new ATOM 0 HG2 PRO A 28 6.525 1.122 11.060 1.00 0.00 H new ATOM 0 HG3 PRO A 28 7.377 0.777 9.569 1.00 0.00 H new ATOM 0 HD2 PRO A 28 8.382 2.483 11.448 1.00 0.00 H new ATOM 0 HD3 PRO A 28 8.725 2.678 9.741 1.00 0.00 H new ATOM 444 N VAL A 29 3.454 3.820 10.699 1.00 0.00 N ATOM 445 CA VAL A 29 2.341 3.805 11.639 1.00 0.00 C ATOM 446 C VAL A 29 1.565 2.498 11.501 1.00 0.00 C ATOM 447 O VAL A 29 1.257 2.068 10.385 1.00 0.00 O ATOM 448 CB VAL A 29 1.384 4.996 11.405 1.00 0.00 C ATOM 449 CG1 VAL A 29 0.249 4.993 12.419 1.00 0.00 C ATOM 450 CG2 VAL A 29 2.143 6.310 11.458 1.00 0.00 C ATOM 0 H VAL A 29 3.175 3.940 9.725 1.00 0.00 H new ATOM 0 HA VAL A 29 2.753 3.891 12.644 1.00 0.00 H new ATOM 0 HB VAL A 29 0.949 4.888 10.411 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -0.409 5.841 12.231 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -0.318 4.067 12.328 1.00 0.00 H new ATOM 0 HG13 VAL A 29 0.660 5.069 13.426 1.00 0.00 H new ATOM 0 HG21 VAL A 29 1.452 7.136 11.291 1.00 0.00 H new ATOM 0 HG22 VAL A 29 2.611 6.421 12.436 1.00 0.00 H new ATOM 0 HG23 VAL A 29 2.911 6.318 10.685 1.00 0.00 H new ATOM 460 N TYR A 30 1.259 1.871 12.628 1.00 0.00 N ATOM 461 CA TYR A 30 0.557 0.594 12.628 1.00 0.00 C ATOM 462 C TYR A 30 -0.886 0.784 13.073 1.00 0.00 C ATOM 463 O TYR A 30 -1.144 1.234 14.185 1.00 0.00 O ATOM 464 CB TYR A 30 1.267 -0.408 13.540 1.00 0.00 C ATOM 465 CG TYR A 30 2.710 -0.644 13.156 1.00 0.00 C ATOM 466 CD1 TYR A 30 3.033 -1.310 11.980 1.00 0.00 C ATOM 467 CD2 TYR A 30 3.747 -0.199 13.964 1.00 0.00 C ATOM 468 CE1 TYR A 30 4.347 -1.527 11.620 1.00 0.00 C ATOM 469 CE2 TYR A 30 5.065 -0.411 13.611 1.00 0.00 C ATOM 470 CZ TYR A 30 5.360 -1.077 12.439 1.00 0.00 C ATOM 471 OH TYR A 30 6.673 -1.291 12.084 1.00 0.00 O ATOM 0 H TYR A 30 1.486 2.226 13.557 1.00 0.00 H new ATOM 0 HA TYR A 30 0.560 0.198 11.612 1.00 0.00 H new ATOM 0 HB2 TYR A 30 1.226 -0.047 14.568 1.00 0.00 H new ATOM 0 HB3 TYR A 30 0.731 -1.357 13.514 1.00 0.00 H new ATOM 0 HD1 TYR A 30 2.241 -1.664 11.336 1.00 0.00 H new ATOM 0 HD2 TYR A 30 3.520 0.321 14.883 1.00 0.00 H new ATOM 0 HE1 TYR A 30 4.580 -2.046 10.702 1.00 0.00 H new ATOM 0 HE2 TYR A 30 5.861 -0.057 14.249 1.00 0.00 H new ATOM 0 HH TYR A 30 7.263 -0.911 12.768 1.00 0.00 H new ATOM 481 N PRO A 31 -1.842 0.454 12.201 1.00 0.00 N ATOM 482 CA PRO A 31 -3.261 0.665 12.463 1.00 0.00 C ATOM 483 C PRO A 31 -3.906 -0.479 13.238 1.00 0.00 C ATOM 484 O PRO A 31 -3.357 -1.580 13.319 1.00 0.00 O ATOM 485 CB PRO A 31 -3.835 0.740 11.055 1.00 0.00 C ATOM 486 CG PRO A 31 -2.988 -0.192 10.256 1.00 0.00 C ATOM 487 CD PRO A 31 -1.614 -0.156 10.877 1.00 0.00 C ATOM 0 HA PRO A 31 -3.441 1.544 13.083 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -4.882 0.439 11.037 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -3.788 1.755 10.661 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -3.397 -1.202 10.276 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -2.950 0.116 9.211 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -1.189 -1.156 10.965 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -0.920 0.434 10.279 1.00 0.00 H new ATOM 495 N GLY A 32 -5.072 -0.215 13.814 1.00 0.00 N ATOM 496 CA GLY A 32 -5.807 -1.262 14.489 1.00 0.00 C ATOM 497 C GLY A 32 -6.770 -0.719 15.520 1.00 0.00 C ATOM 498 O GLY A 32 -6.939 0.494 15.630 1.00 0.00 O ATOM 0 H GLY A 32 -5.519 0.702 13.825 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -6.359 -1.847 13.753 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -5.105 -1.940 14.974 1.00 0.00 H new ATOM 502 N PRO A 33 -7.412 -1.607 16.298 1.00 0.00 N ATOM 503 CA PRO A 33 -8.377 -1.218 17.339 1.00 0.00 C ATOM 504 C PRO A 33 -7.698 -0.685 18.594 1.00 0.00 C ATOM 505 O PRO A 33 -8.345 -0.448 19.616 1.00 0.00 O ATOM 506 CB PRO A 33 -9.094 -2.527 17.641 1.00 0.00 C ATOM 507 CG PRO A 33 -8.077 -3.579 17.371 1.00 0.00 C ATOM 508 CD PRO A 33 -7.261 -3.072 16.213 1.00 0.00 C ATOM 0 HA PRO A 33 -9.034 -0.412 17.011 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -9.437 -2.562 18.675 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -9.973 -2.653 17.009 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -7.450 -3.751 18.246 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -8.552 -4.529 17.128 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -6.217 -3.373 16.296 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -7.630 -3.459 15.263 1.00 0.00 H new ATOM 516 N ALA A 34 -6.385 -0.532 18.495 1.00 0.00 N ATOM 517 CA ALA A 34 -5.557 0.021 19.562 1.00 0.00 C ATOM 518 C ALA A 34 -5.543 -0.875 20.795 1.00 0.00 C ATOM 519 O ALA A 34 -6.204 -0.595 21.797 1.00 0.00 O ATOM 520 CB ALA A 34 -5.995 1.433 19.929 1.00 0.00 C ATOM 0 H ALA A 34 -5.857 -0.791 17.662 1.00 0.00 H new ATOM 0 HA ALA A 34 -4.538 0.069 19.178 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -5.358 1.816 20.726 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -5.910 2.079 19.055 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -7.031 1.416 20.268 1.00 0.00 H new ATOM 526 N THR A 35 -4.804 -1.971 20.705 1.00 0.00 N ATOM 527 CA THR A 35 -4.583 -2.831 21.855 1.00 0.00 C ATOM 528 C THR A 35 -3.115 -2.745 22.280 1.00 0.00 C ATOM 529 O THR A 35 -2.282 -2.261 21.509 1.00 0.00 O ATOM 530 CB THR A 35 -4.983 -4.301 21.566 1.00 0.00 C ATOM 531 OG1 THR A 35 -4.254 -4.811 20.446 1.00 0.00 O ATOM 532 CG2 THR A 35 -6.476 -4.416 21.295 1.00 0.00 C ATOM 0 H THR A 35 -4.348 -2.284 19.848 1.00 0.00 H new ATOM 0 HA THR A 35 -5.220 -2.483 22.668 1.00 0.00 H new ATOM 0 HB THR A 35 -4.739 -4.890 22.450 1.00 0.00 H new ATOM 0 HG1 THR A 35 -4.467 -4.282 19.649 1.00 0.00 H new ATOM 0 HG21 THR A 35 -6.730 -5.457 21.095 1.00 0.00 H new ATOM 0 HG22 THR A 35 -7.032 -4.067 22.165 1.00 0.00 H new ATOM 0 HG23 THR A 35 -6.737 -3.806 20.430 1.00 0.00 H new ATOM 540 N PRO A 36 -2.788 -3.202 23.508 1.00 0.00 N ATOM 541 CA PRO A 36 -1.451 -3.065 24.111 1.00 0.00 C ATOM 542 C PRO A 36 -0.272 -3.244 23.144 1.00 0.00 C ATOM 543 O PRO A 36 0.642 -2.422 23.126 1.00 0.00 O ATOM 544 CB PRO A 36 -1.450 -4.172 25.163 1.00 0.00 C ATOM 545 CG PRO A 36 -2.866 -4.239 25.624 1.00 0.00 C ATOM 546 CD PRO A 36 -3.720 -3.888 24.432 1.00 0.00 C ATOM 0 HA PRO A 36 -1.301 -2.054 24.490 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -1.123 -5.122 24.741 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -0.774 -3.939 25.986 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -3.107 -5.236 25.994 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -3.040 -3.543 26.445 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -4.151 -4.779 23.975 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -4.550 -3.241 24.714 1.00 0.00 H new ATOM 554 N GLU A 37 -0.296 -4.302 22.336 1.00 0.00 N ATOM 555 CA GLU A 37 0.855 -4.641 21.497 1.00 0.00 C ATOM 556 C GLU A 37 1.057 -3.658 20.343 1.00 0.00 C ATOM 557 O GLU A 37 2.190 -3.436 19.913 1.00 0.00 O ATOM 558 CB GLU A 37 0.740 -6.065 20.956 1.00 0.00 C ATOM 559 CG GLU A 37 0.782 -7.125 22.042 1.00 0.00 C ATOM 560 CD GLU A 37 1.344 -8.434 21.541 1.00 0.00 C ATOM 561 OE1 GLU A 37 0.676 -9.104 20.729 1.00 0.00 O ATOM 562 OE2 GLU A 37 2.464 -8.800 21.959 1.00 0.00 O ATOM 0 H GLU A 37 -1.091 -4.935 22.243 1.00 0.00 H new ATOM 0 HA GLU A 37 1.732 -4.571 22.141 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -0.193 -6.161 20.400 1.00 0.00 H new ATOM 0 HB3 GLU A 37 1.551 -6.245 20.251 1.00 0.00 H new ATOM 0 HG2 GLU A 37 1.388 -6.766 22.874 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -0.224 -7.288 22.428 1.00 0.00 H new ATOM 569 N GLN A 38 -0.021 -3.061 19.842 1.00 0.00 N ATOM 570 CA GLN A 38 0.110 -2.063 18.780 1.00 0.00 C ATOM 571 C GLN A 38 0.863 -0.846 19.304 1.00 0.00 C ATOM 572 O GLN A 38 1.772 -0.332 18.653 1.00 0.00 O ATOM 573 CB GLN A 38 -1.252 -1.621 18.231 1.00 0.00 C ATOM 574 CG GLN A 38 -1.924 -2.625 17.308 1.00 0.00 C ATOM 575 CD GLN A 38 -2.798 -3.605 18.053 1.00 0.00 C ATOM 576 OE1 GLN A 38 -3.978 -3.341 18.291 1.00 0.00 O ATOM 577 NE2 GLN A 38 -2.244 -4.752 18.406 1.00 0.00 N ATOM 0 H GLN A 38 -0.977 -3.244 20.145 1.00 0.00 H new ATOM 0 HA GLN A 38 0.664 -2.527 17.964 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -1.918 -1.418 19.070 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -1.123 -0.682 17.692 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -2.527 -2.091 16.574 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -1.160 -3.172 16.755 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -1.263 -4.932 18.191 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -2.797 -5.457 18.894 1.00 0.00 H new ATOM 586 N LEU A 39 0.500 -0.429 20.512 1.00 0.00 N ATOM 587 CA LEU A 39 1.127 0.714 21.168 1.00 0.00 C ATOM 588 C LEU A 39 2.404 0.272 21.872 1.00 0.00 C ATOM 589 O LEU A 39 2.972 1.003 22.686 1.00 0.00 O ATOM 590 CB LEU A 39 0.167 1.352 22.188 1.00 0.00 C ATOM 591 CG LEU A 39 -1.062 2.071 21.610 1.00 0.00 C ATOM 592 CD1 LEU A 39 -0.647 3.082 20.556 1.00 0.00 C ATOM 593 CD2 LEU A 39 -2.073 1.083 21.043 1.00 0.00 C ATOM 0 H LEU A 39 -0.235 -0.872 21.063 1.00 0.00 H new ATOM 0 HA LEU A 39 1.369 1.456 20.407 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -0.180 0.572 22.865 1.00 0.00 H new ATOM 0 HB3 LEU A 39 0.731 2.067 22.788 1.00 0.00 H new ATOM 0 HG LEU A 39 -1.547 2.605 22.428 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -1.533 3.579 20.160 1.00 0.00 H new ATOM 0 HD12 LEU A 39 0.016 3.823 21.003 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -0.126 2.571 19.747 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -2.929 1.627 20.643 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -1.607 0.503 20.246 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -2.408 0.411 21.833 1.00 0.00 H new ATOM 605 N ASN A 40 2.832 -0.941 21.564 1.00 0.00 N ATOM 606 CA ASN A 40 4.047 -1.505 22.129 1.00 0.00 C ATOM 607 C ASN A 40 5.128 -1.551 21.061 1.00 0.00 C ATOM 608 O ASN A 40 6.259 -1.127 21.285 1.00 0.00 O ATOM 609 CB ASN A 40 3.768 -2.918 22.660 1.00 0.00 C ATOM 610 CG ASN A 40 4.926 -3.532 23.430 1.00 0.00 C ATOM 611 OD1 ASN A 40 6.095 -3.210 23.216 1.00 0.00 O ATOM 612 ND2 ASN A 40 4.598 -4.442 24.332 1.00 0.00 N ATOM 0 H ASN A 40 2.348 -1.562 20.916 1.00 0.00 H new ATOM 0 HA ASN A 40 4.387 -0.881 22.955 1.00 0.00 H new ATOM 0 HB2 ASN A 40 2.892 -2.885 23.308 1.00 0.00 H new ATOM 0 HB3 ASN A 40 3.519 -3.567 21.821 1.00 0.00 H new ATOM 0 HD21 ASN A 40 5.325 -4.903 24.879 1.00 0.00 H new ATOM 0 HD22 ASN A 40 3.618 -4.682 24.481 1.00 0.00 H new ATOM 619 N ARG A 41 4.771 -2.048 19.886 1.00 0.00 N ATOM 620 CA ARG A 41 5.741 -2.200 18.810 1.00 0.00 C ATOM 621 C ARG A 41 5.919 -0.897 18.037 1.00 0.00 C ATOM 622 O ARG A 41 6.972 -0.658 17.444 1.00 0.00 O ATOM 623 CB ARG A 41 5.329 -3.323 17.857 1.00 0.00 C ATOM 624 CG ARG A 41 4.041 -3.054 17.097 1.00 0.00 C ATOM 625 CD ARG A 41 3.811 -4.104 16.028 1.00 0.00 C ATOM 626 NE ARG A 41 4.921 -4.154 15.074 1.00 0.00 N ATOM 627 CZ ARG A 41 5.493 -5.282 14.654 1.00 0.00 C ATOM 628 NH1 ARG A 41 5.112 -6.451 15.150 1.00 0.00 N ATOM 629 NH2 ARG A 41 6.476 -5.235 13.764 1.00 0.00 N ATOM 0 H ARG A 41 3.825 -2.351 19.654 1.00 0.00 H new ATOM 0 HA ARG A 41 6.696 -2.462 19.266 1.00 0.00 H new ATOM 0 HB2 ARG A 41 6.133 -3.489 17.140 1.00 0.00 H new ATOM 0 HB3 ARG A 41 5.215 -4.245 18.427 1.00 0.00 H new ATOM 0 HG2 ARG A 41 3.200 -3.046 17.791 1.00 0.00 H new ATOM 0 HG3 ARG A 41 4.085 -2.066 16.638 1.00 0.00 H new ATOM 0 HD2 ARG A 41 3.689 -5.081 16.497 1.00 0.00 H new ATOM 0 HD3 ARG A 41 2.884 -3.887 15.497 1.00 0.00 H new ATOM 0 HE ARG A 41 5.278 -3.271 14.709 1.00 0.00 H new ATOM 0 HH11 ARG A 41 4.378 -6.490 15.857 1.00 0.00 H new ATOM 0 HH12 ARG A 41 5.553 -7.311 14.825 1.00 0.00 H new ATOM 0 HH21 ARG A 41 6.793 -4.336 13.402 1.00 0.00 H new ATOM 0 HH22 ARG A 41 6.914 -6.098 13.442 1.00 0.00 H new ATOM 643 N GLY A 42 4.895 -0.058 18.047 1.00 0.00 N ATOM 644 CA GLY A 42 4.964 1.195 17.330 1.00 0.00 C ATOM 645 C GLY A 42 3.930 2.188 17.808 1.00 0.00 C ATOM 646 O GLY A 42 3.675 2.301 19.006 1.00 0.00 O ATOM 0 H GLY A 42 4.017 -0.224 18.540 1.00 0.00 H new ATOM 0 HA2 GLY A 42 5.959 1.624 17.449 1.00 0.00 H new ATOM 0 HA3 GLY A 42 4.822 1.010 16.265 1.00 0.00 H new ATOM 650 N VAL A 43 3.338 2.907 16.869 1.00 0.00 N ATOM 651 CA VAL A 43 2.312 3.885 17.183 1.00 0.00 C ATOM 652 C VAL A 43 1.058 3.559 16.378 1.00 0.00 C ATOM 653 O VAL A 43 1.156 3.078 15.245 1.00 0.00 O ATOM 654 CB VAL A 43 2.800 5.323 16.886 1.00 0.00 C ATOM 655 CG1 VAL A 43 3.013 5.544 15.394 1.00 0.00 C ATOM 656 CG2 VAL A 43 1.838 6.350 17.457 1.00 0.00 C ATOM 0 H VAL A 43 3.553 2.830 15.875 1.00 0.00 H new ATOM 0 HA VAL A 43 2.084 3.837 18.248 1.00 0.00 H new ATOM 0 HB VAL A 43 3.765 5.452 17.377 1.00 0.00 H new ATOM 0 HG11 VAL A 43 3.356 6.564 15.223 1.00 0.00 H new ATOM 0 HG12 VAL A 43 3.762 4.843 15.026 1.00 0.00 H new ATOM 0 HG13 VAL A 43 2.074 5.383 14.865 1.00 0.00 H new ATOM 0 HG21 VAL A 43 2.203 7.353 17.235 1.00 0.00 H new ATOM 0 HG22 VAL A 43 0.853 6.215 17.009 1.00 0.00 H new ATOM 0 HG23 VAL A 43 1.766 6.220 18.537 1.00 0.00 H new ATOM 666 N SER A 44 -0.110 3.799 16.954 1.00 0.00 N ATOM 667 CA SER A 44 -1.349 3.341 16.347 1.00 0.00 C ATOM 668 C SER A 44 -2.419 4.422 16.317 1.00 0.00 C ATOM 669 O SER A 44 -2.189 5.559 16.726 1.00 0.00 O ATOM 670 CB SER A 44 -1.859 2.115 17.103 1.00 0.00 C ATOM 671 OG SER A 44 -0.916 1.065 17.029 1.00 0.00 O ATOM 0 H SER A 44 -0.225 4.304 17.833 1.00 0.00 H new ATOM 0 HA SER A 44 -1.134 3.082 15.310 1.00 0.00 H new ATOM 0 HB2 SER A 44 -2.044 2.373 18.146 1.00 0.00 H new ATOM 0 HB3 SER A 44 -2.810 1.789 16.681 1.00 0.00 H new ATOM 0 HG SER A 44 -0.745 0.845 16.090 1.00 0.00 H new ATOM 677 N PHE A 45 -3.588 4.043 15.823 1.00 0.00 N ATOM 678 CA PHE A 45 -4.717 4.947 15.702 1.00 0.00 C ATOM 679 C PHE A 45 -5.642 4.807 16.902 1.00 0.00 C ATOM 680 O PHE A 45 -5.517 3.860 17.675 1.00 0.00 O ATOM 681 CB PHE A 45 -5.474 4.645 14.406 1.00 0.00 C ATOM 682 CG PHE A 45 -4.695 4.998 13.172 1.00 0.00 C ATOM 683 CD1 PHE A 45 -4.231 6.290 12.980 1.00 0.00 C ATOM 684 CD2 PHE A 45 -4.426 4.045 12.206 1.00 0.00 C ATOM 685 CE1 PHE A 45 -3.511 6.620 11.848 1.00 0.00 C ATOM 686 CE2 PHE A 45 -3.708 4.371 11.072 1.00 0.00 C ATOM 687 CZ PHE A 45 -3.250 5.662 10.892 1.00 0.00 C ATOM 0 H PHE A 45 -3.779 3.096 15.494 1.00 0.00 H new ATOM 0 HA PHE A 45 -4.352 5.974 15.673 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -5.726 3.585 14.378 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -6.414 5.196 14.405 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -4.434 7.047 13.723 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -4.782 3.034 12.340 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -3.152 7.630 11.712 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -3.505 3.617 10.326 1.00 0.00 H new ATOM 0 HZ PHE A 45 -2.690 5.920 10.005 1.00 0.00 H new ATOM 697 N ALA A 46 -6.559 5.756 17.053 1.00 0.00 N ATOM 698 CA ALA A 46 -7.516 5.733 18.157 1.00 0.00 C ATOM 699 C ALA A 46 -8.434 4.521 18.060 1.00 0.00 C ATOM 700 O ALA A 46 -8.753 3.889 19.065 1.00 0.00 O ATOM 701 CB ALA A 46 -8.334 7.013 18.177 1.00 0.00 C ATOM 0 H ALA A 46 -6.661 6.553 16.425 1.00 0.00 H new ATOM 0 HA ALA A 46 -6.954 5.660 19.088 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -9.042 6.980 19.005 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -7.669 7.868 18.302 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -8.879 7.111 17.238 1.00 0.00 H new ATOM 707 N GLU A 47 -8.858 4.203 16.845 1.00 0.00 N ATOM 708 CA GLU A 47 -9.711 3.051 16.616 1.00 0.00 C ATOM 709 C GLU A 47 -9.445 2.468 15.235 1.00 0.00 C ATOM 710 O GLU A 47 -8.750 3.077 14.419 1.00 0.00 O ATOM 711 CB GLU A 47 -11.187 3.432 16.756 1.00 0.00 C ATOM 712 CG GLU A 47 -11.678 4.392 15.689 1.00 0.00 C ATOM 713 CD GLU A 47 -13.153 4.693 15.827 1.00 0.00 C ATOM 714 OE1 GLU A 47 -13.962 3.739 15.781 1.00 0.00 O ATOM 715 OE2 GLU A 47 -13.509 5.879 15.980 1.00 0.00 O ATOM 0 H GLU A 47 -8.623 4.729 16.003 1.00 0.00 H new ATOM 0 HA GLU A 47 -9.480 2.297 17.368 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -11.791 2.525 16.721 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -11.345 3.882 17.736 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -11.112 5.321 15.751 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -11.486 3.967 14.704 1.00 0.00 H new ATOM 722 N GLU A 48 -10.014 1.300 14.974 1.00 0.00 N ATOM 723 CA GLU A 48 -9.769 0.591 13.726 1.00 0.00 C ATOM 724 C GLU A 48 -10.581 1.195 12.577 1.00 0.00 C ATOM 725 O GLU A 48 -10.213 1.061 11.411 1.00 0.00 O ATOM 726 CB GLU A 48 -10.112 -0.890 13.901 1.00 0.00 C ATOM 727 CG GLU A 48 -9.602 -1.776 12.780 1.00 0.00 C ATOM 728 CD GLU A 48 -10.066 -3.208 12.925 1.00 0.00 C ATOM 729 OE1 GLU A 48 -11.195 -3.513 12.485 1.00 0.00 O ATOM 730 OE2 GLU A 48 -9.311 -4.038 13.472 1.00 0.00 O ATOM 0 H GLU A 48 -10.650 0.822 15.612 1.00 0.00 H new ATOM 0 HA GLU A 48 -8.713 0.690 13.473 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -9.696 -1.240 14.846 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -11.195 -0.996 13.971 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -9.943 -1.381 11.823 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -8.512 -1.749 12.765 1.00 0.00 H new ATOM 737 N ASN A 49 -11.677 1.872 12.912 1.00 0.00 N ATOM 738 CA ASN A 49 -12.538 2.474 11.893 1.00 0.00 C ATOM 739 C ASN A 49 -12.040 3.850 11.466 1.00 0.00 C ATOM 740 O ASN A 49 -12.633 4.483 10.590 1.00 0.00 O ATOM 741 CB ASN A 49 -13.989 2.571 12.374 1.00 0.00 C ATOM 742 CG ASN A 49 -14.708 1.239 12.305 1.00 0.00 C ATOM 743 OD1 ASN A 49 -14.727 0.478 13.272 1.00 0.00 O ATOM 744 ND2 ASN A 49 -15.298 0.945 11.156 1.00 0.00 N ATOM 0 H ASN A 49 -11.989 2.018 13.872 1.00 0.00 H new ATOM 0 HA ASN A 49 -12.500 1.815 11.026 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -14.005 2.937 13.400 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -14.523 3.301 11.766 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -15.792 0.059 11.048 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -15.258 1.604 10.379 1.00 0.00 H new ATOM 751 N GLU A 50 -10.953 4.308 12.077 1.00 0.00 N ATOM 752 CA GLU A 50 -10.332 5.563 11.674 1.00 0.00 C ATOM 753 C GLU A 50 -9.877 5.444 10.221 1.00 0.00 C ATOM 754 O GLU A 50 -9.489 4.364 9.777 1.00 0.00 O ATOM 755 CB GLU A 50 -9.138 5.888 12.580 1.00 0.00 C ATOM 756 CG GLU A 50 -8.591 7.299 12.400 1.00 0.00 C ATOM 757 CD GLU A 50 -9.493 8.366 12.993 1.00 0.00 C ATOM 758 OE1 GLU A 50 -10.666 8.473 12.572 1.00 0.00 O ATOM 759 OE2 GLU A 50 -9.024 9.112 13.880 1.00 0.00 O ATOM 0 H GLU A 50 -10.486 3.832 12.849 1.00 0.00 H new ATOM 0 HA GLU A 50 -11.056 6.373 11.768 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -9.437 5.755 13.620 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -8.340 5.172 12.383 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -7.607 7.363 12.865 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -8.454 7.497 11.337 1.00 0.00 H new ATOM 766 N SER A 51 -9.952 6.528 9.471 1.00 0.00 N ATOM 767 CA SER A 51 -9.590 6.496 8.064 1.00 0.00 C ATOM 768 C SER A 51 -8.586 7.595 7.732 1.00 0.00 C ATOM 769 O SER A 51 -8.578 8.650 8.362 1.00 0.00 O ATOM 770 CB SER A 51 -10.852 6.646 7.216 1.00 0.00 C ATOM 771 OG SER A 51 -11.837 5.708 7.624 1.00 0.00 O ATOM 0 H SER A 51 -10.259 7.440 9.810 1.00 0.00 H new ATOM 0 HA SER A 51 -9.116 5.540 7.842 1.00 0.00 H new ATOM 0 HB2 SER A 51 -11.244 7.659 7.311 1.00 0.00 H new ATOM 0 HB3 SER A 51 -10.611 6.495 6.164 1.00 0.00 H new ATOM 0 HG SER A 51 -12.640 5.817 7.073 1.00 0.00 H new ATOM 777 N LEU A 52 -7.746 7.343 6.736 1.00 0.00 N ATOM 778 CA LEU A 52 -6.706 8.289 6.340 1.00 0.00 C ATOM 779 C LEU A 52 -7.295 9.378 5.453 1.00 0.00 C ATOM 780 O LEU A 52 -6.696 10.432 5.250 1.00 0.00 O ATOM 781 CB LEU A 52 -5.588 7.552 5.596 1.00 0.00 C ATOM 782 CG LEU A 52 -4.946 6.394 6.369 1.00 0.00 C ATOM 783 CD1 LEU A 52 -3.973 5.630 5.486 1.00 0.00 C ATOM 784 CD2 LEU A 52 -4.242 6.909 7.613 1.00 0.00 C ATOM 0 H LEU A 52 -7.764 6.486 6.183 1.00 0.00 H new ATOM 0 HA LEU A 52 -6.292 8.754 7.235 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -5.990 7.165 4.660 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -4.810 8.270 5.336 1.00 0.00 H new ATOM 0 HG LEU A 52 -5.737 5.710 6.677 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -3.529 4.813 6.055 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -4.504 5.225 4.624 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -3.187 6.303 5.144 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -3.792 6.073 8.149 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -3.464 7.616 7.324 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -4.964 7.408 8.259 1.00 0.00 H new ATOM 796 N ASP A 53 -8.482 9.102 4.933 1.00 0.00 N ATOM 797 CA ASP A 53 -9.186 10.038 4.065 1.00 0.00 C ATOM 798 C ASP A 53 -10.049 10.993 4.890 1.00 0.00 C ATOM 799 O ASP A 53 -10.645 11.929 4.359 1.00 0.00 O ATOM 800 CB ASP A 53 -10.047 9.260 3.063 1.00 0.00 C ATOM 801 CG ASP A 53 -10.792 10.160 2.098 1.00 0.00 C ATOM 802 OD1 ASP A 53 -12.035 10.051 2.018 1.00 0.00 O ATOM 803 OD2 ASP A 53 -10.145 10.985 1.419 1.00 0.00 O ATOM 0 H ASP A 53 -8.983 8.229 5.099 1.00 0.00 H new ATOM 0 HA ASP A 53 -8.456 10.634 3.518 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -9.411 8.579 2.498 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -10.765 8.648 3.608 1.00 0.00 H new ATOM 808 N ASP A 54 -10.086 10.763 6.198 1.00 0.00 N ATOM 809 CA ASP A 54 -10.885 11.585 7.107 1.00 0.00 C ATOM 810 C ASP A 54 -10.291 12.991 7.209 1.00 0.00 C ATOM 811 O ASP A 54 -9.151 13.225 6.801 1.00 0.00 O ATOM 812 CB ASP A 54 -10.943 10.935 8.499 1.00 0.00 C ATOM 813 CG ASP A 54 -12.016 11.527 9.401 1.00 0.00 C ATOM 814 OD1 ASP A 54 -13.059 10.870 9.599 1.00 0.00 O ATOM 815 OD2 ASP A 54 -11.826 12.646 9.919 1.00 0.00 O ATOM 0 H ASP A 54 -9.571 10.012 6.656 1.00 0.00 H new ATOM 0 HA ASP A 54 -11.898 11.659 6.711 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -11.124 9.866 8.385 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -9.972 11.044 8.983 1.00 0.00 H new ATOM 820 N GLN A 55 -11.068 13.928 7.729 1.00 0.00 N ATOM 821 CA GLN A 55 -10.603 15.294 7.929 1.00 0.00 C ATOM 822 C GLN A 55 -9.647 15.355 9.122 1.00 0.00 C ATOM 823 O GLN A 55 -8.826 16.263 9.231 1.00 0.00 O ATOM 824 CB GLN A 55 -11.806 16.228 8.122 1.00 0.00 C ATOM 825 CG GLN A 55 -11.460 17.708 8.249 1.00 0.00 C ATOM 826 CD GLN A 55 -11.588 18.225 9.672 1.00 0.00 C ATOM 827 OE1 GLN A 55 -12.658 18.666 10.088 1.00 0.00 O ATOM 828 NE2 GLN A 55 -10.498 18.196 10.420 1.00 0.00 N ATOM 0 H GLN A 55 -12.031 13.767 8.023 1.00 0.00 H new ATOM 0 HA GLN A 55 -10.055 15.626 7.048 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -12.485 16.100 7.279 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -12.347 15.919 9.016 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -10.440 17.869 7.900 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -12.115 18.286 7.597 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -9.628 17.822 10.040 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -10.527 18.547 11.377 1.00 0.00 H new ATOM 837 N ASN A 56 -9.740 14.373 10.006 1.00 0.00 N ATOM 838 CA ASN A 56 -8.832 14.298 11.141 1.00 0.00 C ATOM 839 C ASN A 56 -8.359 12.864 11.341 1.00 0.00 C ATOM 840 O ASN A 56 -9.085 11.916 11.058 1.00 0.00 O ATOM 841 CB ASN A 56 -9.477 14.864 12.428 1.00 0.00 C ATOM 842 CG ASN A 56 -10.405 13.909 13.183 1.00 0.00 C ATOM 843 OD1 ASN A 56 -10.503 13.978 14.410 1.00 0.00 O ATOM 844 ND2 ASN A 56 -11.113 13.040 12.481 1.00 0.00 N ATOM 0 H ASN A 56 -10.429 13.622 9.961 1.00 0.00 H new ATOM 0 HA ASN A 56 -7.964 14.921 10.923 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -8.681 15.177 13.104 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -10.042 15.758 12.166 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -11.758 12.407 12.954 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -11.014 13.003 11.467 1.00 0.00 H new ATOM 851 N ILE A 57 -7.121 12.713 11.774 1.00 0.00 N ATOM 852 CA ILE A 57 -6.567 11.396 12.042 1.00 0.00 C ATOM 853 C ILE A 57 -6.015 11.346 13.463 1.00 0.00 C ATOM 854 O ILE A 57 -5.066 12.065 13.799 1.00 0.00 O ATOM 855 CB ILE A 57 -5.459 11.006 11.027 1.00 0.00 C ATOM 856 CG1 ILE A 57 -6.042 10.775 9.631 1.00 0.00 C ATOM 857 CG2 ILE A 57 -4.713 9.767 11.473 1.00 0.00 C ATOM 858 CD1 ILE A 57 -6.086 12.015 8.777 1.00 0.00 C ATOM 0 H ILE A 57 -6.478 13.486 11.948 1.00 0.00 H new ATOM 0 HA ILE A 57 -7.375 10.672 11.933 1.00 0.00 H new ATOM 0 HB ILE A 57 -4.760 11.841 10.985 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -5.450 10.015 9.121 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -7.052 10.378 9.731 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -3.944 9.521 10.740 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -4.246 9.952 12.440 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -5.411 8.934 11.560 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -6.511 11.771 7.803 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -6.703 12.770 9.264 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -5.076 12.402 8.645 1.00 0.00 H new ATOM 870 N SER A 58 -6.628 10.517 14.293 1.00 0.00 N ATOM 871 CA SER A 58 -6.239 10.407 15.688 1.00 0.00 C ATOM 872 C SER A 58 -5.146 9.354 15.860 1.00 0.00 C ATOM 873 O SER A 58 -5.404 8.153 15.753 1.00 0.00 O ATOM 874 CB SER A 58 -7.457 10.033 16.532 1.00 0.00 C ATOM 875 OG SER A 58 -8.627 10.663 16.039 1.00 0.00 O ATOM 0 H SER A 58 -7.400 9.908 14.022 1.00 0.00 H new ATOM 0 HA SER A 58 -5.848 11.369 16.019 1.00 0.00 H new ATOM 0 HB2 SER A 58 -7.591 8.951 16.525 1.00 0.00 H new ATOM 0 HB3 SER A 58 -7.290 10.327 17.568 1.00 0.00 H new ATOM 0 HG SER A 58 -9.039 10.097 15.353 1.00 0.00 H new ATOM 881 N ILE A 59 -3.925 9.807 16.114 1.00 0.00 N ATOM 882 CA ILE A 59 -2.815 8.899 16.350 1.00 0.00 C ATOM 883 C ILE A 59 -2.486 8.880 17.840 1.00 0.00 C ATOM 884 O ILE A 59 -2.212 9.921 18.437 1.00 0.00 O ATOM 885 CB ILE A 59 -1.557 9.296 15.540 1.00 0.00 C ATOM 886 CG1 ILE A 59 -1.886 9.396 14.045 1.00 0.00 C ATOM 887 CG2 ILE A 59 -0.446 8.280 15.764 1.00 0.00 C ATOM 888 CD1 ILE A 59 -0.696 9.778 13.185 1.00 0.00 C ATOM 0 H ILE A 59 -3.681 10.796 16.161 1.00 0.00 H new ATOM 0 HA ILE A 59 -3.117 7.906 16.018 1.00 0.00 H new ATOM 0 HB ILE A 59 -1.219 10.273 15.886 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -2.278 8.438 13.703 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -2.677 10.133 13.904 1.00 0.00 H new ATOM 0 HG21 ILE A 59 0.434 8.570 15.189 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -0.192 8.246 16.823 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -0.783 7.295 15.440 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -1.004 9.830 12.141 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -0.317 10.750 13.500 1.00 0.00 H new ATOM 0 HD13 ILE A 59 0.088 9.029 13.296 1.00 0.00 H new ATOM 900 N ALA A 60 -2.529 7.698 18.433 1.00 0.00 N ATOM 901 CA ALA A 60 -2.338 7.556 19.868 1.00 0.00 C ATOM 902 C ALA A 60 -0.897 7.187 20.198 1.00 0.00 C ATOM 903 O ALA A 60 -0.357 6.219 19.662 1.00 0.00 O ATOM 904 CB ALA A 60 -3.295 6.513 20.425 1.00 0.00 C ATOM 0 H ALA A 60 -2.695 6.820 17.941 1.00 0.00 H new ATOM 0 HA ALA A 60 -2.553 8.517 20.335 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -3.142 6.416 21.500 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -4.322 6.821 20.231 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -3.107 5.553 19.944 1.00 0.00 H new ATOM 910 N GLY A 61 -0.286 7.965 21.079 1.00 0.00 N ATOM 911 CA GLY A 61 1.081 7.707 21.486 1.00 0.00 C ATOM 912 C GLY A 61 1.152 6.966 22.808 1.00 0.00 C ATOM 913 O GLY A 61 0.204 6.993 23.594 1.00 0.00 O ATOM 0 H GLY A 61 -0.716 8.777 21.523 1.00 0.00 H new ATOM 0 HA2 GLY A 61 1.584 7.122 20.716 1.00 0.00 H new ATOM 0 HA3 GLY A 61 1.618 8.652 21.571 1.00 0.00 H new ATOM 917 N HIS A 62 2.276 6.313 23.060 1.00 0.00 N ATOM 918 CA HIS A 62 2.452 5.530 24.274 1.00 0.00 C ATOM 919 C HIS A 62 3.918 5.532 24.690 1.00 0.00 C ATOM 920 O HIS A 62 4.708 4.725 24.207 1.00 0.00 O ATOM 921 CB HIS A 62 1.957 4.094 24.055 1.00 0.00 C ATOM 922 CG HIS A 62 2.064 3.215 25.264 1.00 0.00 C ATOM 923 ND1 HIS A 62 2.682 1.986 25.248 1.00 0.00 N ATOM 924 CD2 HIS A 62 1.605 3.386 26.526 1.00 0.00 C ATOM 925 CE1 HIS A 62 2.598 1.436 26.445 1.00 0.00 C ATOM 926 NE2 HIS A 62 1.948 2.267 27.242 1.00 0.00 N ATOM 0 H HIS A 62 3.084 6.310 22.437 1.00 0.00 H new ATOM 0 HA HIS A 62 1.863 5.980 25.073 1.00 0.00 H new ATOM 0 HB2 HIS A 62 0.916 4.126 23.734 1.00 0.00 H new ATOM 0 HB3 HIS A 62 2.528 3.645 23.242 1.00 0.00 H new ATOM 0 HD1 HIS A 62 3.135 1.565 24.437 1.00 0.00 H new ATOM 0 HD2 HIS A 62 1.068 4.245 26.900 1.00 0.00 H new ATOM 0 HE1 HIS A 62 2.993 0.471 26.726 1.00 0.00 H new ATOM 934 N THR A 63 4.269 6.461 25.569 1.00 0.00 N ATOM 935 CA THR A 63 5.648 6.639 25.998 1.00 0.00 C ATOM 936 C THR A 63 6.186 5.390 26.705 1.00 0.00 C ATOM 937 O THR A 63 5.435 4.649 27.346 1.00 0.00 O ATOM 938 CB THR A 63 5.757 7.862 26.931 1.00 0.00 C ATOM 939 OG1 THR A 63 4.908 8.913 26.443 1.00 0.00 O ATOM 940 CG2 THR A 63 7.192 8.368 26.998 1.00 0.00 C ATOM 0 H THR A 63 3.610 7.108 26.002 1.00 0.00 H new ATOM 0 HA THR A 63 6.255 6.805 25.108 1.00 0.00 H new ATOM 0 HB THR A 63 5.446 7.561 27.931 1.00 0.00 H new ATOM 0 HG1 THR A 63 4.975 9.690 27.036 1.00 0.00 H new ATOM 0 HG21 THR A 63 7.243 9.231 27.662 1.00 0.00 H new ATOM 0 HG22 THR A 63 7.839 7.578 27.379 1.00 0.00 H new ATOM 0 HG23 THR A 63 7.523 8.658 26.001 1.00 0.00 H new ATOM 948 N PHE A 64 7.485 5.154 26.564 1.00 0.00 N ATOM 949 CA PHE A 64 8.130 4.006 27.185 1.00 0.00 C ATOM 950 C PHE A 64 9.193 4.458 28.175 1.00 0.00 C ATOM 951 O PHE A 64 9.511 5.644 28.260 1.00 0.00 O ATOM 952 CB PHE A 64 8.757 3.095 26.127 1.00 0.00 C ATOM 953 CG PHE A 64 7.749 2.396 25.264 1.00 0.00 C ATOM 954 CD1 PHE A 64 7.461 2.865 23.994 1.00 0.00 C ATOM 955 CD2 PHE A 64 7.089 1.270 25.727 1.00 0.00 C ATOM 956 CE1 PHE A 64 6.535 2.221 23.199 1.00 0.00 C ATOM 957 CE2 PHE A 64 6.161 0.622 24.937 1.00 0.00 C ATOM 958 CZ PHE A 64 5.883 1.100 23.672 1.00 0.00 C ATOM 0 H PHE A 64 8.114 5.746 26.022 1.00 0.00 H new ATOM 0 HA PHE A 64 7.366 3.443 27.721 1.00 0.00 H new ATOM 0 HB2 PHE A 64 9.417 3.688 25.493 1.00 0.00 H new ATOM 0 HB3 PHE A 64 9.378 2.349 26.623 1.00 0.00 H new ATOM 0 HD1 PHE A 64 7.966 3.744 23.621 1.00 0.00 H new ATOM 0 HD2 PHE A 64 7.303 0.895 26.717 1.00 0.00 H new ATOM 0 HE1 PHE A 64 6.321 2.593 22.208 1.00 0.00 H new ATOM 0 HE2 PHE A 64 5.654 -0.257 25.307 1.00 0.00 H new ATOM 0 HZ PHE A 64 5.155 0.597 23.052 1.00 0.00 H new ATOM 968 N ILE A 65 9.737 3.505 28.920 1.00 0.00 N ATOM 969 CA ILE A 65 10.743 3.793 29.933 1.00 0.00 C ATOM 970 C ILE A 65 12.131 3.374 29.455 1.00 0.00 C ATOM 971 O ILE A 65 13.109 4.098 29.635 1.00 0.00 O ATOM 972 CB ILE A 65 10.420 3.062 31.256 1.00 0.00 C ATOM 973 CG1 ILE A 65 9.013 3.433 31.735 1.00 0.00 C ATOM 974 CG2 ILE A 65 11.455 3.402 32.321 1.00 0.00 C ATOM 975 CD1 ILE A 65 8.574 2.684 32.976 1.00 0.00 C ATOM 0 H ILE A 65 9.495 2.517 28.840 1.00 0.00 H new ATOM 0 HA ILE A 65 10.732 4.869 30.107 1.00 0.00 H new ATOM 0 HB ILE A 65 10.455 1.987 31.078 1.00 0.00 H new ATOM 0 HG12 ILE A 65 8.978 4.504 31.936 1.00 0.00 H new ATOM 0 HG13 ILE A 65 8.302 3.236 30.932 1.00 0.00 H new ATOM 0 HG21 ILE A 65 11.211 2.878 33.245 1.00 0.00 H new ATOM 0 HG22 ILE A 65 12.443 3.094 31.979 1.00 0.00 H new ATOM 0 HG23 ILE A 65 11.452 4.477 32.501 1.00 0.00 H new ATOM 0 HD11 ILE A 65 7.569 2.999 33.255 1.00 0.00 H new ATOM 0 HD12 ILE A 65 8.575 1.613 32.774 1.00 0.00 H new ATOM 0 HD13 ILE A 65 9.262 2.900 33.794 1.00 0.00 H new ATOM 987 N ASP A 66 12.204 2.209 28.825 1.00 0.00 N ATOM 988 CA ASP A 66 13.483 1.631 28.414 1.00 0.00 C ATOM 989 C ASP A 66 13.915 2.135 27.041 1.00 0.00 C ATOM 990 O ASP A 66 15.015 1.834 26.581 1.00 0.00 O ATOM 991 CB ASP A 66 13.391 0.102 28.390 1.00 0.00 C ATOM 992 CG ASP A 66 12.417 -0.408 27.345 1.00 0.00 C ATOM 993 OD1 ASP A 66 12.866 -0.878 26.280 1.00 0.00 O ATOM 994 OD2 ASP A 66 11.194 -0.338 27.583 1.00 0.00 O ATOM 0 H ASP A 66 11.391 1.642 28.585 1.00 0.00 H new ATOM 0 HA ASP A 66 14.231 1.944 29.143 1.00 0.00 H new ATOM 0 HB2 ASP A 66 14.379 -0.315 28.194 1.00 0.00 H new ATOM 0 HB3 ASP A 66 13.083 -0.255 29.373 1.00 0.00 H new ATOM 999 N ARG A 67 13.060 2.910 26.392 1.00 0.00 N ATOM 1000 CA ARG A 67 13.344 3.382 25.041 1.00 0.00 C ATOM 1001 C ARG A 67 13.436 4.901 25.009 1.00 0.00 C ATOM 1002 O ARG A 67 12.435 5.592 25.201 1.00 0.00 O ATOM 1003 CB ARG A 67 12.262 2.902 24.073 1.00 0.00 C ATOM 1004 CG ARG A 67 12.030 1.406 24.134 1.00 0.00 C ATOM 1005 CD ARG A 67 10.910 0.965 23.213 1.00 0.00 C ATOM 1006 NE ARG A 67 10.473 -0.391 23.526 1.00 0.00 N ATOM 1007 CZ ARG A 67 9.352 -0.942 23.073 1.00 0.00 C ATOM 1008 NH1 ARG A 67 8.602 -0.302 22.188 1.00 0.00 N ATOM 1009 NH2 ARG A 67 9.000 -2.150 23.490 1.00 0.00 N ATOM 0 H ARG A 67 12.168 3.225 26.774 1.00 0.00 H new ATOM 0 HA ARG A 67 14.305 2.971 24.731 1.00 0.00 H new ATOM 0 HB2 ARG A 67 11.328 3.418 24.297 1.00 0.00 H new ATOM 0 HB3 ARG A 67 12.543 3.179 23.057 1.00 0.00 H new ATOM 0 HG2 ARG A 67 12.948 0.886 23.862 1.00 0.00 H new ATOM 0 HG3 ARG A 67 11.792 1.118 25.158 1.00 0.00 H new ATOM 0 HD2 ARG A 67 10.068 1.652 23.305 1.00 0.00 H new ATOM 0 HD3 ARG A 67 11.247 1.011 22.178 1.00 0.00 H new ATOM 0 HE ARG A 67 11.068 -0.954 24.134 1.00 0.00 H new ATOM 0 HH11 ARG A 67 8.884 0.618 21.851 1.00 0.00 H new ATOM 0 HH12 ARG A 67 7.742 -0.730 21.844 1.00 0.00 H new ATOM 0 HH21 ARG A 67 9.589 -2.652 24.155 1.00 0.00 H new ATOM 0 HH22 ARG A 67 8.141 -2.578 23.146 1.00 0.00 H new ATOM 1023 N PRO A 68 14.646 5.438 24.781 1.00 0.00 N ATOM 1024 CA PRO A 68 14.868 6.883 24.685 1.00 0.00 C ATOM 1025 C PRO A 68 14.385 7.456 23.360 1.00 0.00 C ATOM 1026 O PRO A 68 14.329 8.676 23.182 1.00 0.00 O ATOM 1027 CB PRO A 68 16.386 7.016 24.780 1.00 0.00 C ATOM 1028 CG PRO A 68 16.909 5.731 24.240 1.00 0.00 C ATOM 1029 CD PRO A 68 15.901 4.676 24.622 1.00 0.00 C ATOM 0 HA PRO A 68 14.322 7.426 25.457 1.00 0.00 H new ATOM 0 HB2 PRO A 68 16.747 7.866 24.201 1.00 0.00 H new ATOM 0 HB3 PRO A 68 16.707 7.173 25.810 1.00 0.00 H new ATOM 0 HG2 PRO A 68 17.028 5.783 23.158 1.00 0.00 H new ATOM 0 HG3 PRO A 68 17.889 5.503 24.658 1.00 0.00 H new ATOM 0 HD2 PRO A 68 15.810 3.910 23.852 1.00 0.00 H new ATOM 0 HD3 PRO A 68 16.182 4.168 25.545 1.00 0.00 H new ATOM 1037 N ASN A 69 14.040 6.577 22.429 1.00 0.00 N ATOM 1038 CA ASN A 69 13.673 7.005 21.094 1.00 0.00 C ATOM 1039 C ASN A 69 12.778 5.973 20.417 1.00 0.00 C ATOM 1040 O ASN A 69 13.250 5.081 19.712 1.00 0.00 O ATOM 1041 CB ASN A 69 14.935 7.249 20.263 1.00 0.00 C ATOM 1042 CG ASN A 69 14.719 8.221 19.121 1.00 0.00 C ATOM 1043 OD1 ASN A 69 13.639 8.299 18.536 1.00 0.00 O ATOM 1044 ND2 ASN A 69 15.753 8.989 18.815 1.00 0.00 N ATOM 0 H ASN A 69 14.008 5.568 22.576 1.00 0.00 H new ATOM 0 HA ASN A 69 13.111 7.936 21.169 1.00 0.00 H new ATOM 0 HB2 ASN A 69 15.722 7.631 20.913 1.00 0.00 H new ATOM 0 HB3 ASN A 69 15.287 6.299 19.861 1.00 0.00 H new ATOM 0 HD21 ASN A 69 15.672 9.679 18.068 1.00 0.00 H new ATOM 0 HD22 ASN A 69 16.630 8.891 19.326 1.00 0.00 H new ATOM 1051 N TYR A 70 11.488 6.067 20.697 1.00 0.00 N ATOM 1052 CA TYR A 70 10.484 5.303 19.971 1.00 0.00 C ATOM 1053 C TYR A 70 9.703 6.278 19.083 1.00 0.00 C ATOM 1054 O TYR A 70 10.113 7.431 18.945 1.00 0.00 O ATOM 1055 CB TYR A 70 9.549 4.543 20.941 1.00 0.00 C ATOM 1056 CG TYR A 70 8.423 5.374 21.525 1.00 0.00 C ATOM 1057 CD1 TYR A 70 7.128 5.260 21.031 1.00 0.00 C ATOM 1058 CD2 TYR A 70 8.655 6.283 22.543 1.00 0.00 C ATOM 1059 CE1 TYR A 70 6.103 6.032 21.532 1.00 0.00 C ATOM 1060 CE2 TYR A 70 7.634 7.057 23.055 1.00 0.00 C ATOM 1061 CZ TYR A 70 6.360 6.930 22.541 1.00 0.00 C ATOM 1062 OH TYR A 70 5.342 7.713 23.028 1.00 0.00 O ATOM 0 H TYR A 70 11.109 6.669 21.427 1.00 0.00 H new ATOM 0 HA TYR A 70 10.964 4.545 19.352 1.00 0.00 H new ATOM 0 HB2 TYR A 70 9.117 3.692 20.414 1.00 0.00 H new ATOM 0 HB3 TYR A 70 10.147 4.142 21.759 1.00 0.00 H new ATOM 0 HD1 TYR A 70 6.922 4.554 20.240 1.00 0.00 H new ATOM 0 HD2 TYR A 70 9.653 6.388 22.943 1.00 0.00 H new ATOM 0 HE1 TYR A 70 5.104 5.933 21.135 1.00 0.00 H new ATOM 0 HE2 TYR A 70 7.831 7.758 23.853 1.00 0.00 H new ATOM 0 HH TYR A 70 5.527 8.654 22.825 1.00 0.00 H new ATOM 1072 N GLN A 71 8.593 5.817 18.510 1.00 0.00 N ATOM 1073 CA GLN A 71 7.756 6.626 17.609 1.00 0.00 C ATOM 1074 C GLN A 71 7.637 8.089 18.053 1.00 0.00 C ATOM 1075 O GLN A 71 8.171 8.984 17.406 1.00 0.00 O ATOM 1076 CB GLN A 71 6.354 6.026 17.517 1.00 0.00 C ATOM 1077 CG GLN A 71 6.335 4.542 17.195 1.00 0.00 C ATOM 1078 CD GLN A 71 7.033 4.208 15.895 1.00 0.00 C ATOM 1079 OE1 GLN A 71 6.298 4.252 14.795 1.00 0.00 O flip ATOM 1080 NE2 GLN A 71 8.225 3.919 15.879 1.00 0.00 N flip ATOM 0 H GLN A 71 8.243 4.870 18.654 1.00 0.00 H new ATOM 0 HA GLN A 71 8.249 6.612 16.637 1.00 0.00 H new ATOM 0 HB2 GLN A 71 5.838 6.188 18.463 1.00 0.00 H new ATOM 0 HB3 GLN A 71 5.791 6.560 16.752 1.00 0.00 H new ATOM 0 HG2 GLN A 71 6.812 3.994 18.008 1.00 0.00 H new ATOM 0 HG3 GLN A 71 5.301 4.201 17.144 1.00 0.00 H new ATOM 0 HE21 GLN A 71 8.756 3.896 16.750 1.00 0.00 H new ATOM 0 HE22 GLN A 71 8.685 3.701 14.995 1.00 0.00 H new ATOM 1089 N PHE A 72 6.933 8.333 19.153 1.00 0.00 N ATOM 1090 CA PHE A 72 6.707 9.700 19.617 1.00 0.00 C ATOM 1091 C PHE A 72 7.392 9.960 20.954 1.00 0.00 C ATOM 1092 O PHE A 72 6.751 9.935 22.001 1.00 0.00 O ATOM 1093 CB PHE A 72 5.207 9.998 19.743 1.00 0.00 C ATOM 1094 CG PHE A 72 4.471 10.050 18.433 1.00 0.00 C ATOM 1095 CD1 PHE A 72 3.122 9.743 18.370 1.00 0.00 C ATOM 1096 CD2 PHE A 72 5.126 10.407 17.266 1.00 0.00 C ATOM 1097 CE1 PHE A 72 2.442 9.794 17.168 1.00 0.00 C ATOM 1098 CE2 PHE A 72 4.453 10.457 16.062 1.00 0.00 C ATOM 1099 CZ PHE A 72 3.108 10.150 16.013 1.00 0.00 C ATOM 0 H PHE A 72 6.512 7.610 19.737 1.00 0.00 H new ATOM 0 HA PHE A 72 7.142 10.364 18.870 1.00 0.00 H new ATOM 0 HB2 PHE A 72 4.749 9.235 20.373 1.00 0.00 H new ATOM 0 HB3 PHE A 72 5.080 10.952 20.255 1.00 0.00 H new ATOM 0 HD1 PHE A 72 2.596 9.461 19.270 1.00 0.00 H new ATOM 0 HD2 PHE A 72 6.178 10.650 17.299 1.00 0.00 H new ATOM 0 HE1 PHE A 72 1.389 9.555 17.133 1.00 0.00 H new ATOM 0 HE2 PHE A 72 4.978 10.736 15.160 1.00 0.00 H new ATOM 0 HZ PHE A 72 2.578 10.188 15.073 1.00 0.00 H new ATOM 1109 N THR A 73 8.694 10.193 20.918 1.00 0.00 N ATOM 1110 CA THR A 73 9.441 10.495 22.135 1.00 0.00 C ATOM 1111 C THR A 73 9.970 11.923 22.096 1.00 0.00 C ATOM 1112 O THR A 73 9.766 12.711 23.019 1.00 0.00 O ATOM 1113 CB THR A 73 10.643 9.552 22.303 1.00 0.00 C ATOM 1114 OG1 THR A 73 10.384 8.310 21.648 1.00 0.00 O ATOM 1115 CG2 THR A 73 10.935 9.303 23.777 1.00 0.00 C ATOM 0 H THR A 73 9.255 10.180 20.067 1.00 0.00 H new ATOM 0 HA THR A 73 8.753 10.365 22.970 1.00 0.00 H new ATOM 0 HB THR A 73 11.515 10.026 21.852 1.00 0.00 H new ATOM 0 HG1 THR A 73 9.580 7.900 22.030 1.00 0.00 H new ATOM 0 HG21 THR A 73 11.790 8.633 23.870 1.00 0.00 H new ATOM 0 HG22 THR A 73 11.161 10.250 24.268 1.00 0.00 H new ATOM 0 HG23 THR A 73 10.064 8.848 24.249 1.00 0.00 H new ATOM 1123 N ASN A 74 10.631 12.250 20.998 1.00 0.00 N ATOM 1124 CA ASN A 74 11.333 13.520 20.863 1.00 0.00 C ATOM 1125 C ASN A 74 10.397 14.617 20.343 1.00 0.00 C ATOM 1126 O ASN A 74 10.827 15.565 19.693 1.00 0.00 O ATOM 1127 CB ASN A 74 12.533 13.333 19.922 1.00 0.00 C ATOM 1128 CG ASN A 74 13.471 14.528 19.899 1.00 0.00 C ATOM 1129 OD1 ASN A 74 13.575 15.270 20.872 1.00 0.00 O ATOM 1130 ND2 ASN A 74 14.166 14.712 18.788 1.00 0.00 N ATOM 0 H ASN A 74 10.697 11.647 20.178 1.00 0.00 H new ATOM 0 HA ASN A 74 11.688 13.837 21.844 1.00 0.00 H new ATOM 0 HB2 ASN A 74 13.091 12.448 20.228 1.00 0.00 H new ATOM 0 HB3 ASN A 74 12.168 13.147 18.912 1.00 0.00 H new ATOM 0 HD21 ASN A 74 14.818 15.494 18.718 1.00 0.00 H new ATOM 0 HD22 ASN A 74 14.050 14.072 18.002 1.00 0.00 H new ATOM 1137 N LEU A 75 9.115 14.511 20.679 1.00 0.00 N ATOM 1138 CA LEU A 75 8.131 15.505 20.251 1.00 0.00 C ATOM 1139 C LEU A 75 8.342 16.838 20.962 1.00 0.00 C ATOM 1140 O LEU A 75 7.733 17.841 20.612 1.00 0.00 O ATOM 1141 CB LEU A 75 6.705 15.009 20.496 1.00 0.00 C ATOM 1142 CG LEU A 75 6.199 13.963 19.503 1.00 0.00 C ATOM 1143 CD1 LEU A 75 4.775 13.559 19.841 1.00 0.00 C ATOM 1144 CD2 LEU A 75 6.270 14.502 18.083 1.00 0.00 C ATOM 0 H LEU A 75 8.733 13.752 21.243 1.00 0.00 H new ATOM 0 HA LEU A 75 8.272 15.656 19.181 1.00 0.00 H new ATOM 0 HB2 LEU A 75 6.651 14.589 21.500 1.00 0.00 H new ATOM 0 HB3 LEU A 75 6.031 15.865 20.472 1.00 0.00 H new ATOM 0 HG LEU A 75 6.837 13.082 19.573 1.00 0.00 H new ATOM 0 HD11 LEU A 75 4.429 12.814 19.125 1.00 0.00 H new ATOM 0 HD12 LEU A 75 4.745 13.138 20.846 1.00 0.00 H new ATOM 0 HD13 LEU A 75 4.128 14.435 19.795 1.00 0.00 H new ATOM 0 HD21 LEU A 75 5.906 13.745 17.388 1.00 0.00 H new ATOM 0 HD22 LEU A 75 5.652 15.396 18.002 1.00 0.00 H new ATOM 0 HD23 LEU A 75 7.303 14.752 17.840 1.00 0.00 H new ATOM 1156 N LYS A 76 9.210 16.846 21.962 1.00 0.00 N ATOM 1157 CA LYS A 76 9.528 18.079 22.672 1.00 0.00 C ATOM 1158 C LYS A 76 10.500 18.937 21.869 1.00 0.00 C ATOM 1159 O LYS A 76 10.760 20.090 22.211 1.00 0.00 O ATOM 1160 CB LYS A 76 10.070 17.784 24.083 1.00 0.00 C ATOM 1161 CG LYS A 76 11.108 16.664 24.168 1.00 0.00 C ATOM 1162 CD LYS A 76 12.470 17.078 23.630 1.00 0.00 C ATOM 1163 CE LYS A 76 13.500 15.978 23.846 1.00 0.00 C ATOM 1164 NZ LYS A 76 14.801 16.287 23.192 1.00 0.00 N ATOM 0 H LYS A 76 9.704 16.020 22.300 1.00 0.00 H new ATOM 0 HA LYS A 76 8.605 18.647 22.788 1.00 0.00 H new ATOM 0 HB2 LYS A 76 10.512 18.697 24.482 1.00 0.00 H new ATOM 0 HB3 LYS A 76 9.231 17.528 24.730 1.00 0.00 H new ATOM 0 HG2 LYS A 76 11.213 16.351 25.207 1.00 0.00 H new ATOM 0 HG3 LYS A 76 10.749 15.800 23.609 1.00 0.00 H new ATOM 0 HD2 LYS A 76 12.391 17.304 22.567 1.00 0.00 H new ATOM 0 HD3 LYS A 76 12.799 17.991 24.126 1.00 0.00 H new ATOM 0 HE2 LYS A 76 13.658 15.836 24.915 1.00 0.00 H new ATOM 0 HE3 LYS A 76 13.112 15.038 23.453 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 15.560 15.752 23.660 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 14.757 16.020 22.188 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 14.996 17.306 23.271 1.00 0.00 H new ATOM 1178 N ALA A 77 11.035 18.361 20.803 1.00 0.00 N ATOM 1179 CA ALA A 77 11.861 19.107 19.869 1.00 0.00 C ATOM 1180 C ALA A 77 11.012 19.621 18.715 1.00 0.00 C ATOM 1181 O ALA A 77 11.480 20.396 17.884 1.00 0.00 O ATOM 1182 CB ALA A 77 12.999 18.243 19.347 1.00 0.00 C ATOM 0 H ALA A 77 10.911 17.377 20.564 1.00 0.00 H new ATOM 0 HA ALA A 77 12.294 19.958 20.394 1.00 0.00 H new ATOM 0 HB1 ALA A 77 13.605 18.822 18.649 1.00 0.00 H new ATOM 0 HB2 ALA A 77 13.620 17.916 20.181 1.00 0.00 H new ATOM 0 HB3 ALA A 77 12.589 17.372 18.836 1.00 0.00 H new ATOM 1188 N ALA A 78 9.754 19.193 18.688 1.00 0.00 N ATOM 1189 CA ALA A 78 8.823 19.583 17.639 1.00 0.00 C ATOM 1190 C ALA A 78 8.269 20.973 17.906 1.00 0.00 C ATOM 1191 O ALA A 78 7.766 21.253 18.995 1.00 0.00 O ATOM 1192 CB ALA A 78 7.688 18.574 17.549 1.00 0.00 C ATOM 0 H ALA A 78 9.354 18.569 19.389 1.00 0.00 H new ATOM 0 HA ALA A 78 9.357 19.602 16.689 1.00 0.00 H new ATOM 0 HB1 ALA A 78 6.996 18.874 16.762 1.00 0.00 H new ATOM 0 HB2 ALA A 78 8.094 17.589 17.319 1.00 0.00 H new ATOM 0 HB3 ALA A 78 7.159 18.535 18.501 1.00 0.00 H new ATOM 1198 N LYS A 79 8.376 21.849 16.920 1.00 0.00 N ATOM 1199 CA LYS A 79 7.860 23.202 17.055 1.00 0.00 C ATOM 1200 C LYS A 79 6.663 23.409 16.138 1.00 0.00 C ATOM 1201 O LYS A 79 6.143 22.456 15.558 1.00 0.00 O ATOM 1202 CB LYS A 79 8.943 24.229 16.733 1.00 0.00 C ATOM 1203 CG LYS A 79 10.268 23.948 17.413 1.00 0.00 C ATOM 1204 CD LYS A 79 10.128 23.898 18.926 1.00 0.00 C ATOM 1205 CE LYS A 79 11.309 23.187 19.571 1.00 0.00 C ATOM 1206 NZ LYS A 79 12.604 23.862 19.289 1.00 0.00 N ATOM 0 H LYS A 79 8.814 21.649 16.021 1.00 0.00 H new ATOM 0 HA LYS A 79 7.543 23.341 18.089 1.00 0.00 H new ATOM 0 HB2 LYS A 79 9.097 24.256 15.654 1.00 0.00 H new ATOM 0 HB3 LYS A 79 8.594 25.218 17.031 1.00 0.00 H new ATOM 0 HG2 LYS A 79 10.667 22.999 17.054 1.00 0.00 H new ATOM 0 HG3 LYS A 79 10.987 24.720 17.140 1.00 0.00 H new ATOM 0 HD2 LYS A 79 10.053 24.912 19.319 1.00 0.00 H new ATOM 0 HD3 LYS A 79 9.204 23.384 19.190 1.00 0.00 H new ATOM 0 HE2 LYS A 79 11.155 23.139 20.649 1.00 0.00 H new ATOM 0 HE3 LYS A 79 11.352 22.160 19.209 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 13.369 23.369 19.792 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 12.791 23.840 18.266 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 12.558 24.850 19.612 1.00 0.00 H new ATOM 1220 N LYS A 80 6.244 24.660 16.002 1.00 0.00 N ATOM 1221 CA LYS A 80 5.059 24.988 15.215 1.00 0.00 C ATOM 1222 C LYS A 80 5.240 24.621 13.747 1.00 0.00 C ATOM 1223 O LYS A 80 4.356 24.034 13.128 1.00 0.00 O ATOM 1224 CB LYS A 80 4.699 26.469 15.350 1.00 0.00 C ATOM 1225 CG LYS A 80 5.889 27.413 15.302 1.00 0.00 C ATOM 1226 CD LYS A 80 5.464 28.840 14.981 1.00 0.00 C ATOM 1227 CE LYS A 80 4.257 29.283 15.798 1.00 0.00 C ATOM 1228 NZ LYS A 80 4.509 29.254 17.265 1.00 0.00 N ATOM 0 H LYS A 80 6.706 25.465 16.425 1.00 0.00 H new ATOM 0 HA LYS A 80 4.236 24.394 15.613 1.00 0.00 H new ATOM 0 HB2 LYS A 80 4.007 26.736 14.551 1.00 0.00 H new ATOM 0 HB3 LYS A 80 4.171 26.617 16.292 1.00 0.00 H new ATOM 0 HG2 LYS A 80 6.407 27.395 16.261 1.00 0.00 H new ATOM 0 HG3 LYS A 80 6.598 27.067 14.550 1.00 0.00 H new ATOM 0 HD2 LYS A 80 6.297 29.516 15.172 1.00 0.00 H new ATOM 0 HD3 LYS A 80 5.229 28.916 13.919 1.00 0.00 H new ATOM 0 HE2 LYS A 80 3.976 30.294 15.503 1.00 0.00 H new ATOM 0 HE3 LYS A 80 3.411 28.636 15.567 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 3.660 29.581 17.770 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 4.734 28.282 17.559 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 5.309 29.879 17.492 1.00 0.00 H new ATOM 1242 N GLY A 81 6.386 24.945 13.186 1.00 0.00 N ATOM 1243 CA GLY A 81 6.639 24.577 11.815 1.00 0.00 C ATOM 1244 C GLY A 81 7.500 23.341 11.740 1.00 0.00 C ATOM 1245 O GLY A 81 8.534 23.328 11.075 1.00 0.00 O ATOM 0 H GLY A 81 7.141 25.452 13.649 1.00 0.00 H new ATOM 0 HA2 GLY A 81 5.694 24.399 11.302 1.00 0.00 H new ATOM 0 HA3 GLY A 81 7.132 25.400 11.298 1.00 0.00 H new ATOM 1249 N SER A 82 7.058 22.303 12.436 1.00 0.00 N ATOM 1250 CA SER A 82 7.787 21.048 12.530 1.00 0.00 C ATOM 1251 C SER A 82 7.926 20.378 11.159 1.00 0.00 C ATOM 1252 O SER A 82 8.840 19.585 10.934 1.00 0.00 O ATOM 1253 CB SER A 82 7.054 20.122 13.509 1.00 0.00 C ATOM 1254 OG SER A 82 7.893 19.089 13.980 1.00 0.00 O ATOM 0 H SER A 82 6.179 22.309 12.954 1.00 0.00 H new ATOM 0 HA SER A 82 8.794 21.250 12.894 1.00 0.00 H new ATOM 0 HB2 SER A 82 6.685 20.704 14.353 1.00 0.00 H new ATOM 0 HB3 SER A 82 6.184 19.688 13.017 1.00 0.00 H new ATOM 0 HG SER A 82 8.607 19.473 14.531 1.00 0.00 H new ATOM 1260 N MET A 83 7.035 20.755 10.243 1.00 0.00 N ATOM 1261 CA MET A 83 6.947 20.139 8.919 1.00 0.00 C ATOM 1262 C MET A 83 6.894 18.624 9.012 1.00 0.00 C ATOM 1263 O MET A 83 7.878 17.926 8.762 1.00 0.00 O ATOM 1264 CB MET A 83 8.100 20.586 8.019 1.00 0.00 C ATOM 1265 CG MET A 83 7.925 21.988 7.454 1.00 0.00 C ATOM 1266 SD MET A 83 7.112 22.008 5.838 1.00 0.00 S ATOM 1267 CE MET A 83 5.497 21.336 6.225 1.00 0.00 C ATOM 0 H MET A 83 6.353 21.497 10.398 1.00 0.00 H new ATOM 0 HA MET A 83 6.015 20.479 8.467 1.00 0.00 H new ATOM 0 HB2 MET A 83 9.029 20.546 8.587 1.00 0.00 H new ATOM 0 HB3 MET A 83 8.200 19.881 7.194 1.00 0.00 H new ATOM 0 HG2 MET A 83 7.341 22.585 8.155 1.00 0.00 H new ATOM 0 HG3 MET A 83 8.902 22.463 7.368 1.00 0.00 H new ATOM 0 HE1 MET A 83 4.827 21.488 5.379 1.00 0.00 H new ATOM 0 HE2 MET A 83 5.586 20.269 6.430 1.00 0.00 H new ATOM 0 HE3 MET A 83 5.093 21.841 7.102 1.00 0.00 H new ATOM 1277 N VAL A 84 5.734 18.129 9.390 1.00 0.00 N ATOM 1278 CA VAL A 84 5.514 16.705 9.521 1.00 0.00 C ATOM 1279 C VAL A 84 5.221 16.092 8.164 1.00 0.00 C ATOM 1280 O VAL A 84 4.295 16.516 7.473 1.00 0.00 O ATOM 1281 CB VAL A 84 4.338 16.420 10.477 1.00 0.00 C ATOM 1282 CG1 VAL A 84 4.018 14.936 10.533 1.00 0.00 C ATOM 1283 CG2 VAL A 84 4.643 16.956 11.865 1.00 0.00 C ATOM 0 H VAL A 84 4.920 18.701 9.614 1.00 0.00 H new ATOM 0 HA VAL A 84 6.420 16.259 9.932 1.00 0.00 H new ATOM 0 HB VAL A 84 3.458 16.934 10.090 1.00 0.00 H new ATOM 0 HG11 VAL A 84 3.185 14.769 11.216 1.00 0.00 H new ATOM 0 HG12 VAL A 84 3.748 14.584 9.537 1.00 0.00 H new ATOM 0 HG13 VAL A 84 4.892 14.388 10.886 1.00 0.00 H new ATOM 0 HG21 VAL A 84 3.804 16.747 12.528 1.00 0.00 H new ATOM 0 HG22 VAL A 84 5.540 16.473 12.252 1.00 0.00 H new ATOM 0 HG23 VAL A 84 4.804 18.033 11.812 1.00 0.00 H new ATOM 1293 N TYR A 85 6.022 15.117 7.774 1.00 0.00 N ATOM 1294 CA TYR A 85 5.795 14.412 6.531 1.00 0.00 C ATOM 1295 C TYR A 85 5.109 13.085 6.811 1.00 0.00 C ATOM 1296 O TYR A 85 5.744 12.113 7.224 1.00 0.00 O ATOM 1297 CB TYR A 85 7.110 14.195 5.781 1.00 0.00 C ATOM 1298 CG TYR A 85 7.865 15.477 5.511 1.00 0.00 C ATOM 1299 CD1 TYR A 85 7.370 16.425 4.622 1.00 0.00 C ATOM 1300 CD2 TYR A 85 9.070 15.739 6.146 1.00 0.00 C ATOM 1301 CE1 TYR A 85 8.061 17.596 4.373 1.00 0.00 C ATOM 1302 CE2 TYR A 85 9.766 16.907 5.904 1.00 0.00 C ATOM 1303 CZ TYR A 85 9.256 17.832 5.019 1.00 0.00 C ATOM 1304 OH TYR A 85 9.950 18.997 4.771 1.00 0.00 O ATOM 0 H TYR A 85 6.834 14.797 8.302 1.00 0.00 H new ATOM 0 HA TYR A 85 5.147 15.017 5.897 1.00 0.00 H new ATOM 0 HB2 TYR A 85 7.744 13.524 6.360 1.00 0.00 H new ATOM 0 HB3 TYR A 85 6.902 13.698 4.833 1.00 0.00 H new ATOM 0 HD1 TYR A 85 6.432 16.244 4.119 1.00 0.00 H new ATOM 0 HD2 TYR A 85 9.471 15.017 6.842 1.00 0.00 H new ATOM 0 HE1 TYR A 85 7.667 18.322 3.677 1.00 0.00 H new ATOM 0 HE2 TYR A 85 10.704 17.094 6.405 1.00 0.00 H new ATOM 0 HH TYR A 85 10.770 19.009 5.307 1.00 0.00 H new ATOM 1314 N PHE A 86 3.804 13.064 6.617 1.00 0.00 N ATOM 1315 CA PHE A 86 3.018 11.867 6.840 1.00 0.00 C ATOM 1316 C PHE A 86 2.718 11.217 5.502 1.00 0.00 C ATOM 1317 O PHE A 86 1.962 11.751 4.688 1.00 0.00 O ATOM 1318 CB PHE A 86 1.728 12.206 7.589 1.00 0.00 C ATOM 1319 CG PHE A 86 0.911 11.007 7.981 1.00 0.00 C ATOM 1320 CD1 PHE A 86 -0.381 10.852 7.508 1.00 0.00 C ATOM 1321 CD2 PHE A 86 1.430 10.042 8.829 1.00 0.00 C ATOM 1322 CE1 PHE A 86 -1.140 9.754 7.869 1.00 0.00 C ATOM 1323 CE2 PHE A 86 0.677 8.941 9.192 1.00 0.00 C ATOM 1324 CZ PHE A 86 -0.611 8.798 8.713 1.00 0.00 C ATOM 0 H PHE A 86 3.263 13.870 6.303 1.00 0.00 H new ATOM 0 HA PHE A 86 3.582 11.167 7.457 1.00 0.00 H new ATOM 0 HB2 PHE A 86 1.980 12.770 8.487 1.00 0.00 H new ATOM 0 HB3 PHE A 86 1.119 12.858 6.964 1.00 0.00 H new ATOM 0 HD1 PHE A 86 -0.801 11.598 6.849 1.00 0.00 H new ATOM 0 HD2 PHE A 86 2.434 10.151 9.211 1.00 0.00 H new ATOM 0 HE1 PHE A 86 -2.146 9.644 7.491 1.00 0.00 H new ATOM 0 HE2 PHE A 86 1.095 8.193 9.850 1.00 0.00 H new ATOM 0 HZ PHE A 86 -1.203 7.941 8.998 1.00 0.00 H new ATOM 1334 N LYS A 87 3.343 10.083 5.266 1.00 0.00 N ATOM 1335 CA LYS A 87 3.244 9.415 3.986 1.00 0.00 C ATOM 1336 C LYS A 87 2.197 8.325 4.021 1.00 0.00 C ATOM 1337 O LYS A 87 2.133 7.541 4.962 1.00 0.00 O ATOM 1338 CB LYS A 87 4.592 8.827 3.602 1.00 0.00 C ATOM 1339 CG LYS A 87 5.681 9.868 3.475 1.00 0.00 C ATOM 1340 CD LYS A 87 7.017 9.222 3.190 1.00 0.00 C ATOM 1341 CE LYS A 87 8.116 10.263 3.070 1.00 0.00 C ATOM 1342 NZ LYS A 87 9.461 9.642 2.999 1.00 0.00 N ATOM 0 H LYS A 87 3.929 9.602 5.949 1.00 0.00 H new ATOM 0 HA LYS A 87 2.945 10.151 3.240 1.00 0.00 H new ATOM 0 HB2 LYS A 87 4.887 8.091 4.350 1.00 0.00 H new ATOM 0 HB3 LYS A 87 4.493 8.296 2.655 1.00 0.00 H new ATOM 0 HG2 LYS A 87 5.432 10.564 2.674 1.00 0.00 H new ATOM 0 HG3 LYS A 87 5.743 10.449 4.395 1.00 0.00 H new ATOM 0 HD2 LYS A 87 7.262 8.521 3.988 1.00 0.00 H new ATOM 0 HD3 LYS A 87 6.956 8.646 2.267 1.00 0.00 H new ATOM 0 HE2 LYS A 87 7.948 10.867 2.179 1.00 0.00 H new ATOM 0 HE3 LYS A 87 8.072 10.937 3.925 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 10.189 10.383 3.054 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 9.580 8.980 3.792 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 9.559 9.127 2.101 1.00 0.00 H new ATOM 1356 N VAL A 88 1.391 8.281 2.983 1.00 0.00 N ATOM 1357 CA VAL A 88 0.334 7.291 2.863 1.00 0.00 C ATOM 1358 C VAL A 88 0.223 6.819 1.420 1.00 0.00 C ATOM 1359 O VAL A 88 -0.221 7.558 0.538 1.00 0.00 O ATOM 1360 CB VAL A 88 -1.029 7.834 3.348 1.00 0.00 C ATOM 1361 CG1 VAL A 88 -1.074 7.900 4.861 1.00 0.00 C ATOM 1362 CG2 VAL A 88 -1.309 9.207 2.762 1.00 0.00 C ATOM 0 H VAL A 88 1.447 8.928 2.197 1.00 0.00 H new ATOM 0 HA VAL A 88 0.599 6.450 3.504 1.00 0.00 H new ATOM 0 HB VAL A 88 -1.800 7.146 3.003 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -2.043 8.285 5.180 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -0.927 6.902 5.273 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -0.285 8.561 5.220 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -2.274 9.565 3.120 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -0.527 9.901 3.071 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -1.327 9.142 1.674 1.00 0.00 H new ATOM 1372 N GLY A 89 0.654 5.592 1.179 1.00 0.00 N ATOM 1373 CA GLY A 89 0.700 5.076 -0.172 1.00 0.00 C ATOM 1374 C GLY A 89 1.675 5.859 -1.029 1.00 0.00 C ATOM 1375 O GLY A 89 2.888 5.694 -0.907 1.00 0.00 O ATOM 0 H GLY A 89 0.974 4.942 1.897 1.00 0.00 H new ATOM 0 HA2 GLY A 89 0.992 4.026 -0.153 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -0.295 5.122 -0.615 1.00 0.00 H new ATOM 1379 N ASN A 90 1.149 6.742 -1.864 1.00 0.00 N ATOM 1380 CA ASN A 90 1.992 7.560 -2.730 1.00 0.00 C ATOM 1381 C ASN A 90 1.874 9.036 -2.366 1.00 0.00 C ATOM 1382 O ASN A 90 2.439 9.897 -3.037 1.00 0.00 O ATOM 1383 CB ASN A 90 1.645 7.352 -4.214 1.00 0.00 C ATOM 1384 CG ASN A 90 0.393 8.088 -4.690 1.00 0.00 C ATOM 1385 OD1 ASN A 90 -0.639 8.158 -3.860 1.00 0.00 O flip ATOM 1386 ND2 ASN A 90 0.346 8.571 -5.822 1.00 0.00 N flip ATOM 0 H ASN A 90 0.148 6.912 -1.962 1.00 0.00 H new ATOM 0 HA ASN A 90 3.023 7.241 -2.575 1.00 0.00 H new ATOM 0 HB2 ASN A 90 2.492 7.676 -4.819 1.00 0.00 H new ATOM 0 HB3 ASN A 90 1.513 6.285 -4.395 1.00 0.00 H new ATOM 0 HD21 ASN A 90 1.155 8.503 -6.440 1.00 0.00 H new ATOM 0 HD22 ASN A 90 -0.502 9.039 -6.142 1.00 0.00 H new ATOM 1393 N GLU A 91 1.152 9.325 -1.292 1.00 0.00 N ATOM 1394 CA GLU A 91 0.930 10.705 -0.882 1.00 0.00 C ATOM 1395 C GLU A 91 1.825 11.080 0.293 1.00 0.00 C ATOM 1396 O GLU A 91 1.690 10.535 1.389 1.00 0.00 O ATOM 1397 CB GLU A 91 -0.537 10.931 -0.502 1.00 0.00 C ATOM 1398 CG GLU A 91 -1.514 10.681 -1.637 1.00 0.00 C ATOM 1399 CD GLU A 91 -2.926 11.110 -1.293 1.00 0.00 C ATOM 1400 OE1 GLU A 91 -3.276 12.277 -1.565 1.00 0.00 O ATOM 1401 OE2 GLU A 91 -3.688 10.286 -0.753 1.00 0.00 O ATOM 0 H GLU A 91 0.712 8.627 -0.692 1.00 0.00 H new ATOM 0 HA GLU A 91 1.180 11.342 -1.730 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -0.790 10.277 0.333 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -0.657 11.956 -0.152 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -1.180 11.219 -2.524 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -1.511 9.620 -1.888 1.00 0.00 H new ATOM 1408 N THR A 92 2.752 11.991 0.051 1.00 0.00 N ATOM 1409 CA THR A 92 3.555 12.564 1.115 1.00 0.00 C ATOM 1410 C THR A 92 2.927 13.876 1.564 1.00 0.00 C ATOM 1411 O THR A 92 3.116 14.920 0.935 1.00 0.00 O ATOM 1412 CB THR A 92 5.002 12.813 0.660 1.00 0.00 C ATOM 1413 OG1 THR A 92 5.520 11.635 0.030 1.00 0.00 O ATOM 1414 CG2 THR A 92 5.883 13.190 1.842 1.00 0.00 C ATOM 0 H THR A 92 2.967 12.351 -0.879 1.00 0.00 H new ATOM 0 HA THR A 92 3.583 11.855 1.943 1.00 0.00 H new ATOM 0 HB THR A 92 5.003 13.640 -0.051 1.00 0.00 H new ATOM 0 HG1 THR A 92 6.442 11.798 -0.260 1.00 0.00 H new ATOM 0 HG21 THR A 92 6.902 13.361 1.496 1.00 0.00 H new ATOM 0 HG22 THR A 92 5.500 14.099 2.306 1.00 0.00 H new ATOM 0 HG23 THR A 92 5.879 12.380 2.572 1.00 0.00 H new ATOM 1422 N ARG A 93 2.161 13.808 2.635 1.00 0.00 N ATOM 1423 CA ARG A 93 1.378 14.942 3.085 1.00 0.00 C ATOM 1424 C ARG A 93 2.158 15.742 4.119 1.00 0.00 C ATOM 1425 O ARG A 93 2.779 15.169 5.016 1.00 0.00 O ATOM 1426 CB ARG A 93 0.063 14.440 3.679 1.00 0.00 C ATOM 1427 CG ARG A 93 -0.527 13.267 2.908 1.00 0.00 C ATOM 1428 CD ARG A 93 -1.744 12.678 3.597 1.00 0.00 C ATOM 1429 NE ARG A 93 -2.928 13.512 3.432 1.00 0.00 N ATOM 1430 CZ ARG A 93 -4.027 13.121 2.796 1.00 0.00 C ATOM 1431 NH1 ARG A 93 -4.096 11.905 2.266 1.00 0.00 N ATOM 1432 NH2 ARG A 93 -5.056 13.948 2.696 1.00 0.00 N ATOM 0 H ARG A 93 2.064 12.973 3.213 1.00 0.00 H new ATOM 0 HA ARG A 93 1.164 15.595 2.239 1.00 0.00 H new ATOM 0 HB2 ARG A 93 0.229 14.141 4.714 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -0.658 15.257 3.695 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -0.803 13.596 1.906 1.00 0.00 H new ATOM 0 HG3 ARG A 93 0.232 12.493 2.792 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -1.942 11.685 3.194 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -1.534 12.555 4.659 1.00 0.00 H new ATOM 0 HE ARG A 93 -2.912 14.452 3.828 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -3.304 11.268 2.347 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -4.941 11.608 1.778 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -5.003 14.880 3.106 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -5.902 13.653 2.209 1.00 0.00 H new ATOM 1446 N LYS A 94 2.137 17.060 3.991 1.00 0.00 N ATOM 1447 CA LYS A 94 2.861 17.922 4.913 1.00 0.00 C ATOM 1448 C LYS A 94 1.897 18.455 5.959 1.00 0.00 C ATOM 1449 O LYS A 94 0.819 18.945 5.626 1.00 0.00 O ATOM 1450 CB LYS A 94 3.534 19.114 4.205 1.00 0.00 C ATOM 1451 CG LYS A 94 4.101 18.827 2.818 1.00 0.00 C ATOM 1452 CD LYS A 94 3.005 18.798 1.762 1.00 0.00 C ATOM 1453 CE LYS A 94 3.570 18.774 0.355 1.00 0.00 C ATOM 1454 NZ LYS A 94 4.145 20.087 -0.040 1.00 0.00 N ATOM 0 H LYS A 94 1.628 17.555 3.259 1.00 0.00 H new ATOM 0 HA LYS A 94 3.647 17.321 5.370 1.00 0.00 H new ATOM 0 HB2 LYS A 94 2.806 19.920 4.120 1.00 0.00 H new ATOM 0 HB3 LYS A 94 4.342 19.480 4.839 1.00 0.00 H new ATOM 0 HG2 LYS A 94 4.836 19.589 2.560 1.00 0.00 H new ATOM 0 HG3 LYS A 94 4.623 17.870 2.828 1.00 0.00 H new ATOM 0 HD2 LYS A 94 2.377 17.920 1.915 1.00 0.00 H new ATOM 0 HD3 LYS A 94 2.365 19.672 1.880 1.00 0.00 H new ATOM 0 HE2 LYS A 94 4.341 18.006 0.288 1.00 0.00 H new ATOM 0 HE3 LYS A 94 2.783 18.498 -0.347 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 4.333 20.090 -1.063 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 3.471 20.845 0.191 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 5.034 20.246 0.476 1.00 0.00 H new ATOM 1468 N TYR A 95 2.270 18.344 7.219 1.00 0.00 N ATOM 1469 CA TYR A 95 1.443 18.849 8.300 1.00 0.00 C ATOM 1470 C TYR A 95 2.215 19.858 9.139 1.00 0.00 C ATOM 1471 O TYR A 95 3.394 19.661 9.441 1.00 0.00 O ATOM 1472 CB TYR A 95 0.939 17.697 9.171 1.00 0.00 C ATOM 1473 CG TYR A 95 -0.017 16.777 8.452 1.00 0.00 C ATOM 1474 CD1 TYR A 95 0.449 15.720 7.685 1.00 0.00 C ATOM 1475 CD2 TYR A 95 -1.386 16.971 8.536 1.00 0.00 C ATOM 1476 CE1 TYR A 95 -0.426 14.885 7.022 1.00 0.00 C ATOM 1477 CE2 TYR A 95 -2.266 16.138 7.878 1.00 0.00 C ATOM 1478 CZ TYR A 95 -1.781 15.098 7.122 1.00 0.00 C ATOM 1479 OH TYR A 95 -2.655 14.275 6.453 1.00 0.00 O ATOM 0 H TYR A 95 3.141 17.908 7.521 1.00 0.00 H new ATOM 0 HA TYR A 95 0.580 19.355 7.866 1.00 0.00 H new ATOM 0 HB2 TYR A 95 1.792 17.118 9.525 1.00 0.00 H new ATOM 0 HB3 TYR A 95 0.445 18.106 10.052 1.00 0.00 H new ATOM 0 HD1 TYR A 95 1.512 15.548 7.606 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -1.771 17.789 9.127 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -0.048 14.067 6.427 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -3.331 16.302 7.956 1.00 0.00 H new ATOM 0 HH TYR A 95 -3.089 14.776 5.731 1.00 0.00 H new ATOM 1489 N LYS A 96 1.552 20.947 9.496 1.00 0.00 N ATOM 1490 CA LYS A 96 2.177 22.009 10.269 1.00 0.00 C ATOM 1491 C LYS A 96 1.598 22.023 11.683 1.00 0.00 C ATOM 1492 O LYS A 96 0.377 21.999 11.857 1.00 0.00 O ATOM 1493 CB LYS A 96 1.944 23.359 9.579 1.00 0.00 C ATOM 1494 CG LYS A 96 3.057 24.369 9.797 1.00 0.00 C ATOM 1495 CD LYS A 96 4.345 23.954 9.098 1.00 0.00 C ATOM 1496 CE LYS A 96 4.441 24.530 7.694 1.00 0.00 C ATOM 1497 NZ LYS A 96 4.506 26.015 7.704 1.00 0.00 N ATOM 0 H LYS A 96 0.575 21.119 9.261 1.00 0.00 H new ATOM 0 HA LYS A 96 3.251 21.831 10.331 1.00 0.00 H new ATOM 0 HB2 LYS A 96 1.825 23.192 8.509 1.00 0.00 H new ATOM 0 HB3 LYS A 96 1.008 23.783 9.941 1.00 0.00 H new ATOM 0 HG2 LYS A 96 2.740 25.344 9.426 1.00 0.00 H new ATOM 0 HG3 LYS A 96 3.243 24.479 10.865 1.00 0.00 H new ATOM 0 HD2 LYS A 96 5.200 24.287 9.686 1.00 0.00 H new ATOM 0 HD3 LYS A 96 4.396 22.866 9.048 1.00 0.00 H new ATOM 0 HE2 LYS A 96 5.327 24.132 7.199 1.00 0.00 H new ATOM 0 HE3 LYS A 96 3.578 24.209 7.111 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 4.994 26.347 6.848 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 3.542 26.405 7.726 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 5.027 26.334 8.546 1.00 0.00 H new ATOM 1511 N MET A 97 2.466 22.066 12.686 1.00 0.00 N ATOM 1512 CA MET A 97 2.033 21.995 14.081 1.00 0.00 C ATOM 1513 C MET A 97 1.545 23.358 14.555 1.00 0.00 C ATOM 1514 O MET A 97 2.238 24.070 15.276 1.00 0.00 O ATOM 1515 CB MET A 97 3.172 21.508 14.985 1.00 0.00 C ATOM 1516 CG MET A 97 3.513 20.036 14.827 1.00 0.00 C ATOM 1517 SD MET A 97 2.193 18.954 15.406 1.00 0.00 S ATOM 1518 CE MET A 97 2.961 17.349 15.195 1.00 0.00 C ATOM 0 H MET A 97 3.475 22.150 12.562 1.00 0.00 H new ATOM 0 HA MET A 97 1.212 21.280 14.142 1.00 0.00 H new ATOM 0 HB2 MET A 97 4.063 22.099 14.776 1.00 0.00 H new ATOM 0 HB3 MET A 97 2.901 21.696 16.024 1.00 0.00 H new ATOM 0 HG2 MET A 97 3.717 19.825 13.777 1.00 0.00 H new ATOM 0 HG3 MET A 97 4.426 19.817 15.380 1.00 0.00 H new ATOM 0 HE1 MET A 97 2.264 16.674 14.698 1.00 0.00 H new ATOM 0 HE2 MET A 97 3.860 17.453 14.588 1.00 0.00 H new ATOM 0 HE3 MET A 97 3.227 16.942 16.170 1.00 0.00 H new ATOM 1528 N THR A 98 0.350 23.719 14.132 1.00 0.00 N ATOM 1529 CA THR A 98 -0.192 25.036 14.418 1.00 0.00 C ATOM 1530 C THR A 98 -0.915 25.072 15.765 1.00 0.00 C ATOM 1531 O THR A 98 -1.243 26.146 16.269 1.00 0.00 O ATOM 1532 CB THR A 98 -1.139 25.505 13.289 1.00 0.00 C ATOM 1533 OG1 THR A 98 -1.875 26.669 13.692 1.00 0.00 O ATOM 1534 CG2 THR A 98 -2.098 24.397 12.889 1.00 0.00 C ATOM 0 H THR A 98 -0.268 23.118 13.587 1.00 0.00 H new ATOM 0 HA THR A 98 0.652 25.723 14.473 1.00 0.00 H new ATOM 0 HB THR A 98 -0.525 25.761 12.426 1.00 0.00 H new ATOM 0 HG1 THR A 98 -1.703 26.853 14.639 1.00 0.00 H new ATOM 0 HG21 THR A 98 -2.753 24.752 12.094 1.00 0.00 H new ATOM 0 HG22 THR A 98 -1.532 23.536 12.535 1.00 0.00 H new ATOM 0 HG23 THR A 98 -2.699 24.107 13.751 1.00 0.00 H new ATOM 1542 N SER A 99 -1.166 23.909 16.348 1.00 0.00 N ATOM 1543 CA SER A 99 -1.793 23.849 17.656 1.00 0.00 C ATOM 1544 C SER A 99 -1.108 22.804 18.529 1.00 0.00 C ATOM 1545 O SER A 99 -1.343 21.602 18.388 1.00 0.00 O ATOM 1546 CB SER A 99 -3.285 23.546 17.519 1.00 0.00 C ATOM 1547 OG SER A 99 -3.929 24.514 16.704 1.00 0.00 O ATOM 0 H SER A 99 -0.946 23.001 15.938 1.00 0.00 H new ATOM 0 HA SER A 99 -1.684 24.821 18.138 1.00 0.00 H new ATOM 0 HB2 SER A 99 -3.420 22.554 17.087 1.00 0.00 H new ATOM 0 HB3 SER A 99 -3.748 23.530 18.505 1.00 0.00 H new ATOM 0 HG SER A 99 -4.882 24.298 16.630 1.00 0.00 H new ATOM 1553 N ILE A 100 -0.244 23.272 19.417 1.00 0.00 N ATOM 1554 CA ILE A 100 0.505 22.391 20.302 1.00 0.00 C ATOM 1555 C ILE A 100 0.184 22.704 21.756 1.00 0.00 C ATOM 1556 O ILE A 100 0.364 23.839 22.201 1.00 0.00 O ATOM 1557 CB ILE A 100 2.029 22.542 20.096 1.00 0.00 C ATOM 1558 CG1 ILE A 100 2.416 22.223 18.648 1.00 0.00 C ATOM 1559 CG2 ILE A 100 2.791 21.642 21.064 1.00 0.00 C ATOM 1560 CD1 ILE A 100 3.883 22.450 18.355 1.00 0.00 C ATOM 0 H ILE A 100 -0.043 24.264 19.545 1.00 0.00 H new ATOM 0 HA ILE A 100 0.212 21.369 20.061 1.00 0.00 H new ATOM 0 HB ILE A 100 2.300 23.578 20.301 1.00 0.00 H new ATOM 0 HG12 ILE A 100 2.167 21.184 18.433 1.00 0.00 H new ATOM 0 HG13 ILE A 100 1.819 22.839 17.976 1.00 0.00 H new ATOM 0 HG21 ILE A 100 3.863 21.761 20.905 1.00 0.00 H new ATOM 0 HG22 ILE A 100 2.544 21.918 22.089 1.00 0.00 H new ATOM 0 HG23 ILE A 100 2.512 20.603 20.891 1.00 0.00 H new ATOM 0 HD11 ILE A 100 4.088 22.205 17.313 1.00 0.00 H new ATOM 0 HD12 ILE A 100 4.133 23.495 18.538 1.00 0.00 H new ATOM 0 HD13 ILE A 100 4.486 21.814 19.003 1.00 0.00 H new ATOM 1572 N ARG A 101 -0.297 21.711 22.493 1.00 0.00 N ATOM 1573 CA ARG A 101 -0.550 21.886 23.917 1.00 0.00 C ATOM 1574 C ARG A 101 -0.645 20.539 24.614 1.00 0.00 C ATOM 1575 O ARG A 101 -0.425 19.498 24.005 1.00 0.00 O ATOM 1576 CB ARG A 101 -1.834 22.695 24.159 1.00 0.00 C ATOM 1577 CG ARG A 101 -3.105 22.007 23.688 1.00 0.00 C ATOM 1578 CD ARG A 101 -4.336 22.841 24.004 1.00 0.00 C ATOM 1579 NE ARG A 101 -4.279 24.155 23.368 1.00 0.00 N ATOM 1580 CZ ARG A 101 -5.221 25.090 23.486 1.00 0.00 C ATOM 1581 NH1 ARG A 101 -6.303 24.870 24.230 1.00 0.00 N ATOM 1582 NH2 ARG A 101 -5.077 26.248 22.853 1.00 0.00 N ATOM 0 H ARG A 101 -0.518 20.783 22.132 1.00 0.00 H new ATOM 0 HA ARG A 101 0.289 22.442 24.335 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -1.922 22.905 25.225 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -1.745 23.656 23.652 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -3.049 21.831 22.614 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -3.192 21.032 24.167 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -5.229 22.313 23.668 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -4.425 22.963 25.083 1.00 0.00 H new ATOM 0 HE ARG A 101 -3.463 24.371 22.795 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -6.416 23.980 24.715 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -7.019 25.591 24.315 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -4.250 26.417 22.281 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -5.794 26.969 22.939 1.00 0.00 H new ATOM 1596 N ASP A 102 -0.939 20.571 25.897 1.00 0.00 N ATOM 1597 CA ASP A 102 -1.213 19.365 26.662 1.00 0.00 C ATOM 1598 C ASP A 102 -2.483 19.569 27.456 1.00 0.00 C ATOM 1599 O ASP A 102 -2.741 20.664 27.950 1.00 0.00 O ATOM 1600 CB ASP A 102 -0.048 19.003 27.593 1.00 0.00 C ATOM 1601 CG ASP A 102 0.496 20.194 28.351 1.00 0.00 C ATOM 1602 OD1 ASP A 102 1.480 20.799 27.873 1.00 0.00 O ATOM 1603 OD2 ASP A 102 -0.052 20.538 29.415 1.00 0.00 O ATOM 0 H ASP A 102 -0.996 21.431 26.442 1.00 0.00 H new ATOM 0 HA ASP A 102 -1.336 18.532 25.969 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -0.380 18.247 28.305 1.00 0.00 H new ATOM 0 HB3 ASP A 102 0.754 18.556 27.005 1.00 0.00 H new ATOM 1608 N VAL A 103 -3.296 18.536 27.546 1.00 0.00 N ATOM 1609 CA VAL A 103 -4.579 18.650 28.213 1.00 0.00 C ATOM 1610 C VAL A 103 -4.686 17.671 29.372 1.00 0.00 C ATOM 1611 O VAL A 103 -3.741 16.942 29.680 1.00 0.00 O ATOM 1612 CB VAL A 103 -5.755 18.426 27.237 1.00 0.00 C ATOM 1613 CG1 VAL A 103 -5.746 19.485 26.148 1.00 0.00 C ATOM 1614 CG2 VAL A 103 -5.710 17.031 26.631 1.00 0.00 C ATOM 0 H VAL A 103 -3.093 17.611 27.167 1.00 0.00 H new ATOM 0 HA VAL A 103 -4.641 19.667 28.600 1.00 0.00 H new ATOM 0 HB VAL A 103 -6.684 18.513 27.800 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -6.580 19.314 25.468 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -5.842 20.472 26.600 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -4.809 19.429 25.594 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -6.550 16.903 25.949 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -4.776 16.902 26.084 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -5.772 16.287 27.425 1.00 0.00 H new ATOM 1624 N LYS A 104 -5.854 17.647 29.987 1.00 0.00 N ATOM 1625 CA LYS A 104 -6.086 16.830 31.161 1.00 0.00 C ATOM 1626 C LYS A 104 -7.052 15.706 30.819 1.00 0.00 C ATOM 1627 O LYS A 104 -7.813 15.818 29.860 1.00 0.00 O ATOM 1628 CB LYS A 104 -6.613 17.667 32.348 1.00 0.00 C ATOM 1629 CG LYS A 104 -7.813 18.560 32.047 1.00 0.00 C ATOM 1630 CD LYS A 104 -7.400 19.860 31.374 1.00 0.00 C ATOM 1631 CE LYS A 104 -8.569 20.824 31.242 1.00 0.00 C ATOM 1632 NZ LYS A 104 -8.309 21.876 30.226 1.00 0.00 N ATOM 0 H LYS A 104 -6.664 18.190 29.688 1.00 0.00 H new ATOM 0 HA LYS A 104 -5.133 16.402 31.473 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -6.883 16.987 33.156 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -5.800 18.293 32.716 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -8.511 18.025 31.404 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -8.341 18.783 32.974 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -6.604 20.331 31.951 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -6.993 19.645 30.386 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -9.467 20.270 30.969 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -8.764 21.292 32.207 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -8.773 22.760 30.515 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -7.284 22.034 30.144 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -8.687 21.571 29.306 1.00 0.00 H new ATOM 1646 N PRO A 105 -7.035 14.604 31.591 1.00 0.00 N ATOM 1647 CA PRO A 105 -7.926 13.459 31.359 1.00 0.00 C ATOM 1648 C PRO A 105 -9.404 13.835 31.454 1.00 0.00 C ATOM 1649 O PRO A 105 -10.280 13.056 31.086 1.00 0.00 O ATOM 1650 CB PRO A 105 -7.551 12.472 32.474 1.00 0.00 C ATOM 1651 CG PRO A 105 -6.836 13.287 33.497 1.00 0.00 C ATOM 1652 CD PRO A 105 -6.139 14.376 32.737 1.00 0.00 C ATOM 0 HA PRO A 105 -7.802 13.053 30.355 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -8.438 12.001 32.897 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -6.915 11.672 32.094 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -7.534 13.702 34.224 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -6.122 12.679 34.052 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -6.018 15.276 33.340 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -5.143 14.071 32.416 1.00 0.00 H new ATOM 1660 N THR A 106 -9.671 15.040 31.941 1.00 0.00 N ATOM 1661 CA THR A 106 -11.032 15.517 32.093 1.00 0.00 C ATOM 1662 C THR A 106 -11.283 16.747 31.212 1.00 0.00 C ATOM 1663 O THR A 106 -12.250 17.485 31.416 1.00 0.00 O ATOM 1664 CB THR A 106 -11.336 15.843 33.577 1.00 0.00 C ATOM 1665 OG1 THR A 106 -12.686 16.302 33.731 1.00 0.00 O ATOM 1666 CG2 THR A 106 -10.374 16.890 34.121 1.00 0.00 C ATOM 0 H THR A 106 -8.957 15.705 32.238 1.00 0.00 H new ATOM 0 HA THR A 106 -11.705 14.723 31.769 1.00 0.00 H new ATOM 0 HB THR A 106 -11.205 14.923 34.146 1.00 0.00 H new ATOM 0 HG1 THR A 106 -12.938 16.843 32.954 1.00 0.00 H new ATOM 0 HG21 THR A 106 -10.613 17.097 35.164 1.00 0.00 H new ATOM 0 HG22 THR A 106 -9.352 16.517 34.050 1.00 0.00 H new ATOM 0 HG23 THR A 106 -10.467 17.807 33.539 1.00 0.00 H new ATOM 1674 N ASP A 107 -10.421 16.958 30.219 1.00 0.00 N ATOM 1675 CA ASP A 107 -10.585 18.085 29.308 1.00 0.00 C ATOM 1676 C ASP A 107 -11.743 17.828 28.357 1.00 0.00 C ATOM 1677 O ASP A 107 -11.825 16.769 27.736 1.00 0.00 O ATOM 1678 CB ASP A 107 -9.309 18.342 28.500 1.00 0.00 C ATOM 1679 CG ASP A 107 -9.421 19.578 27.622 1.00 0.00 C ATOM 1680 OD1 ASP A 107 -10.128 19.526 26.593 1.00 0.00 O ATOM 1681 OD2 ASP A 107 -8.803 20.610 27.969 1.00 0.00 O ATOM 0 H ASP A 107 -9.610 16.369 30.027 1.00 0.00 H new ATOM 0 HA ASP A 107 -10.795 18.969 29.911 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -8.467 18.459 29.182 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -9.096 17.474 27.876 1.00 0.00 H new ATOM 1686 N VAL A 108 -12.632 18.799 28.254 1.00 0.00 N ATOM 1687 CA VAL A 108 -13.793 18.689 27.384 1.00 0.00 C ATOM 1688 C VAL A 108 -13.836 19.851 26.395 1.00 0.00 C ATOM 1689 O VAL A 108 -14.909 20.279 25.960 1.00 0.00 O ATOM 1690 CB VAL A 108 -15.107 18.650 28.195 1.00 0.00 C ATOM 1691 CG1 VAL A 108 -15.214 17.354 28.985 1.00 0.00 C ATOM 1692 CG2 VAL A 108 -15.206 19.853 29.124 1.00 0.00 C ATOM 0 H VAL A 108 -12.573 19.680 28.765 1.00 0.00 H new ATOM 0 HA VAL A 108 -13.700 17.752 26.835 1.00 0.00 H new ATOM 0 HB VAL A 108 -15.939 18.693 27.492 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -16.147 17.348 29.549 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -15.199 16.507 28.299 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -14.373 17.277 29.674 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -16.139 19.804 29.685 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -14.365 19.847 29.818 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -15.184 20.770 28.535 1.00 0.00 H new ATOM 1702 N GLU A 109 -12.661 20.344 26.024 1.00 0.00 N ATOM 1703 CA GLU A 109 -12.565 21.485 25.127 1.00 0.00 C ATOM 1704 C GLU A 109 -11.787 21.143 23.862 1.00 0.00 C ATOM 1705 O GLU A 109 -11.730 21.941 22.926 1.00 0.00 O ATOM 1706 CB GLU A 109 -11.910 22.656 25.848 1.00 0.00 C ATOM 1707 CG GLU A 109 -12.669 23.067 27.094 1.00 0.00 C ATOM 1708 CD GLU A 109 -12.058 24.261 27.790 1.00 0.00 C ATOM 1709 OE1 GLU A 109 -11.936 25.326 27.149 1.00 0.00 O ATOM 1710 OE2 GLU A 109 -11.722 24.146 28.987 1.00 0.00 O ATOM 0 H GLU A 109 -11.763 19.971 26.331 1.00 0.00 H new ATOM 0 HA GLU A 109 -13.575 21.762 24.827 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -10.890 22.386 26.120 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -11.845 23.506 25.169 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -13.700 23.298 26.825 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -12.701 22.226 27.787 1.00 0.00 H new ATOM 1717 N VAL A 110 -11.201 19.955 23.821 1.00 0.00 N ATOM 1718 CA VAL A 110 -10.464 19.529 22.634 1.00 0.00 C ATOM 1719 C VAL A 110 -11.375 18.755 21.697 1.00 0.00 C ATOM 1720 O VAL A 110 -11.102 18.622 20.508 1.00 0.00 O ATOM 1721 CB VAL A 110 -9.221 18.681 22.979 1.00 0.00 C ATOM 1722 CG1 VAL A 110 -8.161 19.545 23.641 1.00 0.00 C ATOM 1723 CG2 VAL A 110 -9.589 17.509 23.874 1.00 0.00 C ATOM 0 H VAL A 110 -11.219 19.276 24.582 1.00 0.00 H new ATOM 0 HA VAL A 110 -10.111 20.434 22.140 1.00 0.00 H new ATOM 0 HB VAL A 110 -8.816 18.279 22.050 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -7.290 18.934 23.879 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -7.868 20.346 22.962 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -8.563 19.976 24.558 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -8.694 16.929 24.101 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -10.024 17.882 24.801 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -10.313 16.874 23.363 1.00 0.00 H new ATOM 1733 N LEU A 111 -12.474 18.272 22.248 1.00 0.00 N ATOM 1734 CA LEU A 111 -13.519 17.639 21.465 1.00 0.00 C ATOM 1735 C LEU A 111 -14.650 18.643 21.273 1.00 0.00 C ATOM 1736 O LEU A 111 -15.783 18.294 20.951 1.00 0.00 O ATOM 1737 CB LEU A 111 -14.021 16.334 22.134 1.00 0.00 C ATOM 1738 CG LEU A 111 -14.156 16.310 23.677 1.00 0.00 C ATOM 1739 CD1 LEU A 111 -12.804 16.153 24.365 1.00 0.00 C ATOM 1740 CD2 LEU A 111 -14.887 17.537 24.198 1.00 0.00 C ATOM 0 H LEU A 111 -12.667 18.308 23.249 1.00 0.00 H new ATOM 0 HA LEU A 111 -13.121 17.348 20.493 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -14.997 16.096 21.710 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -13.344 15.530 21.846 1.00 0.00 H new ATOM 0 HG LEU A 111 -14.756 15.434 23.923 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -12.945 16.141 25.446 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -12.341 15.218 24.049 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -12.158 16.988 24.093 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -14.961 17.482 25.284 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -14.337 18.435 23.916 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -15.888 17.574 23.767 1.00 0.00 H new ATOM 1752 N ASP A 112 -14.287 19.903 21.457 1.00 0.00 N ATOM 1753 CA ASP A 112 -15.223 21.014 21.449 1.00 0.00 C ATOM 1754 C ASP A 112 -14.900 21.937 20.287 1.00 0.00 C ATOM 1755 O ASP A 112 -13.727 22.120 19.959 1.00 0.00 O ATOM 1756 CB ASP A 112 -15.073 21.778 22.753 1.00 0.00 C ATOM 1757 CG ASP A 112 -16.178 22.777 23.010 1.00 0.00 C ATOM 1758 OD1 ASP A 112 -17.212 22.387 23.591 1.00 0.00 O ATOM 1759 OD2 ASP A 112 -16.004 23.963 22.660 1.00 0.00 O ATOM 0 H ASP A 112 -13.320 20.185 21.618 1.00 0.00 H new ATOM 0 HA ASP A 112 -16.243 20.645 21.343 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -15.041 21.066 23.578 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -14.117 22.302 22.747 1.00 0.00 H new ATOM 1764 N GLU A 113 -15.929 22.525 19.689 1.00 0.00 N ATOM 1765 CA GLU A 113 -15.768 23.346 18.490 1.00 0.00 C ATOM 1766 C GLU A 113 -14.935 22.628 17.432 1.00 0.00 C ATOM 1767 O GLU A 113 -13.809 23.033 17.135 1.00 0.00 O ATOM 1768 CB GLU A 113 -15.110 24.689 18.809 1.00 0.00 C ATOM 1769 CG GLU A 113 -16.000 25.671 19.547 1.00 0.00 C ATOM 1770 CD GLU A 113 -15.428 27.076 19.528 1.00 0.00 C ATOM 1771 OE1 GLU A 113 -14.883 27.487 18.476 1.00 0.00 O ATOM 1772 OE2 GLU A 113 -15.533 27.783 20.548 1.00 0.00 O ATOM 0 H GLU A 113 -16.892 22.449 20.016 1.00 0.00 H new ATOM 0 HA GLU A 113 -16.771 23.524 18.102 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -14.217 24.508 19.408 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -14.781 25.148 17.877 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -16.991 25.676 19.092 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -16.125 25.343 20.579 1.00 0.00 H new ATOM 1779 N GLN A 114 -15.471 21.559 16.873 1.00 0.00 N ATOM 1780 CA GLN A 114 -14.756 20.824 15.849 1.00 0.00 C ATOM 1781 C GLN A 114 -15.091 21.404 14.486 1.00 0.00 C ATOM 1782 O GLN A 114 -16.068 21.019 13.843 1.00 0.00 O ATOM 1783 CB GLN A 114 -15.093 19.340 15.911 1.00 0.00 C ATOM 1784 CG GLN A 114 -14.944 18.742 17.300 1.00 0.00 C ATOM 1785 CD GLN A 114 -13.518 18.752 17.827 1.00 0.00 C ATOM 1786 OE1 GLN A 114 -13.173 19.775 18.605 1.00 0.00 O flip ATOM 1787 NE2 GLN A 114 -12.742 17.835 17.565 1.00 0.00 N flip ATOM 0 H GLN A 114 -16.390 21.184 17.108 1.00 0.00 H new ATOM 0 HA GLN A 114 -13.684 20.922 16.021 1.00 0.00 H new ATOM 0 HB2 GLN A 114 -16.118 19.194 15.569 1.00 0.00 H new ATOM 0 HB3 GLN A 114 -14.446 18.799 15.220 1.00 0.00 H new ATOM 0 HG2 GLN A 114 -15.580 19.294 17.992 1.00 0.00 H new ATOM 0 HG3 GLN A 114 -15.307 17.714 17.283 1.00 0.00 H new ATOM 0 HE21 GLN A 114 -13.043 17.068 16.964 1.00 0.00 H new ATOM 0 HE22 GLN A 114 -11.797 17.842 17.948 1.00 0.00 H new ATOM 1796 N LYS A 115 -14.296 22.382 14.095 1.00 0.00 N ATOM 1797 CA LYS A 115 -14.503 23.117 12.853 1.00 0.00 C ATOM 1798 C LYS A 115 -14.034 22.342 11.643 1.00 0.00 C ATOM 1799 O LYS A 115 -13.243 21.404 11.762 1.00 0.00 O ATOM 1800 CB LYS A 115 -13.793 24.475 12.920 1.00 0.00 C ATOM 1801 CG LYS A 115 -14.615 25.568 13.586 1.00 0.00 C ATOM 1802 CD LYS A 115 -15.049 25.192 14.996 1.00 0.00 C ATOM 1803 CE LYS A 115 -16.048 26.189 15.558 1.00 0.00 C ATOM 1804 NZ LYS A 115 -15.421 27.501 15.864 1.00 0.00 N ATOM 0 H LYS A 115 -13.485 22.693 14.629 1.00 0.00 H new ATOM 0 HA LYS A 115 -15.576 23.271 12.742 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -12.855 24.357 13.463 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -13.538 24.791 11.908 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -14.030 26.487 13.622 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -15.497 25.775 12.980 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -15.493 24.197 14.987 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -14.175 25.146 15.646 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -16.857 26.333 14.842 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -16.494 25.781 16.465 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -15.426 27.657 16.892 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -14.440 27.506 15.518 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -15.957 28.260 15.396 1.00 0.00 H new ATOM 1818 N GLY A 116 -14.543 22.749 10.481 1.00 0.00 N ATOM 1819 CA GLY A 116 -14.161 22.142 9.222 1.00 0.00 C ATOM 1820 C GLY A 116 -12.740 22.483 8.834 1.00 0.00 C ATOM 1821 O GLY A 116 -12.496 23.156 7.831 1.00 0.00 O ATOM 0 H GLY A 116 -15.225 23.502 10.393 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -14.266 21.060 9.295 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -14.841 22.476 8.438 1.00 0.00 H new ATOM 1825 N LYS A 117 -11.814 22.060 9.673 1.00 0.00 N ATOM 1826 CA LYS A 117 -10.387 22.154 9.386 1.00 0.00 C ATOM 1827 C LYS A 117 -10.027 21.380 8.122 1.00 0.00 C ATOM 1828 O LYS A 117 -10.872 20.728 7.508 1.00 0.00 O ATOM 1829 CB LYS A 117 -9.575 21.572 10.548 1.00 0.00 C ATOM 1830 CG LYS A 117 -9.618 22.382 11.828 1.00 0.00 C ATOM 1831 CD LYS A 117 -8.859 23.687 11.686 1.00 0.00 C ATOM 1832 CE LYS A 117 -8.496 24.255 13.046 1.00 0.00 C ATOM 1833 NZ LYS A 117 -7.473 23.419 13.730 1.00 0.00 N ATOM 0 H LYS A 117 -12.026 21.639 10.578 1.00 0.00 H new ATOM 0 HA LYS A 117 -10.152 23.209 9.246 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -9.940 20.567 10.759 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -8.536 21.474 10.232 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -10.655 22.590 12.094 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -9.191 21.798 12.644 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -7.953 23.523 11.103 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -9.466 24.407 11.137 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -8.118 25.271 12.928 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -9.390 24.317 13.666 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -7.772 23.236 14.709 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -7.369 22.516 13.225 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -6.562 23.920 13.734 1.00 0.00 H new ATOM 1847 N ASP A 118 -8.764 21.460 7.736 1.00 0.00 N ATOM 1848 CA ASP A 118 -8.230 20.574 6.717 1.00 0.00 C ATOM 1849 C ASP A 118 -7.848 19.269 7.404 1.00 0.00 C ATOM 1850 O ASP A 118 -8.177 19.076 8.576 1.00 0.00 O ATOM 1851 CB ASP A 118 -7.006 21.203 6.038 1.00 0.00 C ATOM 1852 CG ASP A 118 -6.829 20.759 4.597 1.00 0.00 C ATOM 1853 OD1 ASP A 118 -6.639 19.549 4.349 1.00 0.00 O ATOM 1854 OD2 ASP A 118 -6.864 21.630 3.703 1.00 0.00 O ATOM 0 H ASP A 118 -8.091 22.128 8.112 1.00 0.00 H new ATOM 0 HA ASP A 118 -8.974 20.395 5.941 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -7.099 22.289 6.068 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -6.111 20.944 6.604 1.00 0.00 H new ATOM 1859 N LYS A 119 -7.157 18.385 6.710 1.00 0.00 N ATOM 1860 CA LYS A 119 -6.709 17.145 7.326 1.00 0.00 C ATOM 1861 C LYS A 119 -5.725 17.461 8.438 1.00 0.00 C ATOM 1862 O LYS A 119 -4.644 17.975 8.188 1.00 0.00 O ATOM 1863 CB LYS A 119 -6.065 16.213 6.298 1.00 0.00 C ATOM 1864 CG LYS A 119 -7.059 15.401 5.476 1.00 0.00 C ATOM 1865 CD LYS A 119 -8.047 16.287 4.736 1.00 0.00 C ATOM 1866 CE LYS A 119 -8.882 15.491 3.750 1.00 0.00 C ATOM 1867 NZ LYS A 119 -9.804 14.547 4.432 1.00 0.00 N ATOM 0 H LYS A 119 -6.895 18.497 5.731 1.00 0.00 H new ATOM 0 HA LYS A 119 -7.577 16.631 7.740 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -5.452 16.807 5.621 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -5.395 15.527 6.817 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -6.517 14.785 4.758 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -7.603 14.722 6.133 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -8.703 16.780 5.454 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -7.507 17.072 4.206 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -9.459 16.176 3.129 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -8.223 14.935 3.083 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -9.937 13.703 3.840 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -9.399 14.267 5.348 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -10.723 15.010 4.586 1.00 0.00 H new ATOM 1881 N GLN A 120 -6.114 17.198 9.669 1.00 0.00 N ATOM 1882 CA GLN A 120 -5.241 17.478 10.794 1.00 0.00 C ATOM 1883 C GLN A 120 -4.870 16.201 11.534 1.00 0.00 C ATOM 1884 O GLN A 120 -5.727 15.367 11.845 1.00 0.00 O ATOM 1885 CB GLN A 120 -5.869 18.502 11.752 1.00 0.00 C ATOM 1886 CG GLN A 120 -7.178 18.062 12.394 1.00 0.00 C ATOM 1887 CD GLN A 120 -7.732 19.099 13.358 1.00 0.00 C ATOM 1888 OE1 GLN A 120 -7.534 20.305 13.178 1.00 0.00 O ATOM 1889 NE2 GLN A 120 -8.413 18.642 14.396 1.00 0.00 N ATOM 0 H GLN A 120 -7.018 16.795 9.916 1.00 0.00 H new ATOM 0 HA GLN A 120 -4.326 17.915 10.394 1.00 0.00 H new ATOM 0 HB2 GLN A 120 -5.152 18.726 12.541 1.00 0.00 H new ATOM 0 HB3 GLN A 120 -6.043 19.429 11.206 1.00 0.00 H new ATOM 0 HG2 GLN A 120 -7.914 17.866 11.614 1.00 0.00 H new ATOM 0 HG3 GLN A 120 -7.021 17.124 12.926 1.00 0.00 H new ATOM 0 HE21 GLN A 120 -8.556 17.639 14.511 1.00 0.00 H new ATOM 0 HE22 GLN A 120 -8.795 19.293 15.082 1.00 0.00 H new ATOM 1898 N LEU A 121 -3.582 16.049 11.795 1.00 0.00 N ATOM 1899 CA LEU A 121 -3.091 14.924 12.561 1.00 0.00 C ATOM 1900 C LEU A 121 -3.172 15.258 14.032 1.00 0.00 C ATOM 1901 O LEU A 121 -2.596 16.248 14.482 1.00 0.00 O ATOM 1902 CB LEU A 121 -1.641 14.583 12.197 1.00 0.00 C ATOM 1903 CG LEU A 121 -1.420 14.028 10.790 1.00 0.00 C ATOM 1904 CD1 LEU A 121 0.049 13.694 10.586 1.00 0.00 C ATOM 1905 CD2 LEU A 121 -2.280 12.795 10.552 1.00 0.00 C ATOM 0 H LEU A 121 -2.857 16.696 11.484 1.00 0.00 H new ATOM 0 HA LEU A 121 -3.709 14.056 12.330 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -1.037 15.483 12.311 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -1.267 13.855 12.917 1.00 0.00 H new ATOM 0 HG LEU A 121 -1.714 14.791 10.069 1.00 0.00 H new ATOM 0 HD11 LEU A 121 0.196 13.299 9.581 1.00 0.00 H new ATOM 0 HD12 LEU A 121 0.648 14.596 10.713 1.00 0.00 H new ATOM 0 HD13 LEU A 121 0.357 12.947 11.318 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -2.105 12.418 9.544 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -2.020 12.024 11.278 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -3.332 13.058 10.664 1.00 0.00 H new ATOM 1917 N THR A 122 -3.903 14.457 14.770 1.00 0.00 N ATOM 1918 CA THR A 122 -4.036 14.665 16.189 1.00 0.00 C ATOM 1919 C THR A 122 -3.159 13.672 16.935 1.00 0.00 C ATOM 1920 O THR A 122 -3.546 12.523 17.149 1.00 0.00 O ATOM 1921 CB THR A 122 -5.505 14.519 16.628 1.00 0.00 C ATOM 1922 OG1 THR A 122 -6.332 15.324 15.777 1.00 0.00 O ATOM 1923 CG2 THR A 122 -5.691 14.947 18.075 1.00 0.00 C ATOM 0 H THR A 122 -4.416 13.653 14.408 1.00 0.00 H new ATOM 0 HA THR A 122 -3.713 15.678 16.427 1.00 0.00 H new ATOM 0 HB THR A 122 -5.790 13.470 16.546 1.00 0.00 H new ATOM 0 HG1 THR A 122 -7.269 15.234 16.051 1.00 0.00 H new ATOM 0 HG21 THR A 122 -6.738 14.833 18.356 1.00 0.00 H new ATOM 0 HG22 THR A 122 -5.072 14.325 18.721 1.00 0.00 H new ATOM 0 HG23 THR A 122 -5.397 15.991 18.186 1.00 0.00 H new ATOM 1931 N LEU A 123 -1.953 14.104 17.278 1.00 0.00 N ATOM 1932 CA LEU A 123 -1.018 13.245 17.984 1.00 0.00 C ATOM 1933 C LEU A 123 -1.305 13.283 19.476 1.00 0.00 C ATOM 1934 O LEU A 123 -0.938 14.235 20.165 1.00 0.00 O ATOM 1935 CB LEU A 123 0.432 13.669 17.716 1.00 0.00 C ATOM 1936 CG LEU A 123 0.831 13.795 16.240 1.00 0.00 C ATOM 1937 CD1 LEU A 123 2.333 13.984 16.117 1.00 0.00 C ATOM 1938 CD2 LEU A 123 0.378 12.579 15.447 1.00 0.00 C ATOM 0 H LEU A 123 -1.602 15.041 17.079 1.00 0.00 H new ATOM 0 HA LEU A 123 -1.146 12.226 17.618 1.00 0.00 H new ATOM 0 HB2 LEU A 123 0.605 14.629 18.202 1.00 0.00 H new ATOM 0 HB3 LEU A 123 1.095 12.946 18.191 1.00 0.00 H new ATOM 0 HG LEU A 123 0.333 14.671 15.824 1.00 0.00 H new ATOM 0 HD11 LEU A 123 2.604 14.072 15.065 1.00 0.00 H new ATOM 0 HD12 LEU A 123 2.630 14.890 16.645 1.00 0.00 H new ATOM 0 HD13 LEU A 123 2.845 13.126 16.553 1.00 0.00 H new ATOM 0 HD21 LEU A 123 0.673 12.694 14.404 1.00 0.00 H new ATOM 0 HD22 LEU A 123 0.842 11.683 15.859 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -0.706 12.488 15.509 1.00 0.00 H new ATOM 1950 N ILE A 124 -1.990 12.263 19.960 1.00 0.00 N ATOM 1951 CA ILE A 124 -2.346 12.185 21.364 1.00 0.00 C ATOM 1952 C ILE A 124 -1.255 11.453 22.131 1.00 0.00 C ATOM 1953 O ILE A 124 -1.246 10.226 22.208 1.00 0.00 O ATOM 1954 CB ILE A 124 -3.690 11.457 21.564 1.00 0.00 C ATOM 1955 CG1 ILE A 124 -4.747 12.023 20.612 1.00 0.00 C ATOM 1956 CG2 ILE A 124 -4.151 11.591 23.010 1.00 0.00 C ATOM 1957 CD1 ILE A 124 -6.036 11.233 20.601 1.00 0.00 C ATOM 0 H ILE A 124 -2.312 11.475 19.399 1.00 0.00 H new ATOM 0 HA ILE A 124 -2.449 13.202 21.742 1.00 0.00 H new ATOM 0 HB ILE A 124 -3.552 10.399 21.339 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -4.964 13.053 20.895 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -4.338 12.049 19.602 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -5.101 11.073 23.138 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -3.405 11.151 23.672 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -4.277 12.646 23.256 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -6.738 11.692 19.905 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -5.832 10.209 20.289 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -6.468 11.228 21.602 1.00 0.00 H new ATOM 1969 N THR A 125 -0.328 12.212 22.679 1.00 0.00 N ATOM 1970 CA THR A 125 0.813 11.637 23.357 1.00 0.00 C ATOM 1971 C THR A 125 0.575 11.620 24.858 1.00 0.00 C ATOM 1972 O THR A 125 0.767 12.623 25.546 1.00 0.00 O ATOM 1973 CB THR A 125 2.098 12.424 23.042 1.00 0.00 C ATOM 1974 OG1 THR A 125 2.158 12.690 21.634 1.00 0.00 O ATOM 1975 CG2 THR A 125 3.336 11.643 23.465 1.00 0.00 C ATOM 0 H THR A 125 -0.344 13.232 22.667 1.00 0.00 H new ATOM 0 HA THR A 125 0.939 10.615 22.999 1.00 0.00 H new ATOM 0 HB THR A 125 2.076 13.360 23.600 1.00 0.00 H new ATOM 0 HG1 THR A 125 2.639 13.530 21.480 1.00 0.00 H new ATOM 0 HG21 THR A 125 4.229 12.222 23.231 1.00 0.00 H new ATOM 0 HG22 THR A 125 3.298 11.453 24.538 1.00 0.00 H new ATOM 0 HG23 THR A 125 3.368 10.694 22.930 1.00 0.00 H new ATOM 1983 N CYS A 126 0.105 10.491 25.353 1.00 0.00 N ATOM 1984 CA CYS A 126 -0.140 10.339 26.770 1.00 0.00 C ATOM 1985 C CYS A 126 1.176 10.076 27.491 1.00 0.00 C ATOM 1986 O CYS A 126 1.808 9.032 27.295 1.00 0.00 O ATOM 1987 CB CYS A 126 -1.138 9.205 27.014 1.00 0.00 C ATOM 1988 SG CYS A 126 -2.647 9.338 25.996 1.00 0.00 S ATOM 0 H CYS A 126 -0.114 9.667 24.793 1.00 0.00 H new ATOM 0 HA CYS A 126 -0.573 11.258 27.165 1.00 0.00 H new ATOM 0 HB2 CYS A 126 -0.652 8.252 26.807 1.00 0.00 H new ATOM 0 HB3 CYS A 126 -1.418 9.198 28.067 1.00 0.00 H new ATOM 1993 N ASP A 127 1.600 11.041 28.294 1.00 0.00 N ATOM 1994 CA ASP A 127 2.863 10.948 29.006 1.00 0.00 C ATOM 1995 C ASP A 127 2.638 11.220 30.491 1.00 0.00 C ATOM 1996 O ASP A 127 1.509 11.493 30.910 1.00 0.00 O ATOM 1997 CB ASP A 127 3.895 11.925 28.411 1.00 0.00 C ATOM 1998 CG ASP A 127 3.990 13.244 29.159 1.00 0.00 C ATOM 1999 OD1 ASP A 127 5.059 13.515 29.748 1.00 0.00 O ATOM 2000 OD2 ASP A 127 3.007 14.011 29.173 1.00 0.00 O ATOM 0 H ASP A 127 1.083 11.903 28.468 1.00 0.00 H new ATOM 0 HA ASP A 127 3.262 9.940 28.895 1.00 0.00 H new ATOM 0 HB2 ASP A 127 4.875 11.447 28.409 1.00 0.00 H new ATOM 0 HB3 ASP A 127 3.635 12.125 27.371 1.00 0.00 H new ATOM 2005 N ASP A 128 3.711 11.135 31.272 1.00 0.00 N ATOM 2006 CA ASP A 128 3.642 11.265 32.724 1.00 0.00 C ATOM 2007 C ASP A 128 2.787 10.157 33.310 1.00 0.00 C ATOM 2008 O ASP A 128 1.593 10.329 33.564 1.00 0.00 O ATOM 2009 CB ASP A 128 3.104 12.631 33.155 1.00 0.00 C ATOM 2010 CG ASP A 128 4.087 13.385 34.020 1.00 0.00 C ATOM 2011 OD1 ASP A 128 4.368 12.934 35.149 1.00 0.00 O ATOM 2012 OD2 ASP A 128 4.586 14.440 33.575 1.00 0.00 O ATOM 0 H ASP A 128 4.653 10.974 30.916 1.00 0.00 H new ATOM 0 HA ASP A 128 4.659 11.179 33.107 1.00 0.00 H new ATOM 0 HB2 ASP A 128 2.872 13.224 32.270 1.00 0.00 H new ATOM 0 HB3 ASP A 128 2.171 12.496 33.702 1.00 0.00 H new ATOM 2017 N TYR A 129 3.403 9.008 33.486 1.00 0.00 N ATOM 2018 CA TYR A 129 2.710 7.843 33.995 1.00 0.00 C ATOM 2019 C TYR A 129 2.651 7.879 35.513 1.00 0.00 C ATOM 2020 O TYR A 129 3.673 8.028 36.183 1.00 0.00 O ATOM 2021 CB TYR A 129 3.410 6.567 33.523 1.00 0.00 C ATOM 2022 CG TYR A 129 2.681 5.295 33.889 1.00 0.00 C ATOM 2023 CD1 TYR A 129 3.070 4.545 34.988 1.00 0.00 C ATOM 2024 CD2 TYR A 129 1.607 4.844 33.133 1.00 0.00 C ATOM 2025 CE1 TYR A 129 2.415 3.379 35.324 1.00 0.00 C ATOM 2026 CE2 TYR A 129 0.943 3.679 33.462 1.00 0.00 C ATOM 2027 CZ TYR A 129 1.350 2.950 34.559 1.00 0.00 C ATOM 2028 OH TYR A 129 0.695 1.786 34.882 1.00 0.00 O ATOM 0 H TYR A 129 4.391 8.855 33.282 1.00 0.00 H new ATOM 0 HA TYR A 129 1.690 7.849 33.610 1.00 0.00 H new ATOM 0 HB2 TYR A 129 3.527 6.608 32.440 1.00 0.00 H new ATOM 0 HB3 TYR A 129 4.412 6.535 33.950 1.00 0.00 H new ATOM 0 HD1 TYR A 129 3.901 4.880 35.592 1.00 0.00 H new ATOM 0 HD2 TYR A 129 1.286 5.414 32.274 1.00 0.00 H new ATOM 0 HE1 TYR A 129 2.734 2.805 36.181 1.00 0.00 H new ATOM 0 HE2 TYR A 129 0.110 3.341 32.864 1.00 0.00 H new ATOM 0 HH TYR A 129 -0.031 1.631 34.242 1.00 0.00 H new ATOM 2038 N ASN A 130 1.451 7.754 36.045 1.00 0.00 N ATOM 2039 CA ASN A 130 1.252 7.695 37.483 1.00 0.00 C ATOM 2040 C ASN A 130 1.179 6.237 37.916 1.00 0.00 C ATOM 2041 O ASN A 130 0.151 5.578 37.746 1.00 0.00 O ATOM 2042 CB ASN A 130 -0.023 8.449 37.877 1.00 0.00 C ATOM 2043 CG ASN A 130 -0.197 8.589 39.379 1.00 0.00 C ATOM 2044 OD1 ASN A 130 0.198 7.719 40.155 1.00 0.00 O ATOM 2045 ND2 ASN A 130 -0.791 9.694 39.798 1.00 0.00 N ATOM 0 H ASN A 130 0.592 7.691 35.499 1.00 0.00 H new ATOM 0 HA ASN A 130 2.090 8.174 37.989 1.00 0.00 H new ATOM 0 HB2 ASN A 130 -0.004 9.441 37.426 1.00 0.00 H new ATOM 0 HB3 ASN A 130 -0.887 7.928 37.465 1.00 0.00 H new ATOM 0 HD21 ASN A 130 -0.936 9.848 40.796 1.00 0.00 H new ATOM 0 HD22 ASN A 130 -1.104 10.392 39.123 1.00 0.00 H new ATOM 2052 N GLU A 131 2.285 5.739 38.454 1.00 0.00 N ATOM 2053 CA GLU A 131 2.419 4.327 38.806 1.00 0.00 C ATOM 2054 C GLU A 131 1.500 3.922 39.961 1.00 0.00 C ATOM 2055 O GLU A 131 1.240 2.735 40.164 1.00 0.00 O ATOM 2056 CB GLU A 131 3.869 4.020 39.176 1.00 0.00 C ATOM 2057 CG GLU A 131 4.868 4.388 38.092 1.00 0.00 C ATOM 2058 CD GLU A 131 6.276 3.951 38.430 1.00 0.00 C ATOM 2059 OE1 GLU A 131 6.982 4.695 39.141 1.00 0.00 O ATOM 2060 OE2 GLU A 131 6.683 2.855 37.988 1.00 0.00 O ATOM 0 H GLU A 131 3.113 6.298 38.659 1.00 0.00 H new ATOM 0 HA GLU A 131 2.122 3.748 37.932 1.00 0.00 H new ATOM 0 HB2 GLU A 131 4.123 4.558 40.089 1.00 0.00 H new ATOM 0 HB3 GLU A 131 3.961 2.956 39.396 1.00 0.00 H new ATOM 0 HG2 GLU A 131 4.564 3.929 37.151 1.00 0.00 H new ATOM 0 HG3 GLU A 131 4.853 5.467 37.939 1.00 0.00 H new ATOM 2067 N LYS A 132 1.013 4.902 40.712 1.00 0.00 N ATOM 2068 CA LYS A 132 0.159 4.635 41.860 1.00 0.00 C ATOM 2069 C LYS A 132 -1.250 4.228 41.446 1.00 0.00 C ATOM 2070 O LYS A 132 -1.935 3.502 42.169 1.00 0.00 O ATOM 2071 CB LYS A 132 0.108 5.845 42.766 1.00 0.00 C ATOM 2072 CG LYS A 132 1.010 5.691 43.971 1.00 0.00 C ATOM 2073 CD LYS A 132 0.831 6.843 44.922 1.00 0.00 C ATOM 2074 CE LYS A 132 1.546 6.597 46.242 1.00 0.00 C ATOM 2075 NZ LYS A 132 0.869 5.547 47.047 1.00 0.00 N ATOM 0 H LYS A 132 1.196 5.891 40.545 1.00 0.00 H new ATOM 0 HA LYS A 132 0.595 3.795 42.401 1.00 0.00 H new ATOM 0 HB2 LYS A 132 0.403 6.731 42.204 1.00 0.00 H new ATOM 0 HB3 LYS A 132 -0.917 6.005 43.099 1.00 0.00 H new ATOM 0 HG2 LYS A 132 0.786 4.754 44.481 1.00 0.00 H new ATOM 0 HG3 LYS A 132 2.050 5.638 43.648 1.00 0.00 H new ATOM 0 HD2 LYS A 132 1.214 7.755 44.465 1.00 0.00 H new ATOM 0 HD3 LYS A 132 -0.232 7.001 45.107 1.00 0.00 H new ATOM 0 HE2 LYS A 132 2.576 6.299 46.048 1.00 0.00 H new ATOM 0 HE3 LYS A 132 1.585 7.525 46.813 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 1.243 5.559 48.017 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 -0.154 5.731 47.068 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 1.044 4.615 46.620 1.00 0.00 H new ATOM 2089 N THR A 133 -1.682 4.680 40.283 1.00 0.00 N ATOM 2090 CA THR A 133 -3.032 4.394 39.826 1.00 0.00 C ATOM 2091 C THR A 133 -3.020 3.725 38.451 1.00 0.00 C ATOM 2092 O THR A 133 -3.980 3.057 38.067 1.00 0.00 O ATOM 2093 CB THR A 133 -3.890 5.678 39.806 1.00 0.00 C ATOM 2094 OG1 THR A 133 -5.216 5.396 39.343 1.00 0.00 O ATOM 2095 CG2 THR A 133 -3.251 6.738 38.934 1.00 0.00 C ATOM 0 H THR A 133 -1.124 5.243 39.641 1.00 0.00 H new ATOM 0 HA THR A 133 -3.482 3.696 40.532 1.00 0.00 H new ATOM 0 HB THR A 133 -3.950 6.056 40.827 1.00 0.00 H new ATOM 0 HG1 THR A 133 -5.744 6.222 39.339 1.00 0.00 H new ATOM 0 HG21 THR A 133 -3.873 7.633 38.935 1.00 0.00 H new ATOM 0 HG22 THR A 133 -2.263 6.982 39.323 1.00 0.00 H new ATOM 0 HG23 THR A 133 -3.157 6.363 37.915 1.00 0.00 H new ATOM 2103 N GLY A 134 -1.921 3.882 37.725 1.00 0.00 N ATOM 2104 CA GLY A 134 -1.793 3.241 36.434 1.00 0.00 C ATOM 2105 C GLY A 134 -2.465 4.026 35.327 1.00 0.00 C ATOM 2106 O GLY A 134 -3.190 3.458 34.507 1.00 0.00 O ATOM 0 H GLY A 134 -1.117 4.442 38.008 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -0.736 3.117 36.197 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -2.228 2.243 36.483 1.00 0.00 H new ATOM 2110 N VAL A 135 -2.224 5.330 35.298 1.00 0.00 N ATOM 2111 CA VAL A 135 -2.813 6.187 34.280 1.00 0.00 C ATOM 2112 C VAL A 135 -1.795 7.218 33.800 1.00 0.00 C ATOM 2113 O VAL A 135 -0.828 7.522 34.503 1.00 0.00 O ATOM 2114 CB VAL A 135 -4.080 6.908 34.808 1.00 0.00 C ATOM 2115 CG1 VAL A 135 -3.721 8.051 35.745 1.00 0.00 C ATOM 2116 CG2 VAL A 135 -4.949 7.405 33.661 1.00 0.00 C ATOM 0 H VAL A 135 -1.626 5.816 35.966 1.00 0.00 H new ATOM 0 HA VAL A 135 -3.106 5.552 33.444 1.00 0.00 H new ATOM 0 HB VAL A 135 -4.655 6.178 35.377 1.00 0.00 H new ATOM 0 HG11 VAL A 135 -4.633 8.534 36.096 1.00 0.00 H new ATOM 0 HG12 VAL A 135 -3.165 7.661 36.598 1.00 0.00 H new ATOM 0 HG13 VAL A 135 -3.107 8.778 35.213 1.00 0.00 H new ATOM 0 HG21 VAL A 135 -5.830 7.906 34.063 1.00 0.00 H new ATOM 0 HG22 VAL A 135 -4.380 8.106 33.050 1.00 0.00 H new ATOM 0 HG23 VAL A 135 -5.261 6.559 33.048 1.00 0.00 H new ATOM 2126 N TRP A 136 -2.002 7.727 32.596 1.00 0.00 N ATOM 2127 CA TRP A 136 -1.173 8.790 32.059 1.00 0.00 C ATOM 2128 C TRP A 136 -1.828 10.131 32.362 1.00 0.00 C ATOM 2129 O TRP A 136 -2.925 10.416 31.878 1.00 0.00 O ATOM 2130 CB TRP A 136 -0.989 8.600 30.551 1.00 0.00 C ATOM 2131 CG TRP A 136 -0.329 7.300 30.197 1.00 0.00 C ATOM 2132 CD1 TRP A 136 -0.940 6.099 29.965 1.00 0.00 C ATOM 2133 CD2 TRP A 136 1.075 7.068 30.049 1.00 0.00 C ATOM 2134 NE1 TRP A 136 0.000 5.140 29.674 1.00 0.00 N ATOM 2135 CE2 TRP A 136 1.244 5.712 29.719 1.00 0.00 C ATOM 2136 CE3 TRP A 136 2.204 7.878 30.161 1.00 0.00 C ATOM 2137 CZ2 TRP A 136 2.498 5.150 29.500 1.00 0.00 C ATOM 2138 CZ3 TRP A 136 3.448 7.322 29.940 1.00 0.00 C ATOM 2139 CH2 TRP A 136 3.588 5.968 29.615 1.00 0.00 C ATOM 0 H TRP A 136 -2.744 7.417 31.969 1.00 0.00 H new ATOM 0 HA TRP A 136 -0.188 8.763 32.524 1.00 0.00 H new ATOM 0 HB2 TRP A 136 -1.962 8.651 30.063 1.00 0.00 H new ATOM 0 HB3 TRP A 136 -0.392 9.423 30.158 1.00 0.00 H new ATOM 0 HD1 TRP A 136 -2.006 5.929 30.005 1.00 0.00 H new ATOM 0 HE1 TRP A 136 -0.196 4.162 29.460 1.00 0.00 H new ATOM 0 HE3 TRP A 136 2.107 8.923 30.416 1.00 0.00 H new ATOM 0 HZ2 TRP A 136 2.607 4.105 29.248 1.00 0.00 H new ATOM 0 HZ3 TRP A 136 4.328 7.943 30.019 1.00 0.00 H new ATOM 0 HH2 TRP A 136 4.575 5.561 29.452 1.00 0.00 H new ATOM 2150 N GLU A 137 -1.163 10.939 33.175 1.00 0.00 N ATOM 2151 CA GLU A 137 -1.771 12.150 33.711 1.00 0.00 C ATOM 2152 C GLU A 137 -1.842 13.271 32.678 1.00 0.00 C ATOM 2153 O GLU A 137 -2.844 13.985 32.601 1.00 0.00 O ATOM 2154 CB GLU A 137 -1.007 12.620 34.947 1.00 0.00 C ATOM 2155 CG GLU A 137 -0.981 11.588 36.061 1.00 0.00 C ATOM 2156 CD GLU A 137 -0.267 12.083 37.298 1.00 0.00 C ATOM 2157 OE1 GLU A 137 -0.947 12.571 38.226 1.00 0.00 O ATOM 2158 OE2 GLU A 137 0.972 11.985 37.356 1.00 0.00 O ATOM 0 H GLU A 137 -0.202 10.779 33.478 1.00 0.00 H new ATOM 0 HA GLU A 137 -2.796 11.901 33.988 1.00 0.00 H new ATOM 0 HB2 GLU A 137 0.016 12.864 34.663 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -1.462 13.537 35.321 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -2.004 11.315 36.322 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -0.491 10.683 35.701 1.00 0.00 H new ATOM 2165 N LYS A 138 -0.798 13.429 31.881 1.00 0.00 N ATOM 2166 CA LYS A 138 -0.774 14.505 30.906 1.00 0.00 C ATOM 2167 C LYS A 138 -1.033 13.964 29.513 1.00 0.00 C ATOM 2168 O LYS A 138 -0.374 13.026 29.062 1.00 0.00 O ATOM 2169 CB LYS A 138 0.559 15.258 30.923 1.00 0.00 C ATOM 2170 CG LYS A 138 1.024 15.673 32.312 1.00 0.00 C ATOM 2171 CD LYS A 138 1.942 16.892 32.271 1.00 0.00 C ATOM 2172 CE LYS A 138 3.016 16.787 31.192 1.00 0.00 C ATOM 2173 NZ LYS A 138 3.809 15.536 31.290 1.00 0.00 N ATOM 0 H LYS A 138 0.032 12.836 31.889 1.00 0.00 H new ATOM 0 HA LYS A 138 -1.564 15.205 31.179 1.00 0.00 H new ATOM 0 HB2 LYS A 138 1.325 14.629 30.469 1.00 0.00 H new ATOM 0 HB3 LYS A 138 0.468 16.149 30.301 1.00 0.00 H new ATOM 0 HG2 LYS A 138 0.156 15.894 32.933 1.00 0.00 H new ATOM 0 HG3 LYS A 138 1.548 14.841 32.782 1.00 0.00 H new ATOM 0 HD2 LYS A 138 1.344 17.786 32.096 1.00 0.00 H new ATOM 0 HD3 LYS A 138 2.420 17.014 33.243 1.00 0.00 H new ATOM 0 HE2 LYS A 138 2.545 16.837 30.210 1.00 0.00 H new ATOM 0 HE3 LYS A 138 3.686 17.643 31.268 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 4.749 15.687 30.872 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 3.913 15.269 32.290 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 3.321 14.774 30.777 1.00 0.00 H new ATOM 2187 N ARG A 139 -2.003 14.544 28.836 1.00 0.00 N ATOM 2188 CA ARG A 139 -2.280 14.173 27.465 1.00 0.00 C ATOM 2189 C ARG A 139 -1.738 15.244 26.535 1.00 0.00 C ATOM 2190 O ARG A 139 -2.426 16.217 26.224 1.00 0.00 O ATOM 2191 CB ARG A 139 -3.780 13.977 27.242 1.00 0.00 C ATOM 2192 CG ARG A 139 -4.394 12.898 28.125 1.00 0.00 C ATOM 2193 CD ARG A 139 -5.889 12.768 27.888 1.00 0.00 C ATOM 2194 NE ARG A 139 -6.492 11.726 28.722 1.00 0.00 N ATOM 2195 CZ ARG A 139 -7.531 10.978 28.344 1.00 0.00 C ATOM 2196 NH1 ARG A 139 -8.097 11.172 27.159 1.00 0.00 N ATOM 2197 NH2 ARG A 139 -8.022 10.051 29.158 1.00 0.00 N ATOM 0 H ARG A 139 -2.611 15.272 29.212 1.00 0.00 H new ATOM 0 HA ARG A 139 -1.788 13.225 27.250 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -4.292 14.921 27.427 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -3.953 13.721 26.197 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -3.909 11.943 27.925 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -4.210 13.136 29.173 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -6.373 13.723 28.096 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -6.070 12.541 26.838 1.00 0.00 H new ATOM 0 HE ARG A 139 -6.094 11.562 29.647 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -7.738 11.894 26.534 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -8.891 10.599 26.873 1.00 0.00 H new ATOM 0 HH21 ARG A 139 -7.605 9.907 30.078 1.00 0.00 H new ATOM 0 HH22 ARG A 139 -8.816 9.483 28.864 1.00 0.00 H new ATOM 2211 N LYS A 140 -0.484 15.087 26.138 1.00 0.00 N ATOM 2212 CA LYS A 140 0.154 16.038 25.246 1.00 0.00 C ATOM 2213 C LYS A 140 -0.433 15.887 23.852 1.00 0.00 C ATOM 2214 O LYS A 140 -0.409 14.802 23.277 1.00 0.00 O ATOM 2215 CB LYS A 140 1.666 15.809 25.214 1.00 0.00 C ATOM 2216 CG LYS A 140 2.443 16.934 24.550 1.00 0.00 C ATOM 2217 CD LYS A 140 2.357 18.215 25.360 1.00 0.00 C ATOM 2218 CE LYS A 140 3.162 19.343 24.736 1.00 0.00 C ATOM 2219 NZ LYS A 140 3.104 20.580 25.563 1.00 0.00 N ATOM 0 H LYS A 140 0.111 14.308 26.421 1.00 0.00 H new ATOM 0 HA LYS A 140 -0.028 17.050 25.608 1.00 0.00 H new ATOM 0 HB2 LYS A 140 2.027 15.684 26.235 1.00 0.00 H new ATOM 0 HB3 LYS A 140 1.872 14.877 24.687 1.00 0.00 H new ATOM 0 HG2 LYS A 140 3.487 16.641 24.438 1.00 0.00 H new ATOM 0 HG3 LYS A 140 2.051 17.108 23.548 1.00 0.00 H new ATOM 0 HD2 LYS A 140 1.314 18.519 25.446 1.00 0.00 H new ATOM 0 HD3 LYS A 140 2.719 18.029 26.371 1.00 0.00 H new ATOM 0 HE2 LYS A 140 4.200 19.030 24.621 1.00 0.00 H new ATOM 0 HE3 LYS A 140 2.780 19.554 23.737 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 2.785 21.376 24.975 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 2.437 20.441 26.349 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 4.049 20.788 25.944 1.00 0.00 H new ATOM 2233 N ILE A 141 -0.966 16.964 23.311 1.00 0.00 N ATOM 2234 CA ILE A 141 -1.661 16.889 22.044 1.00 0.00 C ATOM 2235 C ILE A 141 -1.013 17.804 21.009 1.00 0.00 C ATOM 2236 O ILE A 141 -0.823 19.005 21.228 1.00 0.00 O ATOM 2237 CB ILE A 141 -3.166 17.217 22.200 1.00 0.00 C ATOM 2238 CG1 ILE A 141 -3.913 16.956 20.890 1.00 0.00 C ATOM 2239 CG2 ILE A 141 -3.369 18.652 22.659 1.00 0.00 C ATOM 2240 CD1 ILE A 141 -5.401 17.226 20.972 1.00 0.00 C ATOM 0 H ILE A 141 -0.931 17.895 23.726 1.00 0.00 H new ATOM 0 HA ILE A 141 -1.581 15.861 21.689 1.00 0.00 H new ATOM 0 HB ILE A 141 -3.576 16.560 22.967 1.00 0.00 H new ATOM 0 HG12 ILE A 141 -3.482 17.579 20.106 1.00 0.00 H new ATOM 0 HG13 ILE A 141 -3.757 15.919 20.594 1.00 0.00 H new ATOM 0 HG21 ILE A 141 -4.435 18.854 22.760 1.00 0.00 H new ATOM 0 HG22 ILE A 141 -2.879 18.799 23.621 1.00 0.00 H new ATOM 0 HG23 ILE A 141 -2.938 19.333 21.925 1.00 0.00 H new ATOM 0 HD11 ILE A 141 -5.862 17.019 20.006 1.00 0.00 H new ATOM 0 HD12 ILE A 141 -5.846 16.584 21.732 1.00 0.00 H new ATOM 0 HD13 ILE A 141 -5.567 18.270 21.237 1.00 0.00 H new ATOM 2252 N PHE A 142 -0.636 17.208 19.899 1.00 0.00 N ATOM 2253 CA PHE A 142 -0.059 17.941 18.789 1.00 0.00 C ATOM 2254 C PHE A 142 -0.996 17.886 17.591 1.00 0.00 C ATOM 2255 O PHE A 142 -1.158 16.832 16.970 1.00 0.00 O ATOM 2256 CB PHE A 142 1.302 17.351 18.401 1.00 0.00 C ATOM 2257 CG PHE A 142 2.433 17.697 19.331 1.00 0.00 C ATOM 2258 CD1 PHE A 142 2.470 17.209 20.628 1.00 0.00 C ATOM 2259 CD2 PHE A 142 3.475 18.499 18.893 1.00 0.00 C ATOM 2260 CE1 PHE A 142 3.519 17.519 21.468 1.00 0.00 C ATOM 2261 CE2 PHE A 142 4.526 18.813 19.732 1.00 0.00 C ATOM 2262 CZ PHE A 142 4.549 18.321 21.020 1.00 0.00 C ATOM 0 H PHE A 142 -0.720 16.204 19.739 1.00 0.00 H new ATOM 0 HA PHE A 142 0.082 18.977 19.096 1.00 0.00 H new ATOM 0 HB2 PHE A 142 1.210 16.266 18.353 1.00 0.00 H new ATOM 0 HB3 PHE A 142 1.558 17.694 17.399 1.00 0.00 H new ATOM 0 HD1 PHE A 142 1.668 16.579 20.985 1.00 0.00 H new ATOM 0 HD2 PHE A 142 3.465 18.883 17.884 1.00 0.00 H new ATOM 0 HE1 PHE A 142 3.534 17.134 22.477 1.00 0.00 H new ATOM 0 HE2 PHE A 142 5.329 19.443 19.380 1.00 0.00 H new ATOM 0 HZ PHE A 142 5.371 18.563 21.677 1.00 0.00 H new ATOM 2272 N VAL A 143 -1.634 19.004 17.282 1.00 0.00 N ATOM 2273 CA VAL A 143 -2.520 19.069 16.133 1.00 0.00 C ATOM 2274 C VAL A 143 -1.804 19.711 14.958 1.00 0.00 C ATOM 2275 O VAL A 143 -1.565 20.925 14.933 1.00 0.00 O ATOM 2276 CB VAL A 143 -3.809 19.855 16.433 1.00 0.00 C ATOM 2277 CG1 VAL A 143 -4.713 19.891 15.211 1.00 0.00 C ATOM 2278 CG2 VAL A 143 -4.544 19.259 17.623 1.00 0.00 C ATOM 0 H VAL A 143 -1.555 19.874 17.808 1.00 0.00 H new ATOM 0 HA VAL A 143 -2.801 18.045 15.888 1.00 0.00 H new ATOM 0 HB VAL A 143 -3.529 20.878 16.684 1.00 0.00 H new ATOM 0 HG11 VAL A 143 -5.618 20.451 15.445 1.00 0.00 H new ATOM 0 HG12 VAL A 143 -4.190 20.374 14.386 1.00 0.00 H new ATOM 0 HG13 VAL A 143 -4.980 18.873 14.926 1.00 0.00 H new ATOM 0 HG21 VAL A 143 -5.451 19.832 17.815 1.00 0.00 H new ATOM 0 HG22 VAL A 143 -4.808 18.224 17.406 1.00 0.00 H new ATOM 0 HG23 VAL A 143 -3.901 19.293 18.502 1.00 0.00 H new ATOM 2288 N ALA A 144 -1.445 18.884 14.000 1.00 0.00 N ATOM 2289 CA ALA A 144 -0.778 19.354 12.804 1.00 0.00 C ATOM 2290 C ALA A 144 -1.744 19.365 11.633 1.00 0.00 C ATOM 2291 O ALA A 144 -2.193 18.317 11.178 1.00 0.00 O ATOM 2292 CB ALA A 144 0.432 18.489 12.497 1.00 0.00 C ATOM 0 H ALA A 144 -1.605 17.877 14.026 1.00 0.00 H new ATOM 0 HA ALA A 144 -0.433 20.374 12.974 1.00 0.00 H new ATOM 0 HB1 ALA A 144 0.922 18.856 11.595 1.00 0.00 H new ATOM 0 HB2 ALA A 144 1.131 18.531 13.332 1.00 0.00 H new ATOM 0 HB3 ALA A 144 0.113 17.458 12.343 1.00 0.00 H new ATOM 2298 N THR A 145 -2.079 20.552 11.162 1.00 0.00 N ATOM 2299 CA THR A 145 -3.016 20.692 10.061 1.00 0.00 C ATOM 2300 C THR A 145 -2.275 20.606 8.727 1.00 0.00 C ATOM 2301 O THR A 145 -1.166 21.135 8.590 1.00 0.00 O ATOM 2302 CB THR A 145 -3.788 22.024 10.165 1.00 0.00 C ATOM 2303 OG1 THR A 145 -4.199 22.232 11.525 1.00 0.00 O ATOM 2304 CG2 THR A 145 -5.019 22.019 9.267 1.00 0.00 C ATOM 0 H THR A 145 -1.716 21.434 11.524 1.00 0.00 H new ATOM 0 HA THR A 145 -3.738 19.877 10.115 1.00 0.00 H new ATOM 0 HB THR A 145 -3.127 22.828 9.842 1.00 0.00 H new ATOM 0 HG1 THR A 145 -4.688 23.079 11.593 1.00 0.00 H new ATOM 0 HG21 THR A 145 -5.542 22.970 9.362 1.00 0.00 H new ATOM 0 HG22 THR A 145 -4.713 21.875 8.231 1.00 0.00 H new ATOM 0 HG23 THR A 145 -5.684 21.208 9.565 1.00 0.00 H new ATOM 2312 N GLU A 146 -2.880 19.913 7.772 1.00 0.00 N ATOM 2313 CA GLU A 146 -2.267 19.654 6.477 1.00 0.00 C ATOM 2314 C GLU A 146 -1.990 20.949 5.728 1.00 0.00 C ATOM 2315 O GLU A 146 -2.903 21.707 5.395 1.00 0.00 O ATOM 2316 CB GLU A 146 -3.169 18.737 5.646 1.00 0.00 C ATOM 2317 CG GLU A 146 -2.463 18.094 4.468 1.00 0.00 C ATOM 2318 CD GLU A 146 -3.313 17.051 3.771 1.00 0.00 C ATOM 2319 OE1 GLU A 146 -3.819 17.332 2.666 1.00 0.00 O ATOM 2320 OE2 GLU A 146 -3.472 15.943 4.319 1.00 0.00 O ATOM 0 H GLU A 146 -3.813 19.513 7.874 1.00 0.00 H new ATOM 0 HA GLU A 146 -1.311 19.157 6.645 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -3.569 17.954 6.290 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -4.019 19.313 5.279 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -2.184 18.867 3.752 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -1.539 17.631 4.813 1.00 0.00 H new ATOM 2327 N VAL A 147 -0.718 21.186 5.470 1.00 0.00 N ATOM 2328 CA VAL A 147 -0.274 22.372 4.771 1.00 0.00 C ATOM 2329 C VAL A 147 0.324 21.976 3.426 1.00 0.00 C ATOM 2330 O VAL A 147 1.075 21.005 3.327 1.00 0.00 O ATOM 2331 CB VAL A 147 0.743 23.167 5.624 1.00 0.00 C ATOM 2332 CG1 VAL A 147 1.865 22.271 6.112 1.00 0.00 C ATOM 2333 CG2 VAL A 147 1.309 24.350 4.858 1.00 0.00 C ATOM 0 H VAL A 147 0.038 20.557 5.741 1.00 0.00 H new ATOM 0 HA VAL A 147 -1.130 23.024 4.596 1.00 0.00 H new ATOM 0 HB VAL A 147 0.205 23.552 6.491 1.00 0.00 H new ATOM 0 HG11 VAL A 147 2.565 22.856 6.709 1.00 0.00 H new ATOM 0 HG12 VAL A 147 1.451 21.469 6.722 1.00 0.00 H new ATOM 0 HG13 VAL A 147 2.387 21.843 5.256 1.00 0.00 H new ATOM 0 HG21 VAL A 147 2.020 24.885 5.488 1.00 0.00 H new ATOM 0 HG22 VAL A 147 1.816 23.994 3.961 1.00 0.00 H new ATOM 0 HG23 VAL A 147 0.498 25.021 4.574 1.00 0.00 H new ATOM 2343 N LYS A 148 -0.056 22.694 2.387 1.00 0.00 N ATOM 2344 CA LYS A 148 0.395 22.381 1.045 1.00 0.00 C ATOM 2345 C LYS A 148 1.751 23.022 0.757 1.00 0.00 C ATOM 2346 O LYS A 148 2.756 22.285 0.703 1.00 0.00 O ATOM 2347 CB LYS A 148 -0.663 22.813 0.023 1.00 0.00 C ATOM 2348 CG LYS A 148 -1.240 24.199 0.279 1.00 0.00 C ATOM 2349 CD LYS A 148 -2.394 24.511 -0.656 1.00 0.00 C ATOM 2350 CE LYS A 148 -3.516 23.490 -0.527 1.00 0.00 C ATOM 2351 NZ LYS A 148 -4.096 23.464 0.841 1.00 0.00 N ATOM 0 H LYS A 148 -0.678 23.500 2.447 1.00 0.00 H new ATOM 0 HA LYS A 148 0.528 21.302 0.962 1.00 0.00 H new ATOM 0 HB2 LYS A 148 -0.221 22.793 -0.973 1.00 0.00 H new ATOM 0 HB3 LYS A 148 -1.475 22.086 0.026 1.00 0.00 H new ATOM 0 HG2 LYS A 148 -1.581 24.265 1.312 1.00 0.00 H new ATOM 0 HG3 LYS A 148 -0.458 24.947 0.153 1.00 0.00 H new ATOM 0 HD2 LYS A 148 -2.781 25.506 -0.437 1.00 0.00 H new ATOM 0 HD3 LYS A 148 -2.034 24.528 -1.685 1.00 0.00 H new ATOM 0 HE2 LYS A 148 -4.300 23.721 -1.248 1.00 0.00 H new ATOM 0 HE3 LYS A 148 -3.135 22.500 -0.777 1.00 0.00 H new ATOM 0 HZ1 LYS A 148 -4.931 22.843 0.853 1.00 0.00 H new ATOM 0 HZ2 LYS A 148 -3.387 23.104 1.512 1.00 0.00 H new ATOM 0 HZ3 LYS A 148 -4.376 24.427 1.117 1.00 0.00 H new TER 2365 LYS A 148 HETATM 2366 C7 JPT A 201 -3.669 8.080 26.731 1.00 0.00 C HETATM 2367 C8 JPT A 201 -3.036 6.694 26.577 1.00 0.00 C HETATM 2368 C11 JPT A 201 -3.188 5.734 27.512 1.00 0.00 C HETATM 2369 S2 JPT A 201 -2.377 4.404 26.941 1.00 0.00 S HETATM 2370 C12 JPT A 201 -1.838 5.059 25.506 1.00 0.00 C HETATM 2371 C13 JPT A 201 -2.291 6.340 25.454 1.00 0.00 C HETATM 2372 C6 JPT A 201 -6.181 7.366 22.878 1.00 0.00 C HETATM 2373 O3 JPT A 201 -6.275 8.485 21.995 1.00 0.00 O HETATM 2374 C5 JPT A 201 -6.107 8.066 26.852 1.00 0.00 C HETATM 2375 C4 JPT A 201 -4.923 8.076 26.125 1.00 0.00 C HETATM 2376 O4 JPT A 201 -6.040 8.038 28.211 1.00 0.00 O HETATM 2377 C1 JPT A 201 -7.341 8.096 26.255 1.00 0.00 C HETATM 2378 O2 JPT A 201 -8.373 8.269 26.904 1.00 0.00 O HETATM 2379 C2 JPT A 201 -7.386 7.935 24.896 1.00 0.00 C HETATM 2380 C3 JPT A 201 -6.192 7.806 24.194 1.00 0.00 C HETATM 2381 O1 JPT A 201 -4.955 8.088 24.741 1.00 0.00 O