USER MOD reduce.3.24.130724 H: found=0, std=0, add=1047, rem=0, adj=44 USER MOD reduce.3.24.130724 removed 1047 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 119 HIS : no HD1:sc= -0.0557 K(o=1.2,f=-7.3!) USER MOD Set 1.2: A 121 THR OG1 : rot 102:sc= 1.29 USER MOD Set 2.1: A 82 SER OG : rot -96:sc= 2.21 USER MOD Set 2.2: A 93 HIS : no HE2:sc= 1.07 K(o=4.4,f=-3.9!) USER MOD Set 2.3: A 95 GLN : amide:sc= 1.09 K(o=4.4,f=2.3) USER MOD Set 3.1: A 53 THR OG1 : rot 16:sc= 2.07 USER MOD Set 3.2: A 60 THR OG1 : rot 57:sc= 1.24 USER MOD Set 4.1: A 45 ASN : amide:sc= 0.722 K(o=2.9,f=1.6) USER MOD Set 4.2: A 48 THR OG1 : rot -73:sc= 2.14 USER MOD Set 5.1: A 9 LYS NZ :NH3+ 168:sc= 1.57 (180deg=0.956) USER MOD Set 5.2: A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 VAL N :NH3+ -175:sc= 0 (180deg=-0.0123) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot 43:sc= 0.541 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 ASN : amide:sc= 1.08 K(o=1.1,f=-2.4!) USER MOD Single : A 19 TYR OH : rot 180:sc= -0.0308 USER MOD Single : A 20 MET CE :methyl 174:sc= -0.417 (180deg=-0.635) USER MOD Single : A 21 LYS NZ :NH3+ 159:sc= 1.19 (180deg=0.988) USER MOD Single : A 22 SER OG : rot 39:sc= 1.23 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0.115 USER MOD Single : A 31 GLN : amide:sc= 0.886 K(o=0.89,f=-1.4) USER MOD Single : A 34 ASN : amide:sc= -0.596 K(o=-0.6,f=-7.3!) USER MOD Single : A 35 MET CE :methyl -143:sc= 0 (180deg=-0.053) USER MOD Single : A 36 THR OG1 : rot -150:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ -169:sc= -0.0186 (180deg=-0.143) USER MOD Single : A 40 THR OG1 : rot 177:sc= 1.35 USER MOD Single : A 52 LYS NZ :NH3+ -166:sc= 1.09 (180deg=0.907) USER MOD Single : A 54 GLN : amide:sc= -0.373 K(o=-0.37,f=-1.1) USER MOD Single : A 55 SER OG : rot 84:sc= 1.12 USER MOD Single : A 56 THR OG1 : rot 8:sc= 0.402 USER MOD Single : A 58 LYS NZ :NH3+ 168:sc= 1.23 (180deg=1.22) USER MOD Single : A 59 ASN : amide:sc= 0.154 K(o=0.15,f=-1.4) USER MOD Single : A 63 SER OG : rot -93:sc= 0.0632 USER MOD Single : A 65 LYS NZ :NH3+ 145:sc= 2.2 (180deg=-0.0256) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 THR OG1 : rot -81:sc= 1.32 USER MOD Single : A 79 LYS NZ :NH3+ -143:sc= -0.15 (180deg=-1.13) USER MOD Single : A 81 LYS NZ :NH3+ -163:sc= 1.23 (180deg=1.12) USER MOD Single : A 85 THR OG1 : rot 10:sc= 0.463 USER MOD Single : A 90 LYS NZ :NH3+ -152:sc= 0 (180deg=-0.00809) USER MOD Single : A 96 LYS NZ :NH3+ 156:sc= 1.24 (180deg=1.07) USER MOD Single : A 98 ASN : amide:sc= -1.31 K(o=-1.3,f=-1.9) USER MOD Single : A 100 GLN : amide:sc= -0.466 X(o=-0.47,f=-0.48) USER MOD Single : A 102 THR OG1 : rot -71:sc= 0.187 USER MOD Single : A 103 SER OG : rot 42:sc= 0.798 USER MOD Single : A 108 MET CE :methyl -178:sc= 0 (180deg=-0.00333) USER MOD Single : A 112 LYS NZ :NH3+ -172:sc= 1.12 (180deg=0.918) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 124 CYS SG : rot 55:sc= 0.942 USER MOD Single : A 125 THR OG1 : rot 180:sc= 0.0913 USER MOD Single : A 127 THR OG1 : rot 41:sc= 1.13 USER MOD Single : A 128 TYR OH : rot 180:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ -144:sc= 1.27 (180deg=1.12) USER MOD Single : A 131 GLN : amide:sc= -0.245 K(o=-0.24,f=-2.8) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 9.472 -12.251 -3.012 1.00 0.00 N ATOM 2 CA VAL A 1 10.094 -11.505 -1.931 1.00 0.00 C ATOM 3 C VAL A 1 11.392 -10.840 -2.412 1.00 0.00 C ATOM 4 O VAL A 1 11.567 -9.634 -2.200 1.00 0.00 O ATOM 5 CB VAL A 1 10.204 -12.388 -0.674 1.00 0.00 C ATOM 6 CG1 VAL A 1 11.148 -13.585 -0.823 1.00 0.00 C ATOM 7 CG2 VAL A 1 10.599 -11.574 0.562 1.00 0.00 C ATOM 0 H1 VAL A 1 8.554 -12.623 -2.694 1.00 0.00 H new ATOM 0 H2 VAL A 1 9.327 -11.623 -3.828 1.00 0.00 H new ATOM 0 H3 VAL A 1 10.089 -13.041 -3.288 1.00 0.00 H new ATOM 0 HA VAL A 1 9.468 -10.668 -1.622 1.00 0.00 H new ATOM 0 HB VAL A 1 9.200 -12.792 -0.541 1.00 0.00 H new ATOM 0 HG11 VAL A 1 11.166 -14.152 0.108 1.00 0.00 H new ATOM 0 HG12 VAL A 1 10.798 -14.226 -1.632 1.00 0.00 H new ATOM 0 HG13 VAL A 1 12.153 -13.230 -1.051 1.00 0.00 H new ATOM 0 HG21 VAL A 1 10.666 -12.234 1.427 1.00 0.00 H new ATOM 0 HG22 VAL A 1 11.566 -11.100 0.392 1.00 0.00 H new ATOM 0 HG23 VAL A 1 9.847 -10.807 0.748 1.00 0.00 H new ATOM 19 N ASP A 2 12.248 -11.594 -3.117 1.00 0.00 N ATOM 20 CA ASP A 2 13.538 -11.197 -3.693 1.00 0.00 C ATOM 21 C ASP A 2 13.358 -10.220 -4.866 1.00 0.00 C ATOM 22 O ASP A 2 13.810 -10.459 -5.984 1.00 0.00 O ATOM 23 CB ASP A 2 14.290 -12.455 -4.168 1.00 0.00 C ATOM 24 CG ASP A 2 14.213 -13.607 -3.182 1.00 0.00 C ATOM 25 OD1 ASP A 2 13.096 -14.166 -3.099 1.00 0.00 O ATOM 26 OD2 ASP A 2 15.237 -13.880 -2.522 1.00 0.00 O ATOM 0 H ASP A 2 12.039 -12.573 -3.314 1.00 0.00 H new ATOM 0 HA ASP A 2 14.114 -10.685 -2.923 1.00 0.00 H new ATOM 0 HB2 ASP A 2 13.879 -12.776 -5.125 1.00 0.00 H new ATOM 0 HB3 ASP A 2 15.336 -12.202 -4.340 1.00 0.00 H new ATOM 31 N ALA A 3 12.672 -9.113 -4.608 1.00 0.00 N ATOM 32 CA ALA A 3 12.058 -8.244 -5.598 1.00 0.00 C ATOM 33 C ALA A 3 11.321 -7.121 -4.878 1.00 0.00 C ATOM 34 O ALA A 3 11.329 -5.981 -5.331 1.00 0.00 O ATOM 35 CB ALA A 3 11.057 -9.035 -6.447 1.00 0.00 C ATOM 0 H ALA A 3 12.523 -8.783 -3.654 1.00 0.00 H new ATOM 0 HA ALA A 3 12.832 -7.835 -6.248 1.00 0.00 H new ATOM 0 HB1 ALA A 3 10.603 -8.374 -7.185 1.00 0.00 H new ATOM 0 HB2 ALA A 3 11.575 -9.847 -6.957 1.00 0.00 H new ATOM 0 HB3 ALA A 3 10.280 -9.447 -5.803 1.00 0.00 H new ATOM 41 N PHE A 4 10.689 -7.455 -3.750 1.00 0.00 N ATOM 42 CA PHE A 4 9.902 -6.544 -2.944 1.00 0.00 C ATOM 43 C PHE A 4 10.732 -5.987 -1.791 1.00 0.00 C ATOM 44 O PHE A 4 10.565 -4.825 -1.440 1.00 0.00 O ATOM 45 CB PHE A 4 8.639 -7.282 -2.482 1.00 0.00 C ATOM 46 CG PHE A 4 7.811 -7.780 -3.653 1.00 0.00 C ATOM 47 CD1 PHE A 4 7.388 -6.857 -4.628 1.00 0.00 C ATOM 48 CD2 PHE A 4 7.747 -9.158 -3.936 1.00 0.00 C ATOM 49 CE1 PHE A 4 6.968 -7.303 -5.893 1.00 0.00 C ATOM 50 CE2 PHE A 4 7.350 -9.601 -5.207 1.00 0.00 C ATOM 51 CZ PHE A 4 6.970 -8.674 -6.188 1.00 0.00 C ATOM 0 H PHE A 4 10.718 -8.400 -3.368 1.00 0.00 H new ATOM 0 HA PHE A 4 9.595 -5.676 -3.527 1.00 0.00 H new ATOM 0 HB2 PHE A 4 8.922 -8.126 -1.853 1.00 0.00 H new ATOM 0 HB3 PHE A 4 8.034 -6.615 -1.868 1.00 0.00 H new ATOM 0 HD1 PHE A 4 7.386 -5.801 -4.403 1.00 0.00 H new ATOM 0 HD2 PHE A 4 8.004 -9.877 -3.172 1.00 0.00 H new ATOM 0 HE1 PHE A 4 6.644 -6.590 -6.637 1.00 0.00 H new ATOM 0 HE2 PHE A 4 7.337 -10.658 -5.430 1.00 0.00 H new ATOM 0 HZ PHE A 4 6.679 -9.016 -7.170 1.00 0.00 H new ATOM 61 N VAL A 5 11.640 -6.788 -1.225 1.00 0.00 N ATOM 62 CA VAL A 5 12.552 -6.359 -0.164 1.00 0.00 C ATOM 63 C VAL A 5 13.274 -5.054 -0.548 1.00 0.00 C ATOM 64 O VAL A 5 14.206 -5.089 -1.353 1.00 0.00 O ATOM 65 CB VAL A 5 13.572 -7.487 0.098 1.00 0.00 C ATOM 66 CG1 VAL A 5 14.656 -7.068 1.105 1.00 0.00 C ATOM 67 CG2 VAL A 5 12.904 -8.768 0.618 1.00 0.00 C ATOM 0 H VAL A 5 11.763 -7.764 -1.495 1.00 0.00 H new ATOM 0 HA VAL A 5 11.981 -6.160 0.743 1.00 0.00 H new ATOM 0 HB VAL A 5 14.032 -7.686 -0.870 1.00 0.00 H new ATOM 0 HG11 VAL A 5 15.350 -7.894 1.257 1.00 0.00 H new ATOM 0 HG12 VAL A 5 15.198 -6.205 0.718 1.00 0.00 H new ATOM 0 HG13 VAL A 5 14.189 -6.807 2.055 1.00 0.00 H new ATOM 0 HG21 VAL A 5 13.663 -9.532 0.787 1.00 0.00 H new ATOM 0 HG22 VAL A 5 12.389 -8.555 1.555 1.00 0.00 H new ATOM 0 HG23 VAL A 5 12.185 -9.128 -0.118 1.00 0.00 H new ATOM 77 N GLY A 6 12.895 -3.909 0.034 1.00 0.00 N ATOM 78 CA GLY A 6 13.656 -2.678 -0.133 1.00 0.00 C ATOM 79 C GLY A 6 12.811 -1.422 0.057 1.00 0.00 C ATOM 80 O GLY A 6 11.598 -1.492 0.248 1.00 0.00 O ATOM 0 H GLY A 6 12.067 -3.816 0.622 1.00 0.00 H new ATOM 0 HA2 GLY A 6 14.479 -2.667 0.582 1.00 0.00 H new ATOM 0 HA3 GLY A 6 14.099 -2.664 -1.129 1.00 0.00 H new ATOM 84 N THR A 7 13.468 -0.260 -0.021 1.00 0.00 N ATOM 85 CA THR A 7 12.805 1.033 -0.108 1.00 0.00 C ATOM 86 C THR A 7 12.866 1.505 -1.555 1.00 0.00 C ATOM 87 O THR A 7 13.957 1.691 -2.103 1.00 0.00 O ATOM 88 CB THR A 7 13.443 2.042 0.851 1.00 0.00 C ATOM 89 OG1 THR A 7 13.397 1.528 2.163 1.00 0.00 O ATOM 90 CG2 THR A 7 12.680 3.365 0.839 1.00 0.00 C ATOM 0 H THR A 7 14.486 -0.197 -0.025 1.00 0.00 H new ATOM 0 HA THR A 7 11.762 0.941 0.194 1.00 0.00 H new ATOM 0 HB THR A 7 14.471 2.212 0.530 1.00 0.00 H new ATOM 0 HG1 THR A 7 13.806 2.170 2.780 1.00 0.00 H new ATOM 0 HG21 THR A 7 13.153 4.064 1.528 1.00 0.00 H new ATOM 0 HG22 THR A 7 12.693 3.783 -0.168 1.00 0.00 H new ATOM 0 HG23 THR A 7 11.649 3.193 1.148 1.00 0.00 H new ATOM 98 N TRP A 8 11.687 1.671 -2.153 1.00 0.00 N ATOM 99 CA TRP A 8 11.494 2.011 -3.545 1.00 0.00 C ATOM 100 C TRP A 8 10.854 3.396 -3.599 1.00 0.00 C ATOM 101 O TRP A 8 9.935 3.691 -2.836 1.00 0.00 O ATOM 102 CB TRP A 8 10.615 0.943 -4.205 1.00 0.00 C ATOM 103 CG TRP A 8 10.939 -0.472 -3.838 1.00 0.00 C ATOM 104 CD1 TRP A 8 10.468 -1.129 -2.754 1.00 0.00 C ATOM 105 CD2 TRP A 8 11.830 -1.405 -4.515 1.00 0.00 C ATOM 106 NE1 TRP A 8 11.015 -2.391 -2.707 1.00 0.00 N ATOM 107 CE2 TRP A 8 11.889 -2.606 -3.748 1.00 0.00 C ATOM 108 CE3 TRP A 8 12.595 -1.363 -5.699 1.00 0.00 C ATOM 109 CZ2 TRP A 8 12.693 -3.691 -4.115 1.00 0.00 C ATOM 110 CZ3 TRP A 8 13.357 -2.473 -6.109 1.00 0.00 C ATOM 111 CH2 TRP A 8 13.426 -3.627 -5.309 1.00 0.00 C ATOM 0 H TRP A 8 10.806 1.565 -1.650 1.00 0.00 H new ATOM 0 HA TRP A 8 12.437 2.038 -4.090 1.00 0.00 H new ATOM 0 HB2 TRP A 8 9.575 1.140 -3.943 1.00 0.00 H new ATOM 0 HB3 TRP A 8 10.696 1.048 -5.287 1.00 0.00 H new ATOM 0 HD1 TRP A 8 9.770 -0.725 -2.036 1.00 0.00 H new ATOM 0 HE1 TRP A 8 10.799 -3.082 -1.989 1.00 0.00 H new ATOM 0 HE3 TRP A 8 12.596 -0.466 -6.300 1.00 0.00 H new ATOM 0 HZ2 TRP A 8 12.748 -4.567 -3.486 1.00 0.00 H new ATOM 0 HZ3 TRP A 8 13.893 -2.438 -7.046 1.00 0.00 H new ATOM 0 HH2 TRP A 8 14.041 -4.461 -5.613 1.00 0.00 H new ATOM 122 N LYS A 9 11.357 4.263 -4.470 1.00 0.00 N ATOM 123 CA LYS A 9 10.975 5.661 -4.538 1.00 0.00 C ATOM 124 C LYS A 9 10.221 5.879 -5.848 1.00 0.00 C ATOM 125 O LYS A 9 10.791 5.594 -6.900 1.00 0.00 O ATOM 126 CB LYS A 9 12.279 6.468 -4.434 1.00 0.00 C ATOM 127 CG LYS A 9 12.072 7.919 -3.996 1.00 0.00 C ATOM 128 CD LYS A 9 11.887 8.848 -5.201 1.00 0.00 C ATOM 129 CE LYS A 9 10.908 9.971 -4.856 1.00 0.00 C ATOM 130 NZ LYS A 9 9.513 9.495 -4.887 1.00 0.00 N ATOM 0 H LYS A 9 12.058 4.003 -5.163 1.00 0.00 H new ATOM 0 HA LYS A 9 10.309 5.980 -3.737 1.00 0.00 H new ATOM 0 HB2 LYS A 9 12.945 5.976 -3.725 1.00 0.00 H new ATOM 0 HB3 LYS A 9 12.780 6.458 -5.402 1.00 0.00 H new ATOM 0 HG2 LYS A 9 11.198 7.983 -3.348 1.00 0.00 H new ATOM 0 HG3 LYS A 9 12.929 8.249 -3.409 1.00 0.00 H new ATOM 0 HD2 LYS A 9 12.848 9.271 -5.495 1.00 0.00 H new ATOM 0 HD3 LYS A 9 11.515 8.280 -6.054 1.00 0.00 H new ATOM 0 HE2 LYS A 9 11.138 10.365 -3.866 1.00 0.00 H new ATOM 0 HE3 LYS A 9 11.030 10.792 -5.562 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 8.892 10.210 -4.457 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 9.223 9.333 -5.873 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 9.438 8.606 -4.353 1.00 0.00 H new ATOM 144 N LEU A 10 8.957 6.346 -5.811 1.00 0.00 N ATOM 145 CA LEU A 10 8.187 6.505 -7.045 1.00 0.00 C ATOM 146 C LEU A 10 8.903 7.498 -7.944 1.00 0.00 C ATOM 147 O LEU A 10 9.265 8.579 -7.463 1.00 0.00 O ATOM 148 CB LEU A 10 6.741 6.971 -6.800 1.00 0.00 C ATOM 149 CG LEU A 10 5.908 6.932 -8.104 1.00 0.00 C ATOM 150 CD1 LEU A 10 4.456 6.535 -7.829 1.00 0.00 C ATOM 151 CD2 LEU A 10 5.870 8.281 -8.838 1.00 0.00 C ATOM 0 H LEU A 10 8.464 6.612 -4.959 1.00 0.00 H new ATOM 0 HA LEU A 10 8.120 5.526 -7.519 1.00 0.00 H new ATOM 0 HB2 LEU A 10 6.274 6.334 -6.049 1.00 0.00 H new ATOM 0 HB3 LEU A 10 6.746 7.985 -6.400 1.00 0.00 H new ATOM 0 HG LEU A 10 6.408 6.192 -8.729 1.00 0.00 H new ATOM 0 HD11 LEU A 10 3.900 6.518 -8.766 1.00 0.00 H new ATOM 0 HD12 LEU A 10 4.430 5.545 -7.373 1.00 0.00 H new ATOM 0 HD13 LEU A 10 4.003 7.259 -7.152 1.00 0.00 H new ATOM 0 HD21 LEU A 10 5.270 8.186 -9.743 1.00 0.00 H new ATOM 0 HD22 LEU A 10 5.429 9.037 -8.188 1.00 0.00 H new ATOM 0 HD23 LEU A 10 6.884 8.579 -9.104 1.00 0.00 H new ATOM 163 N VAL A 11 9.068 7.131 -9.218 1.00 0.00 N ATOM 164 CA VAL A 11 9.677 7.975 -10.232 1.00 0.00 C ATOM 165 C VAL A 11 8.698 8.205 -11.391 1.00 0.00 C ATOM 166 O VAL A 11 8.275 9.345 -11.584 1.00 0.00 O ATOM 167 CB VAL A 11 11.070 7.437 -10.611 1.00 0.00 C ATOM 168 CG1 VAL A 11 11.121 5.934 -10.898 1.00 0.00 C ATOM 169 CG2 VAL A 11 11.676 8.209 -11.786 1.00 0.00 C ATOM 0 H VAL A 11 8.774 6.221 -9.573 1.00 0.00 H new ATOM 0 HA VAL A 11 9.873 8.974 -9.843 1.00 0.00 H new ATOM 0 HB VAL A 11 11.670 7.599 -9.716 1.00 0.00 H new ATOM 0 HG11 VAL A 11 12.141 5.647 -11.156 1.00 0.00 H new ATOM 0 HG12 VAL A 11 10.802 5.384 -10.013 1.00 0.00 H new ATOM 0 HG13 VAL A 11 10.457 5.700 -11.730 1.00 0.00 H new ATOM 0 HG21 VAL A 11 12.658 7.799 -12.023 1.00 0.00 H new ATOM 0 HG22 VAL A 11 11.025 8.117 -12.656 1.00 0.00 H new ATOM 0 HG23 VAL A 11 11.777 9.261 -11.517 1.00 0.00 H new ATOM 179 N ASP A 12 8.309 7.158 -12.133 1.00 0.00 N ATOM 180 CA ASP A 12 7.461 7.294 -13.318 1.00 0.00 C ATOM 181 C ASP A 12 6.041 6.804 -13.011 1.00 0.00 C ATOM 182 O ASP A 12 5.823 6.027 -12.077 1.00 0.00 O ATOM 183 CB ASP A 12 8.039 6.570 -14.552 1.00 0.00 C ATOM 184 CG ASP A 12 9.561 6.551 -14.630 1.00 0.00 C ATOM 185 OD1 ASP A 12 10.130 7.559 -15.092 1.00 0.00 O ATOM 186 OD2 ASP A 12 10.146 5.519 -14.229 1.00 0.00 O ATOM 0 H ASP A 12 8.575 6.195 -11.926 1.00 0.00 H new ATOM 0 HA ASP A 12 7.428 8.354 -13.571 1.00 0.00 H new ATOM 0 HB2 ASP A 12 7.677 5.542 -14.555 1.00 0.00 H new ATOM 0 HB3 ASP A 12 7.650 7.048 -15.451 1.00 0.00 H new ATOM 191 N SER A 13 5.070 7.267 -13.806 1.00 0.00 N ATOM 192 CA SER A 13 3.646 6.991 -13.673 1.00 0.00 C ATOM 193 C SER A 13 2.935 7.626 -14.870 1.00 0.00 C ATOM 194 O SER A 13 3.502 8.492 -15.537 1.00 0.00 O ATOM 195 CB SER A 13 3.123 7.579 -12.348 1.00 0.00 C ATOM 196 OG SER A 13 1.722 7.417 -12.191 1.00 0.00 O ATOM 0 H SER A 13 5.273 7.875 -14.599 1.00 0.00 H new ATOM 0 HA SER A 13 3.457 5.918 -13.658 1.00 0.00 H new ATOM 0 HB2 SER A 13 3.636 7.098 -11.515 1.00 0.00 H new ATOM 0 HB3 SER A 13 3.369 8.640 -12.304 1.00 0.00 H new ATOM 0 HG SER A 13 1.463 6.515 -12.473 1.00 0.00 H new ATOM 202 N LYS A 14 1.680 7.235 -15.105 1.00 0.00 N ATOM 203 CA LYS A 14 0.755 7.919 -16.001 1.00 0.00 C ATOM 204 C LYS A 14 -0.654 7.695 -15.440 1.00 0.00 C ATOM 205 O LYS A 14 -0.859 6.722 -14.715 1.00 0.00 O ATOM 206 CB LYS A 14 0.910 7.371 -17.431 1.00 0.00 C ATOM 207 CG LYS A 14 0.337 8.291 -18.526 1.00 0.00 C ATOM 208 CD LYS A 14 1.193 9.535 -18.826 1.00 0.00 C ATOM 209 CE LYS A 14 2.460 9.184 -19.624 1.00 0.00 C ATOM 210 NZ LYS A 14 3.256 10.381 -19.969 1.00 0.00 N ATOM 0 H LYS A 14 1.272 6.411 -14.663 1.00 0.00 H new ATOM 0 HA LYS A 14 0.958 8.988 -16.058 1.00 0.00 H new ATOM 0 HB2 LYS A 14 1.968 7.203 -17.631 1.00 0.00 H new ATOM 0 HB3 LYS A 14 0.416 6.401 -17.492 1.00 0.00 H new ATOM 0 HG2 LYS A 14 0.222 7.714 -19.444 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -0.660 8.615 -18.226 1.00 0.00 H new ATOM 0 HD2 LYS A 14 0.599 10.257 -19.387 1.00 0.00 H new ATOM 0 HD3 LYS A 14 1.476 10.015 -17.889 1.00 0.00 H new ATOM 0 HE2 LYS A 14 3.075 8.497 -19.042 1.00 0.00 H new ATOM 0 HE3 LYS A 14 2.178 8.662 -20.538 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 4.099 10.094 -20.506 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 2.680 11.026 -20.547 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 3.549 10.866 -19.097 1.00 0.00 H new ATOM 224 N ASN A 15 -1.604 8.597 -15.719 1.00 0.00 N ATOM 225 CA ASN A 15 -2.994 8.500 -15.260 1.00 0.00 C ATOM 226 C ASN A 15 -3.049 8.313 -13.739 1.00 0.00 C ATOM 227 O ASN A 15 -3.794 7.481 -13.226 1.00 0.00 O ATOM 228 CB ASN A 15 -3.735 7.358 -15.980 1.00 0.00 C ATOM 229 CG ASN A 15 -3.963 7.609 -17.466 1.00 0.00 C ATOM 230 OD1 ASN A 15 -3.010 7.782 -18.221 1.00 0.00 O ATOM 231 ND2 ASN A 15 -5.215 7.633 -17.907 1.00 0.00 N ATOM 0 H ASN A 15 -1.424 9.429 -16.280 1.00 0.00 H new ATOM 0 HA ASN A 15 -3.498 9.434 -15.508 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -3.165 6.436 -15.861 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -4.699 7.202 -15.496 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -5.404 7.798 -18.896 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -5.987 7.486 -17.257 1.00 0.00 H new ATOM 238 N PHE A 16 -2.221 9.054 -12.994 1.00 0.00 N ATOM 239 CA PHE A 16 -2.175 8.899 -11.544 1.00 0.00 C ATOM 240 C PHE A 16 -3.533 9.271 -10.954 1.00 0.00 C ATOM 241 O PHE A 16 -4.135 8.485 -10.218 1.00 0.00 O ATOM 242 CB PHE A 16 -1.034 9.720 -10.924 1.00 0.00 C ATOM 243 CG PHE A 16 -0.697 9.320 -9.495 1.00 0.00 C ATOM 244 CD1 PHE A 16 -1.547 9.677 -8.431 1.00 0.00 C ATOM 245 CD2 PHE A 16 0.500 8.632 -9.220 1.00 0.00 C ATOM 246 CE1 PHE A 16 -1.212 9.322 -7.114 1.00 0.00 C ATOM 247 CE2 PHE A 16 0.839 8.295 -7.900 1.00 0.00 C ATOM 248 CZ PHE A 16 -0.027 8.621 -6.847 1.00 0.00 C ATOM 0 H PHE A 16 -1.584 9.757 -13.369 1.00 0.00 H new ATOM 0 HA PHE A 16 -1.965 7.857 -11.304 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -0.143 9.611 -11.542 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -1.307 10.775 -10.942 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -2.457 10.224 -8.628 1.00 0.00 H new ATOM 0 HD2 PHE A 16 1.162 8.362 -10.030 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -1.871 9.591 -6.302 1.00 0.00 H new ATOM 0 HE2 PHE A 16 1.768 7.784 -7.696 1.00 0.00 H new ATOM 0 HZ PHE A 16 0.217 8.334 -5.835 1.00 0.00 H new ATOM 258 N ASP A 17 -3.992 10.488 -11.261 1.00 0.00 N ATOM 259 CA ASP A 17 -5.232 10.979 -10.701 1.00 0.00 C ATOM 260 C ASP A 17 -6.443 10.347 -11.382 1.00 0.00 C ATOM 261 O ASP A 17 -7.274 9.752 -10.710 1.00 0.00 O ATOM 262 CB ASP A 17 -5.331 12.495 -10.715 1.00 0.00 C ATOM 263 CG ASP A 17 -6.640 12.854 -10.032 1.00 0.00 C ATOM 264 OD1 ASP A 17 -6.831 12.392 -8.879 1.00 0.00 O ATOM 265 OD2 ASP A 17 -7.433 13.582 -10.657 1.00 0.00 O ATOM 0 H ASP A 17 -3.521 11.138 -11.890 1.00 0.00 H new ATOM 0 HA ASP A 17 -5.230 10.675 -9.654 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -4.486 12.943 -10.192 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -5.311 12.875 -11.737 1.00 0.00 H new ATOM 270 N ASP A 18 -6.522 10.459 -12.710 1.00 0.00 N ATOM 271 CA ASP A 18 -7.557 9.863 -13.553 1.00 0.00 C ATOM 272 C ASP A 18 -8.185 8.608 -12.928 1.00 0.00 C ATOM 273 O ASP A 18 -9.370 8.588 -12.598 1.00 0.00 O ATOM 274 CB ASP A 18 -6.919 9.551 -14.910 1.00 0.00 C ATOM 275 CG ASP A 18 -7.809 8.651 -15.750 1.00 0.00 C ATOM 276 OD1 ASP A 18 -8.985 9.028 -15.926 1.00 0.00 O ATOM 277 OD2 ASP A 18 -7.284 7.603 -16.187 1.00 0.00 O ATOM 0 H ASP A 18 -5.837 10.990 -13.248 1.00 0.00 H new ATOM 0 HA ASP A 18 -8.381 10.568 -13.665 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -6.730 10.481 -15.447 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -5.953 9.069 -14.757 1.00 0.00 H new ATOM 282 N TYR A 19 -7.345 7.599 -12.683 1.00 0.00 N ATOM 283 CA TYR A 19 -7.731 6.354 -12.036 1.00 0.00 C ATOM 284 C TYR A 19 -8.488 6.581 -10.715 1.00 0.00 C ATOM 285 O TYR A 19 -9.631 6.148 -10.559 1.00 0.00 O ATOM 286 CB TYR A 19 -6.461 5.514 -11.848 1.00 0.00 C ATOM 287 CG TYR A 19 -6.688 4.087 -11.392 1.00 0.00 C ATOM 288 CD1 TYR A 19 -7.332 3.180 -12.251 1.00 0.00 C ATOM 289 CD2 TYR A 19 -6.134 3.623 -10.184 1.00 0.00 C ATOM 290 CE1 TYR A 19 -7.409 1.820 -11.915 1.00 0.00 C ATOM 291 CE2 TYR A 19 -6.190 2.256 -9.862 1.00 0.00 C ATOM 292 CZ TYR A 19 -6.788 1.351 -10.752 1.00 0.00 C ATOM 293 OH TYR A 19 -6.696 0.013 -10.531 1.00 0.00 O ATOM 0 H TYR A 19 -6.358 7.631 -12.937 1.00 0.00 H new ATOM 0 HA TYR A 19 -8.439 5.817 -12.667 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -5.916 5.494 -12.792 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -5.820 6.013 -11.121 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -7.770 3.531 -13.174 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -5.665 4.318 -9.504 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -7.947 1.135 -12.554 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -5.773 1.903 -8.930 1.00 0.00 H new ATOM 0 HH TYR A 19 -6.237 -0.147 -9.680 1.00 0.00 H new ATOM 303 N MET A 20 -7.853 7.250 -9.748 1.00 0.00 N ATOM 304 CA MET A 20 -8.457 7.497 -8.438 1.00 0.00 C ATOM 305 C MET A 20 -9.714 8.377 -8.529 1.00 0.00 C ATOM 306 O MET A 20 -10.615 8.273 -7.684 1.00 0.00 O ATOM 307 CB MET A 20 -7.423 8.065 -7.453 1.00 0.00 C ATOM 308 CG MET A 20 -6.715 9.304 -7.993 1.00 0.00 C ATOM 309 SD MET A 20 -5.690 10.281 -6.879 1.00 0.00 S ATOM 310 CE MET A 20 -4.598 8.947 -6.328 1.00 0.00 C ATOM 0 H MET A 20 -6.913 7.632 -9.851 1.00 0.00 H new ATOM 0 HA MET A 20 -8.790 6.535 -8.048 1.00 0.00 H new ATOM 0 HB2 MET A 20 -7.919 8.315 -6.515 1.00 0.00 H new ATOM 0 HB3 MET A 20 -6.682 7.298 -7.227 1.00 0.00 H new ATOM 0 HG2 MET A 20 -6.086 8.987 -8.825 1.00 0.00 H new ATOM 0 HG3 MET A 20 -7.478 9.966 -8.404 1.00 0.00 H new ATOM 0 HE1 MET A 20 -3.807 9.360 -5.702 1.00 0.00 H new ATOM 0 HE2 MET A 20 -5.173 8.220 -5.754 1.00 0.00 H new ATOM 0 HE3 MET A 20 -4.156 8.457 -7.195 1.00 0.00 H new ATOM 320 N LYS A 21 -9.763 9.262 -9.529 1.00 0.00 N ATOM 321 CA LYS A 21 -10.775 10.293 -9.734 1.00 0.00 C ATOM 322 C LYS A 21 -12.059 9.705 -10.340 1.00 0.00 C ATOM 323 O LYS A 21 -12.621 10.274 -11.279 1.00 0.00 O ATOM 324 CB LYS A 21 -10.166 11.359 -10.661 1.00 0.00 C ATOM 325 CG LYS A 21 -10.917 12.700 -10.635 1.00 0.00 C ATOM 326 CD LYS A 21 -10.667 13.535 -11.903 1.00 0.00 C ATOM 327 CE LYS A 21 -11.088 12.863 -13.223 1.00 0.00 C ATOM 328 NZ LYS A 21 -12.410 12.210 -13.142 1.00 0.00 N ATOM 0 H LYS A 21 -9.052 9.275 -10.260 1.00 0.00 H new ATOM 0 HA LYS A 21 -11.058 10.735 -8.779 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -9.128 11.528 -10.374 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -10.156 10.978 -11.682 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -11.986 12.513 -10.531 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -10.606 13.271 -9.760 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -11.202 14.480 -11.808 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -9.605 13.774 -11.958 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -11.106 13.611 -14.015 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -10.339 12.122 -13.502 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -12.799 12.093 -14.100 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -12.310 11.277 -12.693 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -13.054 12.799 -12.577 1.00 0.00 H new ATOM 342 N SER A 22 -12.516 8.578 -9.795 1.00 0.00 N ATOM 343 CA SER A 22 -13.684 7.793 -10.193 1.00 0.00 C ATOM 344 C SER A 22 -13.733 6.561 -9.295 1.00 0.00 C ATOM 345 O SER A 22 -14.773 6.236 -8.732 1.00 0.00 O ATOM 346 CB SER A 22 -13.623 7.353 -11.665 1.00 0.00 C ATOM 347 OG SER A 22 -14.077 8.380 -12.519 1.00 0.00 O ATOM 0 H SER A 22 -12.039 8.156 -8.998 1.00 0.00 H new ATOM 0 HA SER A 22 -14.576 8.410 -10.086 1.00 0.00 H new ATOM 0 HB2 SER A 22 -12.599 7.084 -11.926 1.00 0.00 H new ATOM 0 HB3 SER A 22 -14.233 6.461 -11.807 1.00 0.00 H new ATOM 0 HG SER A 22 -13.755 9.245 -12.190 1.00 0.00 H new ATOM 353 N LEU A 23 -12.581 5.900 -9.133 1.00 0.00 N ATOM 354 CA LEU A 23 -12.418 4.782 -8.211 1.00 0.00 C ATOM 355 C LEU A 23 -12.856 5.189 -6.791 1.00 0.00 C ATOM 356 O LEU A 23 -13.409 4.386 -6.032 1.00 0.00 O ATOM 357 CB LEU A 23 -10.955 4.323 -8.317 1.00 0.00 C ATOM 358 CG LEU A 23 -10.591 2.922 -7.820 1.00 0.00 C ATOM 359 CD1 LEU A 23 -10.319 2.879 -6.317 1.00 0.00 C ATOM 360 CD2 LEU A 23 -11.655 1.906 -8.233 1.00 0.00 C ATOM 0 H LEU A 23 -11.730 6.132 -9.646 1.00 0.00 H new ATOM 0 HA LEU A 23 -13.059 3.938 -8.465 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -10.662 4.389 -9.365 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -10.343 5.039 -7.769 1.00 0.00 H new ATOM 0 HG LEU A 23 -9.653 2.646 -8.302 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -10.066 1.861 -6.022 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -9.488 3.543 -6.078 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -11.209 3.203 -5.777 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -11.375 0.918 -7.869 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -12.616 2.191 -7.805 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -11.734 1.883 -9.320 1.00 0.00 H new ATOM 372 N GLY A 24 -12.668 6.472 -6.466 1.00 0.00 N ATOM 373 CA GLY A 24 -13.361 7.151 -5.380 1.00 0.00 C ATOM 374 C GLY A 24 -12.372 7.576 -4.309 1.00 0.00 C ATOM 375 O GLY A 24 -12.603 7.352 -3.122 1.00 0.00 O ATOM 0 H GLY A 24 -12.014 7.076 -6.965 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -13.888 8.024 -5.765 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -14.112 6.489 -4.949 1.00 0.00 H new ATOM 379 N VAL A 25 -11.259 8.158 -4.759 1.00 0.00 N ATOM 380 CA VAL A 25 -10.133 8.562 -3.930 1.00 0.00 C ATOM 381 C VAL A 25 -9.618 9.930 -4.409 1.00 0.00 C ATOM 382 O VAL A 25 -9.202 10.767 -3.607 1.00 0.00 O ATOM 383 CB VAL A 25 -9.064 7.450 -3.993 1.00 0.00 C ATOM 384 CG1 VAL A 25 -7.758 7.868 -3.305 1.00 0.00 C ATOM 385 CG2 VAL A 25 -9.558 6.126 -3.396 1.00 0.00 C ATOM 0 H VAL A 25 -11.117 8.366 -5.747 1.00 0.00 H new ATOM 0 HA VAL A 25 -10.420 8.685 -2.886 1.00 0.00 H new ATOM 0 HB VAL A 25 -8.867 7.293 -5.054 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -7.035 7.056 -3.373 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -7.356 8.754 -3.796 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -7.955 8.091 -2.256 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -8.768 5.378 -3.466 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -9.825 6.276 -2.350 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -10.433 5.782 -3.948 1.00 0.00 H new ATOM 395 N GLY A 26 -9.632 10.175 -5.724 1.00 0.00 N ATOM 396 CA GLY A 26 -9.139 11.408 -6.323 1.00 0.00 C ATOM 397 C GLY A 26 -10.104 12.572 -6.127 1.00 0.00 C ATOM 398 O GLY A 26 -10.670 13.082 -7.094 1.00 0.00 O ATOM 0 H GLY A 26 -9.993 9.509 -6.407 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -8.174 11.662 -5.885 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -8.974 11.251 -7.389 1.00 0.00 H new ATOM 402 N PHE A 27 -10.250 13.025 -4.883 1.00 0.00 N ATOM 403 CA PHE A 27 -11.096 14.155 -4.530 1.00 0.00 C ATOM 404 C PHE A 27 -10.232 15.323 -4.049 1.00 0.00 C ATOM 405 O PHE A 27 -10.239 15.622 -2.854 1.00 0.00 O ATOM 406 CB PHE A 27 -12.104 13.702 -3.462 1.00 0.00 C ATOM 407 CG PHE A 27 -12.947 12.495 -3.842 1.00 0.00 C ATOM 408 CD1 PHE A 27 -13.749 12.527 -4.999 1.00 0.00 C ATOM 409 CD2 PHE A 27 -13.008 11.378 -2.988 1.00 0.00 C ATOM 410 CE1 PHE A 27 -14.624 11.466 -5.282 1.00 0.00 C ATOM 411 CE2 PHE A 27 -13.905 10.331 -3.256 1.00 0.00 C ATOM 412 CZ PHE A 27 -14.719 10.377 -4.399 1.00 0.00 C ATOM 0 H PHE A 27 -9.775 12.608 -4.082 1.00 0.00 H new ATOM 0 HA PHE A 27 -11.652 14.505 -5.400 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -11.560 13.472 -2.546 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -12.770 14.535 -3.237 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -13.691 13.370 -5.671 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -12.363 11.326 -2.124 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -15.225 11.487 -6.179 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -13.969 9.490 -2.582 1.00 0.00 H new ATOM 0 HZ PHE A 27 -15.417 9.577 -4.599 1.00 0.00 H new ATOM 422 N ALA A 28 -9.486 15.964 -4.966 1.00 0.00 N ATOM 423 CA ALA A 28 -8.667 17.167 -4.755 1.00 0.00 C ATOM 424 C ALA A 28 -7.447 16.899 -3.868 1.00 0.00 C ATOM 425 O ALA A 28 -6.295 17.026 -4.285 1.00 0.00 O ATOM 426 CB ALA A 28 -9.525 18.332 -4.246 1.00 0.00 C ATOM 0 H ALA A 28 -9.437 15.635 -5.930 1.00 0.00 H new ATOM 0 HA ALA A 28 -8.263 17.462 -5.724 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -8.896 19.210 -4.098 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -10.300 18.560 -4.978 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -9.990 18.055 -3.300 1.00 0.00 H new ATOM 432 N THR A 29 -7.720 16.474 -2.641 1.00 0.00 N ATOM 433 CA THR A 29 -6.817 15.975 -1.626 1.00 0.00 C ATOM 434 C THR A 29 -5.627 15.211 -2.214 1.00 0.00 C ATOM 435 O THR A 29 -4.486 15.428 -1.792 1.00 0.00 O ATOM 436 CB THR A 29 -7.659 15.083 -0.696 1.00 0.00 C ATOM 437 OG1 THR A 29 -8.895 15.715 -0.418 1.00 0.00 O ATOM 438 CG2 THR A 29 -6.950 14.812 0.629 1.00 0.00 C ATOM 0 H THR A 29 -8.682 16.473 -2.303 1.00 0.00 H new ATOM 0 HA THR A 29 -6.370 16.806 -1.081 1.00 0.00 H new ATOM 0 HB THR A 29 -7.814 14.134 -1.210 1.00 0.00 H new ATOM 0 HG1 THR A 29 -9.429 15.144 0.173 1.00 0.00 H new ATOM 0 HG21 THR A 29 -7.579 14.179 1.255 1.00 0.00 H new ATOM 0 HG22 THR A 29 -6.003 14.307 0.438 1.00 0.00 H new ATOM 0 HG23 THR A 29 -6.762 15.756 1.141 1.00 0.00 H new ATOM 446 N ARG A 30 -5.888 14.312 -3.170 1.00 0.00 N ATOM 447 CA ARG A 30 -4.878 13.443 -3.760 1.00 0.00 C ATOM 448 C ARG A 30 -4.604 13.774 -5.236 1.00 0.00 C ATOM 449 O ARG A 30 -4.107 12.922 -5.971 1.00 0.00 O ATOM 450 CB ARG A 30 -5.268 11.978 -3.496 1.00 0.00 C ATOM 451 CG ARG A 30 -4.015 11.155 -3.182 1.00 0.00 C ATOM 452 CD ARG A 30 -4.338 9.716 -2.777 1.00 0.00 C ATOM 453 NE ARG A 30 -3.122 9.030 -2.304 1.00 0.00 N ATOM 454 CZ ARG A 30 -3.032 7.707 -2.096 1.00 0.00 C ATOM 455 NH1 ARG A 30 -3.828 6.859 -2.751 1.00 0.00 N ATOM 456 NH2 ARG A 30 -2.179 7.211 -1.198 1.00 0.00 N ATOM 0 H ARG A 30 -6.821 14.170 -3.557 1.00 0.00 H new ATOM 0 HA ARG A 30 -3.916 13.619 -3.279 1.00 0.00 H new ATOM 0 HB2 ARG A 30 -5.968 11.923 -2.663 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -5.776 11.565 -4.367 1.00 0.00 H new ATOM 0 HG2 ARG A 30 -3.364 11.144 -4.056 1.00 0.00 H new ATOM 0 HG3 ARG A 30 -3.460 11.638 -2.378 1.00 0.00 H new ATOM 0 HD2 ARG A 30 -5.094 9.713 -1.991 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -4.760 9.178 -3.626 1.00 0.00 H new ATOM 0 HE ARG A 30 -2.294 9.598 -2.123 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -4.513 7.214 -3.418 1.00 0.00 H new ATOM 0 HH12 ARG A 30 -3.751 5.856 -2.585 1.00 0.00 H new ATOM 0 HH21 ARG A 30 -1.584 7.840 -0.658 1.00 0.00 H new ATOM 0 HH22 ARG A 30 -2.122 6.203 -1.051 1.00 0.00 H new ATOM 470 N GLN A 31 -4.895 15.020 -5.636 1.00 0.00 N ATOM 471 CA GLN A 31 -4.329 15.703 -6.799 1.00 0.00 C ATOM 472 C GLN A 31 -3.195 16.633 -6.361 1.00 0.00 C ATOM 473 O GLN A 31 -2.313 16.939 -7.162 1.00 0.00 O ATOM 474 CB GLN A 31 -5.421 16.485 -7.549 1.00 0.00 C ATOM 475 CG GLN A 31 -6.284 15.527 -8.378 1.00 0.00 C ATOM 476 CD GLN A 31 -7.772 15.538 -8.032 1.00 0.00 C ATOM 477 OE1 GLN A 31 -8.398 16.586 -7.923 1.00 0.00 O ATOM 478 NE2 GLN A 31 -8.358 14.362 -7.847 1.00 0.00 N ATOM 0 H GLN A 31 -5.563 15.603 -5.131 1.00 0.00 H new ATOM 0 HA GLN A 31 -3.920 14.957 -7.481 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -6.045 17.025 -6.837 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -4.963 17.229 -8.200 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -6.169 15.778 -9.432 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -5.903 14.514 -8.248 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -7.818 13.502 -7.943 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -9.349 14.318 -7.609 1.00 0.00 H new ATOM 487 N VAL A 32 -3.198 17.060 -5.092 1.00 0.00 N ATOM 488 CA VAL A 32 -2.006 17.604 -4.452 1.00 0.00 C ATOM 489 C VAL A 32 -1.208 16.474 -3.782 1.00 0.00 C ATOM 490 O VAL A 32 0.012 16.397 -3.935 1.00 0.00 O ATOM 491 CB VAL A 32 -2.371 18.775 -3.518 1.00 0.00 C ATOM 492 CG1 VAL A 32 -3.186 18.372 -2.286 1.00 0.00 C ATOM 493 CG2 VAL A 32 -1.109 19.529 -3.078 1.00 0.00 C ATOM 0 H VAL A 32 -4.021 17.036 -4.490 1.00 0.00 H new ATOM 0 HA VAL A 32 -1.342 18.037 -5.200 1.00 0.00 H new ATOM 0 HB VAL A 32 -3.015 19.424 -4.111 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -3.398 19.256 -1.685 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -4.123 17.915 -2.603 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -2.617 17.657 -1.691 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -1.388 20.352 -2.419 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -0.445 18.848 -2.546 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -0.597 19.924 -3.955 1.00 0.00 H new ATOM 503 N GLY A 33 -1.886 15.584 -3.041 1.00 0.00 N ATOM 504 CA GLY A 33 -1.263 14.518 -2.261 1.00 0.00 C ATOM 505 C GLY A 33 -0.739 13.360 -3.111 1.00 0.00 C ATOM 506 O GLY A 33 -1.180 12.224 -2.957 1.00 0.00 O ATOM 0 H GLY A 33 -2.903 15.591 -2.970 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -0.438 14.936 -1.685 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -1.989 14.132 -1.545 1.00 0.00 H new ATOM 510 N ASN A 34 0.204 13.657 -4.001 1.00 0.00 N ATOM 511 CA ASN A 34 0.726 12.763 -5.029 1.00 0.00 C ATOM 512 C ASN A 34 1.827 13.485 -5.800 1.00 0.00 C ATOM 513 O ASN A 34 2.870 12.903 -6.085 1.00 0.00 O ATOM 514 CB ASN A 34 -0.369 12.293 -6.002 1.00 0.00 C ATOM 515 CG ASN A 34 -1.011 13.433 -6.786 1.00 0.00 C ATOM 516 OD1 ASN A 34 -1.206 14.517 -6.250 1.00 0.00 O ATOM 517 ND2 ASN A 34 -1.313 13.218 -8.062 1.00 0.00 N ATOM 0 H ASN A 34 0.647 14.575 -4.025 1.00 0.00 H new ATOM 0 HA ASN A 34 1.122 11.875 -4.536 1.00 0.00 H new ATOM 0 HB2 ASN A 34 0.060 11.577 -6.702 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -1.142 11.767 -5.441 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -1.719 13.967 -8.623 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -1.139 12.304 -8.480 1.00 0.00 H new ATOM 524 N MET A 35 1.606 14.767 -6.113 1.00 0.00 N ATOM 525 CA MET A 35 2.605 15.620 -6.737 1.00 0.00 C ATOM 526 C MET A 35 3.893 15.612 -5.905 1.00 0.00 C ATOM 527 O MET A 35 4.993 15.602 -6.458 1.00 0.00 O ATOM 528 CB MET A 35 2.012 17.019 -6.937 1.00 0.00 C ATOM 529 CG MET A 35 2.918 17.914 -7.793 1.00 0.00 C ATOM 530 SD MET A 35 2.121 19.415 -8.438 1.00 0.00 S ATOM 531 CE MET A 35 1.089 18.696 -9.746 1.00 0.00 C ATOM 0 H MET A 35 0.719 15.239 -5.936 1.00 0.00 H new ATOM 0 HA MET A 35 2.879 15.244 -7.723 1.00 0.00 H new ATOM 0 HB2 MET A 35 1.035 16.933 -7.412 1.00 0.00 H new ATOM 0 HB3 MET A 35 1.854 17.487 -5.966 1.00 0.00 H new ATOM 0 HG2 MET A 35 3.783 18.207 -7.197 1.00 0.00 H new ATOM 0 HG3 MET A 35 3.293 17.329 -8.633 1.00 0.00 H new ATOM 0 HE1 MET A 35 1.063 19.371 -10.601 1.00 0.00 H new ATOM 0 HE2 MET A 35 1.506 17.737 -10.053 1.00 0.00 H new ATOM 0 HE3 MET A 35 0.077 18.548 -9.370 1.00 0.00 H new ATOM 541 N THR A 36 3.758 15.541 -4.577 1.00 0.00 N ATOM 542 CA THR A 36 4.833 15.131 -3.686 1.00 0.00 C ATOM 543 C THR A 36 5.198 13.660 -3.950 1.00 0.00 C ATOM 544 O THR A 36 4.823 12.779 -3.173 1.00 0.00 O ATOM 545 CB THR A 36 4.397 15.365 -2.231 1.00 0.00 C ATOM 546 OG1 THR A 36 3.824 16.648 -2.103 1.00 0.00 O ATOM 547 CG2 THR A 36 5.590 15.271 -1.277 1.00 0.00 C ATOM 0 H THR A 36 2.890 15.770 -4.092 1.00 0.00 H new ATOM 0 HA THR A 36 5.727 15.726 -3.872 1.00 0.00 H new ATOM 0 HB THR A 36 3.670 14.595 -1.973 1.00 0.00 H new ATOM 0 HG1 THR A 36 3.982 16.988 -1.197 1.00 0.00 H new ATOM 0 HG21 THR A 36 5.253 15.441 -0.255 1.00 0.00 H new ATOM 0 HG22 THR A 36 6.038 14.280 -1.351 1.00 0.00 H new ATOM 0 HG23 THR A 36 6.330 16.025 -1.545 1.00 0.00 H new ATOM 555 N LYS A 37 5.932 13.436 -5.052 1.00 0.00 N ATOM 556 CA LYS A 37 6.505 12.179 -5.536 1.00 0.00 C ATOM 557 C LYS A 37 6.628 11.118 -4.424 1.00 0.00 C ATOM 558 O LYS A 37 7.651 11.104 -3.733 1.00 0.00 O ATOM 559 CB LYS A 37 7.897 12.481 -6.139 1.00 0.00 C ATOM 560 CG LYS A 37 7.945 12.687 -7.658 1.00 0.00 C ATOM 561 CD LYS A 37 7.231 13.960 -8.128 1.00 0.00 C ATOM 562 CE LYS A 37 7.386 14.176 -9.643 1.00 0.00 C ATOM 563 NZ LYS A 37 8.790 14.382 -10.062 1.00 0.00 N ATOM 0 H LYS A 37 6.158 14.205 -5.682 1.00 0.00 H new ATOM 0 HA LYS A 37 5.836 11.763 -6.289 1.00 0.00 H new ATOM 0 HB2 LYS A 37 8.292 13.376 -5.659 1.00 0.00 H new ATOM 0 HB3 LYS A 37 8.567 11.660 -5.883 1.00 0.00 H new ATOM 0 HG2 LYS A 37 8.986 12.725 -7.978 1.00 0.00 H new ATOM 0 HG3 LYS A 37 7.492 11.825 -8.148 1.00 0.00 H new ATOM 0 HD2 LYS A 37 6.172 13.897 -7.876 1.00 0.00 H new ATOM 0 HD3 LYS A 37 7.635 14.821 -7.595 1.00 0.00 H new ATOM 0 HE2 LYS A 37 6.979 13.313 -10.170 1.00 0.00 H new ATOM 0 HE3 LYS A 37 6.794 15.041 -9.943 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 8.814 14.704 -11.050 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 9.232 15.100 -9.453 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 9.312 13.487 -9.977 1.00 0.00 H new ATOM 577 N PRO A 38 5.659 10.203 -4.259 1.00 0.00 N ATOM 578 CA PRO A 38 5.578 9.352 -3.081 1.00 0.00 C ATOM 579 C PRO A 38 6.739 8.360 -2.979 1.00 0.00 C ATOM 580 O PRO A 38 7.500 8.140 -3.928 1.00 0.00 O ATOM 581 CB PRO A 38 4.220 8.647 -3.169 1.00 0.00 C ATOM 582 CG PRO A 38 3.929 8.645 -4.664 1.00 0.00 C ATOM 583 CD PRO A 38 4.509 9.983 -5.117 1.00 0.00 C ATOM 0 HA PRO A 38 5.660 9.947 -2.171 1.00 0.00 H new ATOM 0 HB2 PRO A 38 4.264 7.635 -2.765 1.00 0.00 H new ATOM 0 HB3 PRO A 38 3.452 9.180 -2.609 1.00 0.00 H new ATOM 0 HG2 PRO A 38 4.406 7.805 -5.169 1.00 0.00 H new ATOM 0 HG3 PRO A 38 2.861 8.576 -4.869 1.00 0.00 H new ATOM 0 HD2 PRO A 38 4.800 9.952 -6.167 1.00 0.00 H new ATOM 0 HD3 PRO A 38 3.779 10.786 -5.012 1.00 0.00 H new ATOM 591 N THR A 39 6.891 7.777 -1.792 1.00 0.00 N ATOM 592 CA THR A 39 7.961 6.841 -1.487 1.00 0.00 C ATOM 593 C THR A 39 7.362 5.607 -0.816 1.00 0.00 C ATOM 594 O THR A 39 6.309 5.698 -0.185 1.00 0.00 O ATOM 595 CB THR A 39 9.021 7.565 -0.650 1.00 0.00 C ATOM 596 OG1 THR A 39 9.462 8.692 -1.388 1.00 0.00 O ATOM 597 CG2 THR A 39 10.229 6.681 -0.358 1.00 0.00 C ATOM 0 H THR A 39 6.263 7.947 -1.006 1.00 0.00 H new ATOM 0 HA THR A 39 8.466 6.484 -2.385 1.00 0.00 H new ATOM 0 HB THR A 39 8.573 7.845 0.303 1.00 0.00 H new ATOM 0 HG1 THR A 39 10.141 9.175 -0.873 1.00 0.00 H new ATOM 0 HG21 THR A 39 10.952 7.238 0.238 1.00 0.00 H new ATOM 0 HG22 THR A 39 9.908 5.797 0.194 1.00 0.00 H new ATOM 0 HG23 THR A 39 10.691 6.375 -1.296 1.00 0.00 H new ATOM 605 N THR A 40 7.992 4.450 -1.022 1.00 0.00 N ATOM 606 CA THR A 40 7.388 3.152 -0.802 1.00 0.00 C ATOM 607 C THR A 40 8.390 2.215 -0.129 1.00 0.00 C ATOM 608 O THR A 40 9.205 1.573 -0.791 1.00 0.00 O ATOM 609 CB THR A 40 6.860 2.651 -2.151 1.00 0.00 C ATOM 610 OG1 THR A 40 5.874 3.563 -2.582 1.00 0.00 O ATOM 611 CG2 THR A 40 6.200 1.281 -2.060 1.00 0.00 C ATOM 0 H THR A 40 8.955 4.397 -1.353 1.00 0.00 H new ATOM 0 HA THR A 40 6.543 3.203 -0.116 1.00 0.00 H new ATOM 0 HB THR A 40 7.707 2.571 -2.833 1.00 0.00 H new ATOM 0 HG1 THR A 40 5.554 3.303 -3.471 1.00 0.00 H new ATOM 0 HG21 THR A 40 5.847 0.981 -3.047 1.00 0.00 H new ATOM 0 HG22 THR A 40 6.924 0.552 -1.697 1.00 0.00 H new ATOM 0 HG23 THR A 40 5.356 1.329 -1.372 1.00 0.00 H new ATOM 619 N ILE A 41 8.322 2.136 1.201 1.00 0.00 N ATOM 620 CA ILE A 41 9.112 1.191 1.976 1.00 0.00 C ATOM 621 C ILE A 41 8.392 -0.148 1.860 1.00 0.00 C ATOM 622 O ILE A 41 7.191 -0.189 2.119 1.00 0.00 O ATOM 623 CB ILE A 41 9.223 1.643 3.446 1.00 0.00 C ATOM 624 CG1 ILE A 41 10.082 2.904 3.648 1.00 0.00 C ATOM 625 CG2 ILE A 41 9.838 0.529 4.307 1.00 0.00 C ATOM 626 CD1 ILE A 41 9.515 4.170 2.997 1.00 0.00 C ATOM 0 H ILE A 41 7.715 2.729 1.768 1.00 0.00 H new ATOM 0 HA ILE A 41 10.134 1.121 1.603 1.00 0.00 H new ATOM 0 HB ILE A 41 8.201 1.872 3.748 1.00 0.00 H new ATOM 0 HG12 ILE A 41 10.199 3.081 4.717 1.00 0.00 H new ATOM 0 HG13 ILE A 41 11.078 2.718 3.245 1.00 0.00 H new ATOM 0 HG21 ILE A 41 9.909 0.866 5.341 1.00 0.00 H new ATOM 0 HG22 ILE A 41 9.208 -0.359 4.257 1.00 0.00 H new ATOM 0 HG23 ILE A 41 10.834 0.289 3.935 1.00 0.00 H new ATOM 0 HD11 ILE A 41 10.184 5.009 3.190 1.00 0.00 H new ATOM 0 HD12 ILE A 41 9.425 4.017 1.922 1.00 0.00 H new ATOM 0 HD13 ILE A 41 8.532 4.386 3.416 1.00 0.00 H new ATOM 638 N ILE A 42 9.090 -1.221 1.472 1.00 0.00 N ATOM 639 CA ILE A 42 8.544 -2.571 1.474 1.00 0.00 C ATOM 640 C ILE A 42 9.487 -3.476 2.268 1.00 0.00 C ATOM 641 O ILE A 42 10.600 -3.767 1.822 1.00 0.00 O ATOM 642 CB ILE A 42 8.302 -3.081 0.047 1.00 0.00 C ATOM 643 CG1 ILE A 42 7.354 -2.147 -0.718 1.00 0.00 C ATOM 644 CG2 ILE A 42 7.702 -4.491 0.126 1.00 0.00 C ATOM 645 CD1 ILE A 42 7.128 -2.558 -2.177 1.00 0.00 C ATOM 0 H ILE A 42 10.055 -1.170 1.147 1.00 0.00 H new ATOM 0 HA ILE A 42 7.567 -2.574 1.957 1.00 0.00 H new ATOM 0 HB ILE A 42 9.250 -3.105 -0.491 1.00 0.00 H new ATOM 0 HG12 ILE A 42 6.393 -2.120 -0.205 1.00 0.00 H new ATOM 0 HG13 ILE A 42 7.758 -1.135 -0.693 1.00 0.00 H new ATOM 0 HG21 ILE A 42 7.524 -4.868 -0.881 1.00 0.00 H new ATOM 0 HG22 ILE A 42 8.396 -5.153 0.644 1.00 0.00 H new ATOM 0 HG23 ILE A 42 6.759 -4.455 0.672 1.00 0.00 H new ATOM 0 HD11 ILE A 42 6.448 -1.852 -2.653 1.00 0.00 H new ATOM 0 HD12 ILE A 42 8.081 -2.558 -2.707 1.00 0.00 H new ATOM 0 HD13 ILE A 42 6.695 -3.558 -2.210 1.00 0.00 H new ATOM 657 N GLU A 43 9.038 -3.902 3.452 1.00 0.00 N ATOM 658 CA GLU A 43 9.829 -4.681 4.392 1.00 0.00 C ATOM 659 C GLU A 43 9.307 -6.118 4.440 1.00 0.00 C ATOM 660 O GLU A 43 8.097 -6.346 4.505 1.00 0.00 O ATOM 661 CB GLU A 43 9.771 -4.014 5.770 1.00 0.00 C ATOM 662 CG GLU A 43 10.721 -4.670 6.779 1.00 0.00 C ATOM 663 CD GLU A 43 10.602 -3.998 8.140 1.00 0.00 C ATOM 664 OE1 GLU A 43 10.903 -2.787 8.195 1.00 0.00 O ATOM 665 OE2 GLU A 43 10.194 -4.702 9.087 1.00 0.00 O ATOM 0 H GLU A 43 8.094 -3.708 3.785 1.00 0.00 H new ATOM 0 HA GLU A 43 10.870 -4.716 4.071 1.00 0.00 H new ATOM 0 HB2 GLU A 43 10.024 -2.958 5.670 1.00 0.00 H new ATOM 0 HB3 GLU A 43 8.751 -4.063 6.151 1.00 0.00 H new ATOM 0 HG2 GLU A 43 10.488 -5.731 6.869 1.00 0.00 H new ATOM 0 HG3 GLU A 43 11.748 -4.598 6.420 1.00 0.00 H new ATOM 672 N VAL A 44 10.229 -7.084 4.427 1.00 0.00 N ATOM 673 CA VAL A 44 9.930 -8.488 4.653 1.00 0.00 C ATOM 674 C VAL A 44 9.623 -8.695 6.141 1.00 0.00 C ATOM 675 O VAL A 44 10.497 -9.034 6.937 1.00 0.00 O ATOM 676 CB VAL A 44 11.067 -9.368 4.096 1.00 0.00 C ATOM 677 CG1 VAL A 44 12.468 -8.928 4.549 1.00 0.00 C ATOM 678 CG2 VAL A 44 10.856 -10.856 4.403 1.00 0.00 C ATOM 0 H VAL A 44 11.218 -6.903 4.256 1.00 0.00 H new ATOM 0 HA VAL A 44 9.039 -8.800 4.109 1.00 0.00 H new ATOM 0 HB VAL A 44 11.021 -9.225 3.016 1.00 0.00 H new ATOM 0 HG11 VAL A 44 13.216 -9.594 4.118 1.00 0.00 H new ATOM 0 HG12 VAL A 44 12.655 -7.907 4.215 1.00 0.00 H new ATOM 0 HG13 VAL A 44 12.529 -8.970 5.636 1.00 0.00 H new ATOM 0 HG21 VAL A 44 11.683 -11.434 3.990 1.00 0.00 H new ATOM 0 HG22 VAL A 44 10.814 -11.002 5.482 1.00 0.00 H new ATOM 0 HG23 VAL A 44 9.920 -11.191 3.955 1.00 0.00 H new ATOM 688 N ASN A 45 8.365 -8.455 6.512 1.00 0.00 N ATOM 689 CA ASN A 45 7.810 -8.651 7.847 1.00 0.00 C ATOM 690 C ASN A 45 7.867 -10.129 8.260 1.00 0.00 C ATOM 691 O ASN A 45 6.846 -10.808 8.336 1.00 0.00 O ATOM 692 CB ASN A 45 6.373 -8.107 7.850 1.00 0.00 C ATOM 693 CG ASN A 45 5.712 -8.127 9.228 1.00 0.00 C ATOM 694 OD1 ASN A 45 5.771 -7.146 9.961 1.00 0.00 O ATOM 695 ND2 ASN A 45 5.037 -9.215 9.584 1.00 0.00 N ATOM 0 H ASN A 45 7.672 -8.100 5.853 1.00 0.00 H new ATOM 0 HA ASN A 45 8.402 -8.109 8.584 1.00 0.00 H new ATOM 0 HB2 ASN A 45 6.380 -7.084 7.475 1.00 0.00 H new ATOM 0 HB3 ASN A 45 5.770 -8.695 7.159 1.00 0.00 H new ATOM 0 HD21 ASN A 45 4.555 -9.245 10.482 1.00 0.00 H new ATOM 0 HD22 ASN A 45 5.001 -10.020 8.959 1.00 0.00 H new ATOM 702 N GLY A 46 9.065 -10.643 8.536 1.00 0.00 N ATOM 703 CA GLY A 46 9.284 -12.032 8.904 1.00 0.00 C ATOM 704 C GLY A 46 8.785 -12.966 7.801 1.00 0.00 C ATOM 705 O GLY A 46 9.426 -13.098 6.762 1.00 0.00 O ATOM 0 H GLY A 46 9.923 -10.092 8.508 1.00 0.00 H new ATOM 0 HA2 GLY A 46 10.346 -12.204 9.081 1.00 0.00 H new ATOM 0 HA3 GLY A 46 8.766 -12.253 9.837 1.00 0.00 H new ATOM 709 N ASP A 47 7.637 -13.610 8.032 1.00 0.00 N ATOM 710 CA ASP A 47 6.985 -14.464 7.047 1.00 0.00 C ATOM 711 C ASP A 47 6.261 -13.613 5.997 1.00 0.00 C ATOM 712 O ASP A 47 6.115 -14.013 4.840 1.00 0.00 O ATOM 713 CB ASP A 47 6.015 -15.432 7.759 1.00 0.00 C ATOM 714 CG ASP A 47 4.553 -15.112 7.477 1.00 0.00 C ATOM 715 OD1 ASP A 47 4.048 -14.146 8.089 1.00 0.00 O ATOM 716 OD2 ASP A 47 4.002 -15.786 6.577 1.00 0.00 O ATOM 0 H ASP A 47 7.133 -13.550 8.917 1.00 0.00 H new ATOM 0 HA ASP A 47 7.737 -15.056 6.526 1.00 0.00 H new ATOM 0 HB2 ASP A 47 6.227 -16.452 7.440 1.00 0.00 H new ATOM 0 HB3 ASP A 47 6.191 -15.391 8.834 1.00 0.00 H new ATOM 721 N THR A 48 5.721 -12.484 6.439 1.00 0.00 N ATOM 722 CA THR A 48 4.789 -11.637 5.732 1.00 0.00 C ATOM 723 C THR A 48 5.607 -10.551 5.028 1.00 0.00 C ATOM 724 O THR A 48 6.834 -10.521 5.127 1.00 0.00 O ATOM 725 CB THR A 48 3.795 -11.068 6.775 1.00 0.00 C ATOM 726 OG1 THR A 48 4.135 -11.466 8.106 1.00 0.00 O ATOM 727 CG2 THR A 48 2.343 -11.482 6.499 1.00 0.00 C ATOM 0 H THR A 48 5.943 -12.118 7.365 1.00 0.00 H new ATOM 0 HA THR A 48 4.210 -12.165 4.975 1.00 0.00 H new ATOM 0 HB THR A 48 3.874 -9.985 6.683 1.00 0.00 H new ATOM 0 HG1 THR A 48 3.922 -12.415 8.228 1.00 0.00 H new ATOM 0 HG21 THR A 48 1.692 -11.055 7.261 1.00 0.00 H new ATOM 0 HG22 THR A 48 2.041 -11.117 5.517 1.00 0.00 H new ATOM 0 HG23 THR A 48 2.264 -12.569 6.522 1.00 0.00 H new ATOM 735 N VAL A 49 4.944 -9.636 4.324 1.00 0.00 N ATOM 736 CA VAL A 49 5.589 -8.458 3.774 1.00 0.00 C ATOM 737 C VAL A 49 4.685 -7.267 4.081 1.00 0.00 C ATOM 738 O VAL A 49 3.472 -7.435 4.180 1.00 0.00 O ATOM 739 CB VAL A 49 5.912 -8.697 2.290 1.00 0.00 C ATOM 740 CG1 VAL A 49 4.703 -9.216 1.509 1.00 0.00 C ATOM 741 CG2 VAL A 49 6.479 -7.456 1.593 1.00 0.00 C ATOM 0 H VAL A 49 3.946 -9.695 4.122 1.00 0.00 H new ATOM 0 HA VAL A 49 6.557 -8.239 4.225 1.00 0.00 H new ATOM 0 HB VAL A 49 6.685 -9.465 2.290 1.00 0.00 H new ATOM 0 HG11 VAL A 49 4.982 -9.369 0.466 1.00 0.00 H new ATOM 0 HG12 VAL A 49 4.371 -10.161 1.938 1.00 0.00 H new ATOM 0 HG13 VAL A 49 3.894 -8.488 1.565 1.00 0.00 H new ATOM 0 HG21 VAL A 49 6.687 -7.688 0.548 1.00 0.00 H new ATOM 0 HG22 VAL A 49 5.753 -6.645 1.647 1.00 0.00 H new ATOM 0 HG23 VAL A 49 7.401 -7.151 2.087 1.00 0.00 H new ATOM 751 N ILE A 50 5.259 -6.087 4.319 1.00 0.00 N ATOM 752 CA ILE A 50 4.497 -4.886 4.634 1.00 0.00 C ATOM 753 C ILE A 50 4.988 -3.752 3.750 1.00 0.00 C ATOM 754 O ILE A 50 6.198 -3.574 3.609 1.00 0.00 O ATOM 755 CB ILE A 50 4.558 -4.561 6.141 1.00 0.00 C ATOM 756 CG1 ILE A 50 3.655 -3.357 6.471 1.00 0.00 C ATOM 757 CG2 ILE A 50 5.990 -4.304 6.628 1.00 0.00 C ATOM 758 CD1 ILE A 50 3.529 -3.100 7.975 1.00 0.00 C ATOM 0 H ILE A 50 6.268 -5.941 4.298 1.00 0.00 H new ATOM 0 HA ILE A 50 3.440 -5.044 4.421 1.00 0.00 H new ATOM 0 HB ILE A 50 4.192 -5.440 6.671 1.00 0.00 H new ATOM 0 HG12 ILE A 50 4.056 -2.466 5.988 1.00 0.00 H new ATOM 0 HG13 ILE A 50 2.663 -3.528 6.053 1.00 0.00 H new ATOM 0 HG21 ILE A 50 5.977 -4.080 7.695 1.00 0.00 H new ATOM 0 HG22 ILE A 50 6.599 -5.190 6.451 1.00 0.00 H new ATOM 0 HG23 ILE A 50 6.413 -3.459 6.085 1.00 0.00 H new ATOM 0 HD11 ILE A 50 2.881 -2.240 8.144 1.00 0.00 H new ATOM 0 HD12 ILE A 50 3.101 -3.978 8.460 1.00 0.00 H new ATOM 0 HD13 ILE A 50 4.515 -2.899 8.394 1.00 0.00 H new ATOM 770 N ILE A 51 4.049 -3.023 3.139 1.00 0.00 N ATOM 771 CA ILE A 51 4.322 -1.859 2.312 1.00 0.00 C ATOM 772 C ILE A 51 3.817 -0.617 3.044 1.00 0.00 C ATOM 773 O ILE A 51 2.694 -0.635 3.543 1.00 0.00 O ATOM 774 CB ILE A 51 3.715 -2.042 0.904 1.00 0.00 C ATOM 775 CG1 ILE A 51 4.033 -0.852 -0.020 1.00 0.00 C ATOM 776 CG2 ILE A 51 2.217 -2.376 0.896 1.00 0.00 C ATOM 777 CD1 ILE A 51 2.960 0.240 -0.061 1.00 0.00 C ATOM 0 H ILE A 51 3.054 -3.237 3.212 1.00 0.00 H new ATOM 0 HA ILE A 51 5.393 -1.734 2.152 1.00 0.00 H new ATOM 0 HB ILE A 51 4.209 -2.926 0.502 1.00 0.00 H new ATOM 0 HG12 ILE A 51 4.974 -0.404 0.300 1.00 0.00 H new ATOM 0 HG13 ILE A 51 4.187 -1.228 -1.032 1.00 0.00 H new ATOM 0 HG21 ILE A 51 1.875 -2.487 -0.133 1.00 0.00 H new ATOM 0 HG22 ILE A 51 2.049 -3.307 1.437 1.00 0.00 H new ATOM 0 HG23 ILE A 51 1.662 -1.571 1.378 1.00 0.00 H new ATOM 0 HD11 ILE A 51 3.275 1.034 -0.738 1.00 0.00 H new ATOM 0 HD12 ILE A 51 2.021 -0.186 -0.413 1.00 0.00 H new ATOM 0 HD13 ILE A 51 2.820 0.650 0.939 1.00 0.00 H new ATOM 789 N LYS A 52 4.634 0.443 3.103 1.00 0.00 N ATOM 790 CA LYS A 52 4.250 1.766 3.583 1.00 0.00 C ATOM 791 C LYS A 52 4.322 2.748 2.414 1.00 0.00 C ATOM 792 O LYS A 52 5.416 3.019 1.918 1.00 0.00 O ATOM 793 CB LYS A 52 5.183 2.259 4.698 1.00 0.00 C ATOM 794 CG LYS A 52 5.353 1.280 5.866 1.00 0.00 C ATOM 795 CD LYS A 52 6.396 1.796 6.874 1.00 0.00 C ATOM 796 CE LYS A 52 5.973 3.031 7.688 1.00 0.00 C ATOM 797 NZ LYS A 52 4.936 2.718 8.691 1.00 0.00 N ATOM 0 H LYS A 52 5.609 0.396 2.808 1.00 0.00 H new ATOM 0 HA LYS A 52 3.240 1.704 3.987 1.00 0.00 H new ATOM 0 HB2 LYS A 52 6.163 2.466 4.269 1.00 0.00 H new ATOM 0 HB3 LYS A 52 4.799 3.203 5.085 1.00 0.00 H new ATOM 0 HG2 LYS A 52 4.396 1.139 6.368 1.00 0.00 H new ATOM 0 HG3 LYS A 52 5.661 0.306 5.486 1.00 0.00 H new ATOM 0 HD2 LYS A 52 6.636 0.990 7.567 1.00 0.00 H new ATOM 0 HD3 LYS A 52 7.312 2.035 6.333 1.00 0.00 H new ATOM 0 HE2 LYS A 52 6.846 3.448 8.190 1.00 0.00 H new ATOM 0 HE3 LYS A 52 5.599 3.798 7.010 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 4.517 3.602 9.044 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 4.195 2.134 8.254 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 5.365 2.197 9.483 1.00 0.00 H new ATOM 811 N THR A 53 3.179 3.295 2.000 1.00 0.00 N ATOM 812 CA THR A 53 3.097 4.432 1.095 1.00 0.00 C ATOM 813 C THR A 53 3.289 5.707 1.918 1.00 0.00 C ATOM 814 O THR A 53 2.493 5.945 2.828 1.00 0.00 O ATOM 815 CB THR A 53 1.708 4.469 0.436 1.00 0.00 C ATOM 816 OG1 THR A 53 0.709 4.269 1.414 1.00 0.00 O ATOM 817 CG2 THR A 53 1.526 3.393 -0.633 1.00 0.00 C ATOM 0 H THR A 53 2.266 2.949 2.294 1.00 0.00 H new ATOM 0 HA THR A 53 3.860 4.351 0.321 1.00 0.00 H new ATOM 0 HB THR A 53 1.622 5.447 -0.038 1.00 0.00 H new ATOM 0 HG1 THR A 53 1.092 4.404 2.306 1.00 0.00 H new ATOM 0 HG21 THR A 53 0.526 3.471 -1.061 1.00 0.00 H new ATOM 0 HG22 THR A 53 2.269 3.531 -1.419 1.00 0.00 H new ATOM 0 HG23 THR A 53 1.653 2.408 -0.183 1.00 0.00 H new ATOM 825 N GLN A 54 4.306 6.515 1.603 1.00 0.00 N ATOM 826 CA GLN A 54 4.586 7.787 2.258 1.00 0.00 C ATOM 827 C GLN A 54 4.473 8.948 1.264 1.00 0.00 C ATOM 828 O GLN A 54 4.929 8.828 0.124 1.00 0.00 O ATOM 829 CB GLN A 54 5.994 7.751 2.863 1.00 0.00 C ATOM 830 CG GLN A 54 6.150 6.629 3.898 1.00 0.00 C ATOM 831 CD GLN A 54 7.520 6.656 4.568 1.00 0.00 C ATOM 832 OE1 GLN A 54 8.358 7.502 4.276 1.00 0.00 O ATOM 833 NE2 GLN A 54 7.771 5.713 5.471 1.00 0.00 N ATOM 0 H GLN A 54 4.973 6.292 0.864 1.00 0.00 H new ATOM 0 HA GLN A 54 3.852 7.943 3.049 1.00 0.00 H new ATOM 0 HB2 GLN A 54 6.726 7.614 2.067 1.00 0.00 H new ATOM 0 HB3 GLN A 54 6.210 8.710 3.334 1.00 0.00 H new ATOM 0 HG2 GLN A 54 5.373 6.725 4.657 1.00 0.00 H new ATOM 0 HG3 GLN A 54 6.003 5.664 3.412 1.00 0.00 H new ATOM 0 HE21 GLN A 54 7.057 5.020 5.697 1.00 0.00 H new ATOM 0 HE22 GLN A 54 8.677 5.682 5.938 1.00 0.00 H new ATOM 842 N SER A 55 3.887 10.071 1.707 1.00 0.00 N ATOM 843 CA SER A 55 3.797 11.333 0.978 1.00 0.00 C ATOM 844 C SER A 55 3.350 12.444 1.943 1.00 0.00 C ATOM 845 O SER A 55 3.370 12.261 3.161 1.00 0.00 O ATOM 846 CB SER A 55 2.841 11.211 -0.219 1.00 0.00 C ATOM 847 OG SER A 55 2.949 12.343 -1.073 1.00 0.00 O ATOM 0 H SER A 55 3.445 10.120 2.625 1.00 0.00 H new ATOM 0 HA SER A 55 4.778 11.588 0.577 1.00 0.00 H new ATOM 0 HB2 SER A 55 3.068 10.304 -0.780 1.00 0.00 H new ATOM 0 HB3 SER A 55 1.815 11.116 0.138 1.00 0.00 H new ATOM 0 HG SER A 55 3.701 12.218 -1.689 1.00 0.00 H new ATOM 853 N THR A 56 2.938 13.591 1.394 1.00 0.00 N ATOM 854 CA THR A 56 2.588 14.803 2.133 1.00 0.00 C ATOM 855 C THR A 56 1.383 14.579 3.061 1.00 0.00 C ATOM 856 O THR A 56 0.228 14.691 2.651 1.00 0.00 O ATOM 857 CB THR A 56 2.424 16.002 1.174 1.00 0.00 C ATOM 858 OG1 THR A 56 2.072 17.172 1.882 1.00 0.00 O ATOM 859 CG2 THR A 56 1.402 15.798 0.052 1.00 0.00 C ATOM 0 H THR A 56 2.836 13.703 0.385 1.00 0.00 H new ATOM 0 HA THR A 56 3.415 15.055 2.797 1.00 0.00 H new ATOM 0 HB THR A 56 3.402 16.100 0.704 1.00 0.00 H new ATOM 0 HG1 THR A 56 2.133 17.002 2.845 1.00 0.00 H new ATOM 0 HG21 THR A 56 1.358 16.694 -0.568 1.00 0.00 H new ATOM 0 HG22 THR A 56 1.699 14.947 -0.561 1.00 0.00 H new ATOM 0 HG23 THR A 56 0.420 15.608 0.485 1.00 0.00 H new ATOM 867 N PHE A 57 1.665 14.240 4.324 1.00 0.00 N ATOM 868 CA PHE A 57 0.684 14.056 5.394 1.00 0.00 C ATOM 869 C PHE A 57 -0.352 12.980 5.059 1.00 0.00 C ATOM 870 O PHE A 57 -1.421 12.941 5.660 1.00 0.00 O ATOM 871 CB PHE A 57 -0.006 15.387 5.725 1.00 0.00 C ATOM 872 CG PHE A 57 0.941 16.555 5.915 1.00 0.00 C ATOM 873 CD1 PHE A 57 1.721 16.644 7.081 1.00 0.00 C ATOM 874 CD2 PHE A 57 1.071 17.532 4.911 1.00 0.00 C ATOM 875 CE1 PHE A 57 2.622 17.710 7.247 1.00 0.00 C ATOM 876 CE2 PHE A 57 1.972 18.597 5.077 1.00 0.00 C ATOM 877 CZ PHE A 57 2.748 18.686 6.244 1.00 0.00 C ATOM 0 H PHE A 57 2.622 14.080 4.639 1.00 0.00 H new ATOM 0 HA PHE A 57 1.229 13.710 6.272 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -0.705 15.629 4.924 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -0.594 15.261 6.634 1.00 0.00 H new ATOM 0 HD1 PHE A 57 1.628 15.892 7.851 1.00 0.00 H new ATOM 0 HD2 PHE A 57 0.477 17.463 4.011 1.00 0.00 H new ATOM 0 HE1 PHE A 57 3.217 17.779 8.145 1.00 0.00 H new ATOM 0 HE2 PHE A 57 2.068 19.348 4.307 1.00 0.00 H new ATOM 0 HZ PHE A 57 3.441 19.504 6.371 1.00 0.00 H new ATOM 887 N LYS A 58 -0.048 12.122 4.084 1.00 0.00 N ATOM 888 CA LYS A 58 -0.944 11.113 3.543 1.00 0.00 C ATOM 889 C LYS A 58 -0.101 9.851 3.473 1.00 0.00 C ATOM 890 O LYS A 58 0.445 9.508 2.426 1.00 0.00 O ATOM 891 CB LYS A 58 -1.472 11.575 2.176 1.00 0.00 C ATOM 892 CG LYS A 58 -2.455 12.742 2.363 1.00 0.00 C ATOM 893 CD LYS A 58 -2.506 13.663 1.140 1.00 0.00 C ATOM 894 CE LYS A 58 -3.147 15.000 1.544 1.00 0.00 C ATOM 895 NZ LYS A 58 -3.099 15.998 0.458 1.00 0.00 N ATOM 0 H LYS A 58 0.868 12.115 3.635 1.00 0.00 H new ATOM 0 HA LYS A 58 -1.833 10.937 4.149 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -0.642 11.885 1.542 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -1.968 10.747 1.669 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -3.452 12.346 2.559 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -2.165 13.322 3.239 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -1.501 13.830 0.753 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -3.082 13.196 0.341 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -4.184 14.830 1.832 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -2.634 15.396 2.420 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -3.714 16.802 0.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -2.122 16.333 0.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -3.428 15.563 -0.428 1.00 0.00 H new ATOM 909 N ASN A 59 0.075 9.245 4.647 1.00 0.00 N ATOM 910 CA ASN A 59 0.952 8.113 4.872 1.00 0.00 C ATOM 911 C ASN A 59 0.053 6.958 5.280 1.00 0.00 C ATOM 912 O ASN A 59 -0.778 7.120 6.172 1.00 0.00 O ATOM 913 CB ASN A 59 1.997 8.439 5.949 1.00 0.00 C ATOM 914 CG ASN A 59 3.008 9.471 5.451 1.00 0.00 C ATOM 915 OD1 ASN A 59 4.161 9.152 5.188 1.00 0.00 O ATOM 916 ND2 ASN A 59 2.573 10.715 5.278 1.00 0.00 N ATOM 0 H ASN A 59 -0.410 9.545 5.493 1.00 0.00 H new ATOM 0 HA ASN A 59 1.519 7.857 3.977 1.00 0.00 H new ATOM 0 HB2 ASN A 59 1.497 8.818 6.840 1.00 0.00 H new ATOM 0 HB3 ASN A 59 2.519 7.527 6.240 1.00 0.00 H new ATOM 0 HD21 ASN A 59 3.204 11.431 4.918 1.00 0.00 H new ATOM 0 HD22 ASN A 59 1.608 10.954 5.505 1.00 0.00 H new ATOM 923 N THR A 60 0.184 5.828 4.596 1.00 0.00 N ATOM 924 CA THR A 60 -0.708 4.683 4.708 1.00 0.00 C ATOM 925 C THR A 60 0.144 3.437 4.497 1.00 0.00 C ATOM 926 O THR A 60 1.244 3.541 3.949 1.00 0.00 O ATOM 927 CB THR A 60 -1.849 4.795 3.674 1.00 0.00 C ATOM 928 OG1 THR A 60 -1.437 5.510 2.522 1.00 0.00 O ATOM 929 CG2 THR A 60 -3.058 5.529 4.257 1.00 0.00 C ATOM 0 H THR A 60 0.939 5.680 3.926 1.00 0.00 H new ATOM 0 HA THR A 60 -1.186 4.637 5.686 1.00 0.00 H new ATOM 0 HB THR A 60 -2.117 3.773 3.407 1.00 0.00 H new ATOM 0 HG1 THR A 60 -0.652 5.074 2.130 1.00 0.00 H new ATOM 0 HG21 THR A 60 -3.844 5.591 3.504 1.00 0.00 H new ATOM 0 HG22 THR A 60 -3.430 4.985 5.125 1.00 0.00 H new ATOM 0 HG23 THR A 60 -2.763 6.534 4.557 1.00 0.00 H new ATOM 937 N GLU A 61 -0.327 2.274 4.945 1.00 0.00 N ATOM 938 CA GLU A 61 0.436 1.045 4.867 1.00 0.00 C ATOM 939 C GLU A 61 -0.507 -0.149 4.788 1.00 0.00 C ATOM 940 O GLU A 61 -1.673 -0.033 5.158 1.00 0.00 O ATOM 941 CB GLU A 61 1.403 0.956 6.057 1.00 0.00 C ATOM 942 CG GLU A 61 0.708 1.012 7.427 1.00 0.00 C ATOM 943 CD GLU A 61 1.712 0.970 8.571 1.00 0.00 C ATOM 944 OE1 GLU A 61 2.903 1.231 8.294 1.00 0.00 O ATOM 945 OE2 GLU A 61 1.286 0.715 9.714 1.00 0.00 O ATOM 0 H GLU A 61 -1.248 2.165 5.370 1.00 0.00 H new ATOM 0 HA GLU A 61 1.039 1.037 3.959 1.00 0.00 H new ATOM 0 HB2 GLU A 61 1.969 0.027 5.985 1.00 0.00 H new ATOM 0 HB3 GLU A 61 2.122 1.773 5.991 1.00 0.00 H new ATOM 0 HG2 GLU A 61 0.115 1.924 7.497 1.00 0.00 H new ATOM 0 HG3 GLU A 61 0.017 0.174 7.519 1.00 0.00 H new ATOM 952 N ILE A 62 0.006 -1.266 4.269 1.00 0.00 N ATOM 953 CA ILE A 62 -0.712 -2.522 4.121 1.00 0.00 C ATOM 954 C ILE A 62 0.282 -3.635 4.456 1.00 0.00 C ATOM 955 O ILE A 62 1.332 -3.734 3.814 1.00 0.00 O ATOM 956 CB ILE A 62 -1.271 -2.652 2.684 1.00 0.00 C ATOM 957 CG1 ILE A 62 -2.324 -1.558 2.414 1.00 0.00 C ATOM 958 CG2 ILE A 62 -1.858 -4.050 2.439 1.00 0.00 C ATOM 959 CD1 ILE A 62 -2.960 -1.637 1.023 1.00 0.00 C ATOM 0 H ILE A 62 0.967 -1.317 3.930 1.00 0.00 H new ATOM 0 HA ILE A 62 -1.572 -2.579 4.789 1.00 0.00 H new ATOM 0 HB ILE A 62 -0.445 -2.515 1.986 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -3.109 -1.630 3.166 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -1.857 -0.581 2.534 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -2.243 -4.110 1.421 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -1.080 -4.801 2.578 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -2.669 -4.233 3.144 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -3.689 -0.835 0.910 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -2.186 -1.533 0.263 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -3.458 -2.599 0.905 1.00 0.00 H new ATOM 971 N SER A 63 -0.029 -4.467 5.451 1.00 0.00 N ATOM 972 CA SER A 63 0.642 -5.736 5.681 1.00 0.00 C ATOM 973 C SER A 63 -0.030 -6.774 4.782 1.00 0.00 C ATOM 974 O SER A 63 -1.228 -6.681 4.539 1.00 0.00 O ATOM 975 CB SER A 63 0.530 -6.087 7.167 1.00 0.00 C ATOM 976 OG SER A 63 -0.778 -5.804 7.627 1.00 0.00 O ATOM 0 H SER A 63 -0.767 -4.270 6.127 1.00 0.00 H new ATOM 0 HA SER A 63 1.704 -5.697 5.437 1.00 0.00 H new ATOM 0 HB2 SER A 63 0.759 -7.142 7.320 1.00 0.00 H new ATOM 0 HB3 SER A 63 1.259 -5.516 7.741 1.00 0.00 H new ATOM 0 HG SER A 63 -0.804 -4.899 8.001 1.00 0.00 H new ATOM 982 N PHE A 64 0.720 -7.730 4.228 1.00 0.00 N ATOM 983 CA PHE A 64 0.168 -8.687 3.283 1.00 0.00 C ATOM 984 C PHE A 64 1.002 -9.967 3.234 1.00 0.00 C ATOM 985 O PHE A 64 2.224 -9.948 3.385 1.00 0.00 O ATOM 986 CB PHE A 64 -0.020 -8.038 1.904 1.00 0.00 C ATOM 987 CG PHE A 64 1.234 -7.621 1.158 1.00 0.00 C ATOM 988 CD1 PHE A 64 1.906 -6.438 1.515 1.00 0.00 C ATOM 989 CD2 PHE A 64 1.654 -8.342 0.024 1.00 0.00 C ATOM 990 CE1 PHE A 64 2.992 -5.984 0.747 1.00 0.00 C ATOM 991 CE2 PHE A 64 2.694 -7.850 -0.780 1.00 0.00 C ATOM 992 CZ PHE A 64 3.368 -6.671 -0.417 1.00 0.00 C ATOM 0 H PHE A 64 1.713 -7.857 4.422 1.00 0.00 H new ATOM 0 HA PHE A 64 -0.821 -8.987 3.628 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -0.571 -8.736 1.274 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -0.648 -7.156 2.028 1.00 0.00 H new ATOM 0 HD1 PHE A 64 1.587 -5.877 2.381 1.00 0.00 H new ATOM 0 HD2 PHE A 64 1.175 -9.276 -0.228 1.00 0.00 H new ATOM 0 HE1 PHE A 64 3.538 -5.104 1.054 1.00 0.00 H new ATOM 0 HE2 PHE A 64 2.977 -8.378 -1.679 1.00 0.00 H new ATOM 0 HZ PHE A 64 4.172 -6.295 -1.032 1.00 0.00 H new ATOM 1002 N LYS A 65 0.309 -11.094 3.054 1.00 0.00 N ATOM 1003 CA LYS A 65 0.866 -12.431 2.950 1.00 0.00 C ATOM 1004 C LYS A 65 0.597 -12.895 1.524 1.00 0.00 C ATOM 1005 O LYS A 65 -0.540 -13.209 1.191 1.00 0.00 O ATOM 1006 CB LYS A 65 0.154 -13.328 3.974 1.00 0.00 C ATOM 1007 CG LYS A 65 0.548 -14.813 3.927 1.00 0.00 C ATOM 1008 CD LYS A 65 1.948 -15.100 4.484 1.00 0.00 C ATOM 1009 CE LYS A 65 2.982 -15.433 3.402 1.00 0.00 C ATOM 1010 NZ LYS A 65 4.289 -15.737 4.018 1.00 0.00 N ATOM 0 H LYS A 65 -0.708 -11.091 2.974 1.00 0.00 H new ATOM 0 HA LYS A 65 1.936 -12.465 3.157 1.00 0.00 H new ATOM 0 HB2 LYS A 65 0.360 -12.945 4.974 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -0.922 -13.249 3.817 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -0.183 -15.391 4.492 1.00 0.00 H new ATOM 0 HG3 LYS A 65 0.500 -15.160 2.895 1.00 0.00 H new ATOM 0 HD2 LYS A 65 2.291 -14.232 5.048 1.00 0.00 H new ATOM 0 HD3 LYS A 65 1.887 -15.932 5.185 1.00 0.00 H new ATOM 0 HE2 LYS A 65 2.642 -16.286 2.815 1.00 0.00 H new ATOM 0 HE3 LYS A 65 3.083 -14.593 2.715 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 4.769 -16.477 3.466 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 4.875 -14.878 4.030 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 4.144 -16.071 4.992 1.00 0.00 H new ATOM 1024 N LEU A 66 1.624 -12.920 0.675 1.00 0.00 N ATOM 1025 CA LEU A 66 1.507 -13.450 -0.676 1.00 0.00 C ATOM 1026 C LEU A 66 0.849 -14.841 -0.669 1.00 0.00 C ATOM 1027 O LEU A 66 1.457 -15.809 -0.220 1.00 0.00 O ATOM 1028 CB LEU A 66 2.874 -13.446 -1.384 1.00 0.00 C ATOM 1029 CG LEU A 66 4.047 -14.034 -0.566 1.00 0.00 C ATOM 1030 CD1 LEU A 66 4.988 -14.833 -1.478 1.00 0.00 C ATOM 1031 CD2 LEU A 66 4.860 -12.941 0.151 1.00 0.00 C ATOM 0 H LEU A 66 2.555 -12.574 0.906 1.00 0.00 H new ATOM 0 HA LEU A 66 0.850 -12.797 -1.250 1.00 0.00 H new ATOM 0 HB2 LEU A 66 2.784 -14.008 -2.314 1.00 0.00 H new ATOM 0 HB3 LEU A 66 3.121 -12.419 -1.655 1.00 0.00 H new ATOM 0 HG LEU A 66 3.608 -14.687 0.188 1.00 0.00 H new ATOM 0 HD11 LEU A 66 5.808 -15.240 -0.887 1.00 0.00 H new ATOM 0 HD12 LEU A 66 4.436 -15.649 -1.944 1.00 0.00 H new ATOM 0 HD13 LEU A 66 5.388 -14.178 -2.251 1.00 0.00 H new ATOM 0 HD21 LEU A 66 5.673 -13.402 0.713 1.00 0.00 H new ATOM 0 HD22 LEU A 66 5.273 -12.252 -0.586 1.00 0.00 H new ATOM 0 HD23 LEU A 66 4.211 -12.394 0.835 1.00 0.00 H new ATOM 1043 N GLY A 67 -0.394 -14.924 -1.156 1.00 0.00 N ATOM 1044 CA GLY A 67 -1.161 -16.155 -1.303 1.00 0.00 C ATOM 1045 C GLY A 67 -2.306 -16.239 -0.291 1.00 0.00 C ATOM 1046 O GLY A 67 -2.548 -17.312 0.254 1.00 0.00 O ATOM 0 H GLY A 67 -0.909 -14.101 -1.469 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -1.565 -16.212 -2.314 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -0.500 -17.012 -1.175 1.00 0.00 H new ATOM 1050 N VAL A 68 -2.999 -15.124 -0.025 1.00 0.00 N ATOM 1051 CA VAL A 68 -4.025 -15.013 1.014 1.00 0.00 C ATOM 1052 C VAL A 68 -4.993 -13.888 0.630 1.00 0.00 C ATOM 1053 O VAL A 68 -4.618 -12.988 -0.127 1.00 0.00 O ATOM 1054 CB VAL A 68 -3.353 -14.751 2.387 1.00 0.00 C ATOM 1055 CG1 VAL A 68 -4.308 -14.290 3.496 1.00 0.00 C ATOM 1056 CG2 VAL A 68 -2.622 -15.999 2.901 1.00 0.00 C ATOM 0 H VAL A 68 -2.857 -14.255 -0.540 1.00 0.00 H new ATOM 0 HA VAL A 68 -4.589 -15.942 1.098 1.00 0.00 H new ATOM 0 HB VAL A 68 -2.660 -13.936 2.181 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -3.747 -14.133 4.417 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -4.787 -13.357 3.199 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -5.069 -15.052 3.661 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -2.163 -15.780 3.865 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -3.334 -16.816 3.015 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -1.850 -16.288 2.188 1.00 0.00 H new ATOM 1066 N GLU A 69 -6.220 -13.935 1.172 1.00 0.00 N ATOM 1067 CA GLU A 69 -7.119 -12.794 1.233 1.00 0.00 C ATOM 1068 C GLU A 69 -7.267 -12.306 2.675 1.00 0.00 C ATOM 1069 O GLU A 69 -7.240 -13.110 3.606 1.00 0.00 O ATOM 1070 CB GLU A 69 -8.482 -13.107 0.603 1.00 0.00 C ATOM 1071 CG GLU A 69 -9.290 -14.236 1.263 1.00 0.00 C ATOM 1072 CD GLU A 69 -10.781 -13.990 1.073 1.00 0.00 C ATOM 1073 OE1 GLU A 69 -11.196 -13.811 -0.090 1.00 0.00 O ATOM 1074 OE2 GLU A 69 -11.482 -13.848 2.100 1.00 0.00 O ATOM 0 H GLU A 69 -6.612 -14.782 1.583 1.00 0.00 H new ATOM 0 HA GLU A 69 -6.678 -11.989 0.644 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -9.084 -12.199 0.620 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -8.325 -13.365 -0.444 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -9.013 -15.196 0.827 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -9.054 -14.289 2.326 1.00 0.00 H new ATOM 1081 N PHE A 70 -7.407 -10.994 2.869 1.00 0.00 N ATOM 1082 CA PHE A 70 -7.614 -10.398 4.182 1.00 0.00 C ATOM 1083 C PHE A 70 -8.317 -9.050 4.020 1.00 0.00 C ATOM 1084 O PHE A 70 -8.144 -8.389 2.996 1.00 0.00 O ATOM 1085 CB PHE A 70 -6.274 -10.250 4.917 1.00 0.00 C ATOM 1086 CG PHE A 70 -5.271 -9.346 4.222 1.00 0.00 C ATOM 1087 CD1 PHE A 70 -4.529 -9.821 3.124 1.00 0.00 C ATOM 1088 CD2 PHE A 70 -5.106 -8.017 4.654 1.00 0.00 C ATOM 1089 CE1 PHE A 70 -3.655 -8.961 2.441 1.00 0.00 C ATOM 1090 CE2 PHE A 70 -4.212 -7.166 3.986 1.00 0.00 C ATOM 1091 CZ PHE A 70 -3.506 -7.631 2.865 1.00 0.00 C ATOM 0 H PHE A 70 -7.379 -10.313 2.110 1.00 0.00 H new ATOM 0 HA PHE A 70 -8.248 -11.048 4.786 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -6.464 -9.860 5.917 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -5.830 -11.238 5.039 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -4.632 -10.848 2.807 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -5.668 -7.651 5.501 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -3.097 -9.322 1.590 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -4.067 -6.154 4.334 1.00 0.00 H new ATOM 0 HZ PHE A 70 -2.847 -6.964 2.328 1.00 0.00 H new ATOM 1101 N ASP A 71 -9.136 -8.663 5.003 1.00 0.00 N ATOM 1102 CA ASP A 71 -9.774 -7.352 5.027 1.00 0.00 C ATOM 1103 C ASP A 71 -8.747 -6.304 5.459 1.00 0.00 C ATOM 1104 O ASP A 71 -7.876 -6.606 6.273 1.00 0.00 O ATOM 1105 CB ASP A 71 -10.999 -7.369 5.944 1.00 0.00 C ATOM 1106 CG ASP A 71 -11.776 -6.063 5.830 1.00 0.00 C ATOM 1107 OD1 ASP A 71 -12.375 -5.849 4.754 1.00 0.00 O ATOM 1108 OD2 ASP A 71 -11.772 -5.305 6.822 1.00 0.00 O ATOM 0 H ASP A 71 -9.372 -9.252 5.801 1.00 0.00 H new ATOM 0 HA ASP A 71 -10.130 -7.093 4.030 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -11.645 -8.206 5.680 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -10.684 -7.522 6.976 1.00 0.00 H new ATOM 1113 N GLU A 72 -8.816 -5.108 4.875 1.00 0.00 N ATOM 1114 CA GLU A 72 -7.857 -4.029 5.043 1.00 0.00 C ATOM 1115 C GLU A 72 -8.633 -2.709 5.054 1.00 0.00 C ATOM 1116 O GLU A 72 -9.736 -2.644 4.514 1.00 0.00 O ATOM 1117 CB GLU A 72 -6.839 -4.121 3.892 1.00 0.00 C ATOM 1118 CG GLU A 72 -5.762 -3.029 3.883 1.00 0.00 C ATOM 1119 CD GLU A 72 -4.992 -2.982 5.194 1.00 0.00 C ATOM 1120 OE1 GLU A 72 -5.489 -2.277 6.099 1.00 0.00 O ATOM 1121 OE2 GLU A 72 -3.955 -3.674 5.267 1.00 0.00 O ATOM 0 H GLU A 72 -9.578 -4.859 4.245 1.00 0.00 H new ATOM 0 HA GLU A 72 -7.304 -4.094 5.980 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -6.348 -5.093 3.940 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -7.380 -4.083 2.946 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -5.069 -3.209 3.061 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -6.228 -2.061 3.701 1.00 0.00 H new ATOM 1128 N THR A 73 -8.071 -1.664 5.662 1.00 0.00 N ATOM 1129 CA THR A 73 -8.699 -0.357 5.792 1.00 0.00 C ATOM 1130 C THR A 73 -7.641 0.726 5.603 1.00 0.00 C ATOM 1131 O THR A 73 -7.137 1.281 6.578 1.00 0.00 O ATOM 1132 CB THR A 73 -9.417 -0.255 7.149 1.00 0.00 C ATOM 1133 OG1 THR A 73 -10.346 -1.312 7.285 1.00 0.00 O ATOM 1134 CG2 THR A 73 -10.220 1.042 7.287 1.00 0.00 C ATOM 0 H THR A 73 -7.145 -1.708 6.086 1.00 0.00 H new ATOM 0 HA THR A 73 -9.457 -0.217 5.022 1.00 0.00 H new ATOM 0 HB THR A 73 -8.636 -0.291 7.909 1.00 0.00 H new ATOM 0 HG1 THR A 73 -10.798 -1.241 8.152 1.00 0.00 H new ATOM 0 HG21 THR A 73 -10.708 1.066 8.261 1.00 0.00 H new ATOM 0 HG22 THR A 73 -9.550 1.897 7.196 1.00 0.00 H new ATOM 0 HG23 THR A 73 -10.975 1.088 6.502 1.00 0.00 H new ATOM 1142 N THR A 74 -7.330 1.050 4.346 1.00 0.00 N ATOM 1143 CA THR A 74 -6.375 2.097 4.015 1.00 0.00 C ATOM 1144 C THR A 74 -7.145 3.377 3.685 1.00 0.00 C ATOM 1145 O THR A 74 -8.115 3.351 2.927 1.00 0.00 O ATOM 1146 CB THR A 74 -5.419 1.622 2.909 1.00 0.00 C ATOM 1147 OG1 THR A 74 -4.350 2.532 2.762 1.00 0.00 O ATOM 1148 CG2 THR A 74 -6.082 1.392 1.550 1.00 0.00 C ATOM 0 H THR A 74 -7.737 0.590 3.531 1.00 0.00 H new ATOM 0 HA THR A 74 -5.730 2.327 4.863 1.00 0.00 H new ATOM 0 HB THR A 74 -5.058 0.648 3.240 1.00 0.00 H new ATOM 0 HG1 THR A 74 -4.642 3.294 2.219 1.00 0.00 H new ATOM 0 HG21 THR A 74 -5.333 1.059 0.832 1.00 0.00 H new ATOM 0 HG22 THR A 74 -6.856 0.631 1.647 1.00 0.00 H new ATOM 0 HG23 THR A 74 -6.530 2.323 1.202 1.00 0.00 H new ATOM 1156 N ALA A 75 -6.747 4.502 4.288 1.00 0.00 N ATOM 1157 CA ALA A 75 -7.458 5.774 4.193 1.00 0.00 C ATOM 1158 C ALA A 75 -7.775 6.158 2.747 1.00 0.00 C ATOM 1159 O ALA A 75 -8.816 6.749 2.467 1.00 0.00 O ATOM 1160 CB ALA A 75 -6.631 6.874 4.865 1.00 0.00 C ATOM 0 H ALA A 75 -5.907 4.551 4.865 1.00 0.00 H new ATOM 0 HA ALA A 75 -8.412 5.660 4.707 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -7.162 7.823 4.794 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -6.476 6.623 5.914 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -5.666 6.960 4.366 1.00 0.00 H new ATOM 1166 N ASP A 76 -6.862 5.825 1.837 1.00 0.00 N ATOM 1167 CA ASP A 76 -6.888 6.175 0.434 1.00 0.00 C ATOM 1168 C ASP A 76 -7.463 5.062 -0.443 1.00 0.00 C ATOM 1169 O ASP A 76 -7.287 5.128 -1.657 1.00 0.00 O ATOM 1170 CB ASP A 76 -5.453 6.490 0.013 1.00 0.00 C ATOM 1171 CG ASP A 76 -4.562 5.249 0.063 1.00 0.00 C ATOM 1172 OD1 ASP A 76 -4.740 4.462 1.017 1.00 0.00 O ATOM 1173 OD2 ASP A 76 -3.694 5.138 -0.837 1.00 0.00 O ATOM 0 H ASP A 76 -6.041 5.272 2.082 1.00 0.00 H new ATOM 0 HA ASP A 76 -7.543 7.036 0.297 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -5.452 6.898 -0.998 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -5.043 7.259 0.667 1.00 0.00 H new ATOM 1178 N ASP A 77 -8.168 4.082 0.132 1.00 0.00 N ATOM 1179 CA ASP A 77 -9.044 3.194 -0.634 1.00 0.00 C ATOM 1180 C ASP A 77 -10.244 2.675 0.171 1.00 0.00 C ATOM 1181 O ASP A 77 -11.068 1.943 -0.370 1.00 0.00 O ATOM 1182 CB ASP A 77 -8.254 2.051 -1.293 1.00 0.00 C ATOM 1183 CG ASP A 77 -8.984 1.412 -2.474 1.00 0.00 C ATOM 1184 OD1 ASP A 77 -9.970 2.007 -2.965 1.00 0.00 O ATOM 1185 OD2 ASP A 77 -8.524 0.333 -2.897 1.00 0.00 O ATOM 0 H ASP A 77 -8.147 3.884 1.132 1.00 0.00 H new ATOM 0 HA ASP A 77 -9.469 3.805 -1.430 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -7.292 2.433 -1.634 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -8.046 1.285 -0.546 1.00 0.00 H new ATOM 1190 N ARG A 78 -10.408 3.095 1.431 1.00 0.00 N ATOM 1191 CA ARG A 78 -11.544 2.767 2.292 1.00 0.00 C ATOM 1192 C ARG A 78 -11.342 1.358 2.872 1.00 0.00 C ATOM 1193 O ARG A 78 -10.230 0.830 2.830 1.00 0.00 O ATOM 1194 CB ARG A 78 -12.903 2.959 1.573 1.00 0.00 C ATOM 1195 CG ARG A 78 -13.030 4.310 0.834 1.00 0.00 C ATOM 1196 CD ARG A 78 -13.795 4.208 -0.498 1.00 0.00 C ATOM 1197 NE ARG A 78 -13.069 3.371 -1.474 1.00 0.00 N ATOM 1198 CZ ARG A 78 -13.207 3.364 -2.809 1.00 0.00 C ATOM 1199 NH1 ARG A 78 -14.093 4.160 -3.414 1.00 0.00 N ATOM 1200 NH2 ARG A 78 -12.455 2.557 -3.555 1.00 0.00 N ATOM 0 H ARG A 78 -9.726 3.695 1.894 1.00 0.00 H new ATOM 0 HA ARG A 78 -11.582 3.469 3.125 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -13.043 2.149 0.857 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -13.706 2.879 2.306 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -13.538 5.024 1.482 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -12.033 4.706 0.642 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -14.784 3.786 -0.320 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -13.943 5.206 -0.911 1.00 0.00 H new ATOM 0 HE ARG A 78 -12.382 2.722 -1.089 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -14.678 4.786 -2.860 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -14.185 4.142 -4.430 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -11.772 1.942 -3.112 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -12.562 2.554 -4.569 1.00 0.00 H new ATOM 1214 N LYS A 79 -12.395 0.744 3.429 1.00 0.00 N ATOM 1215 CA LYS A 79 -12.332 -0.669 3.785 1.00 0.00 C ATOM 1216 C LYS A 79 -12.403 -1.483 2.495 1.00 0.00 C ATOM 1217 O LYS A 79 -13.319 -1.287 1.697 1.00 0.00 O ATOM 1218 CB LYS A 79 -13.427 -1.067 4.784 1.00 0.00 C ATOM 1219 CG LYS A 79 -13.266 -2.551 5.167 1.00 0.00 C ATOM 1220 CD LYS A 79 -14.037 -3.006 6.413 1.00 0.00 C ATOM 1221 CE LYS A 79 -15.549 -2.756 6.357 1.00 0.00 C ATOM 1222 NZ LYS A 79 -15.896 -1.360 6.683 1.00 0.00 N ATOM 0 H LYS A 79 -13.284 1.199 3.638 1.00 0.00 H new ATOM 0 HA LYS A 79 -11.392 -0.875 4.297 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -13.364 -0.443 5.675 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -14.411 -0.899 4.346 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -13.585 -3.161 4.322 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -12.207 -2.753 5.324 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -13.864 -4.072 6.562 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -13.629 -2.492 7.284 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -15.919 -2.997 5.360 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -16.052 -3.426 7.054 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -16.781 -1.341 7.229 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -15.132 -0.935 7.247 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -16.019 -0.819 5.804 1.00 0.00 H new ATOM 1236 N VAL A 80 -11.434 -2.373 2.299 1.00 0.00 N ATOM 1237 CA VAL A 80 -11.225 -3.141 1.090 1.00 0.00 C ATOM 1238 C VAL A 80 -10.681 -4.507 1.487 1.00 0.00 C ATOM 1239 O VAL A 80 -9.870 -4.607 2.401 1.00 0.00 O ATOM 1240 CB VAL A 80 -10.217 -2.415 0.181 1.00 0.00 C ATOM 1241 CG1 VAL A 80 -10.774 -1.082 -0.322 1.00 0.00 C ATOM 1242 CG2 VAL A 80 -8.877 -2.134 0.887 1.00 0.00 C ATOM 0 H VAL A 80 -10.743 -2.583 3.019 1.00 0.00 H new ATOM 0 HA VAL A 80 -12.162 -3.255 0.544 1.00 0.00 H new ATOM 0 HB VAL A 80 -10.044 -3.092 -0.656 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -10.036 -0.597 -0.961 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -11.686 -1.261 -0.892 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -10.998 -0.437 0.528 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -8.204 -1.621 0.200 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -9.051 -1.506 1.761 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -8.426 -3.076 1.200 1.00 0.00 H new ATOM 1252 N LYS A 81 -11.084 -5.561 0.785 1.00 0.00 N ATOM 1253 CA LYS A 81 -10.417 -6.840 0.885 1.00 0.00 C ATOM 1254 C LYS A 81 -9.207 -6.816 -0.042 1.00 0.00 C ATOM 1255 O LYS A 81 -9.318 -6.476 -1.221 1.00 0.00 O ATOM 1256 CB LYS A 81 -11.394 -7.981 0.587 1.00 0.00 C ATOM 1257 CG LYS A 81 -10.721 -9.339 0.809 1.00 0.00 C ATOM 1258 CD LYS A 81 -11.751 -10.470 0.900 1.00 0.00 C ATOM 1259 CE LYS A 81 -12.391 -10.541 2.295 1.00 0.00 C ATOM 1260 NZ LYS A 81 -13.111 -11.815 2.494 1.00 0.00 N ATOM 0 H LYS A 81 -11.874 -5.547 0.140 1.00 0.00 H new ATOM 0 HA LYS A 81 -10.061 -7.021 1.899 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -12.270 -7.894 1.230 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -11.745 -7.907 -0.442 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -10.029 -9.541 -0.009 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -10.131 -9.308 1.725 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -12.527 -10.317 0.150 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -11.270 -11.421 0.671 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -11.619 -10.435 3.057 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -13.082 -9.707 2.423 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -13.760 -11.725 3.302 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -13.655 -12.044 1.637 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -12.426 -12.575 2.683 1.00 0.00 H new ATOM 1274 N SER A 82 -8.038 -7.143 0.499 1.00 0.00 N ATOM 1275 CA SER A 82 -6.823 -7.383 -0.251 1.00 0.00 C ATOM 1276 C SER A 82 -6.737 -8.879 -0.487 1.00 0.00 C ATOM 1277 O SER A 82 -6.581 -9.628 0.474 1.00 0.00 O ATOM 1278 CB SER A 82 -5.626 -6.900 0.573 1.00 0.00 C ATOM 1279 OG SER A 82 -5.454 -5.501 0.428 1.00 0.00 O ATOM 0 H SER A 82 -7.912 -7.250 1.506 1.00 0.00 H new ATOM 0 HA SER A 82 -6.822 -6.850 -1.202 1.00 0.00 H new ATOM 0 HB2 SER A 82 -5.778 -7.146 1.624 1.00 0.00 H new ATOM 0 HB3 SER A 82 -4.723 -7.418 0.251 1.00 0.00 H new ATOM 0 HG SER A 82 -4.784 -5.324 -0.265 1.00 0.00 H new ATOM 1285 N ILE A 83 -6.820 -9.303 -1.749 1.00 0.00 N ATOM 1286 CA ILE A 83 -6.475 -10.652 -2.158 1.00 0.00 C ATOM 1287 C ILE A 83 -5.128 -10.532 -2.857 1.00 0.00 C ATOM 1288 O ILE A 83 -4.990 -9.725 -3.777 1.00 0.00 O ATOM 1289 CB ILE A 83 -7.564 -11.240 -3.069 1.00 0.00 C ATOM 1290 CG1 ILE A 83 -8.956 -11.193 -2.415 1.00 0.00 C ATOM 1291 CG2 ILE A 83 -7.207 -12.684 -3.452 1.00 0.00 C ATOM 1292 CD1 ILE A 83 -9.778 -9.984 -2.874 1.00 0.00 C ATOM 0 H ILE A 83 -7.132 -8.709 -2.517 1.00 0.00 H new ATOM 0 HA ILE A 83 -6.408 -11.338 -1.314 1.00 0.00 H new ATOM 0 HB ILE A 83 -7.607 -10.624 -3.967 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -9.497 -12.108 -2.654 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -8.844 -11.162 -1.331 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -7.985 -13.092 -4.098 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -6.254 -12.695 -3.981 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -7.129 -13.291 -2.550 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -10.751 -9.998 -2.383 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -9.252 -9.066 -2.611 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -9.916 -10.027 -3.954 1.00 0.00 H new ATOM 1304 N VAL A 84 -4.119 -11.273 -2.395 1.00 0.00 N ATOM 1305 CA VAL A 84 -2.789 -11.206 -2.974 1.00 0.00 C ATOM 1306 C VAL A 84 -2.251 -12.611 -3.218 1.00 0.00 C ATOM 1307 O VAL A 84 -2.421 -13.501 -2.382 1.00 0.00 O ATOM 1308 CB VAL A 84 -1.875 -10.329 -2.105 1.00 0.00 C ATOM 1309 CG1 VAL A 84 -1.674 -10.918 -0.709 1.00 0.00 C ATOM 1310 CG2 VAL A 84 -0.518 -10.114 -2.776 1.00 0.00 C ATOM 0 H VAL A 84 -4.205 -11.927 -1.617 1.00 0.00 H new ATOM 0 HA VAL A 84 -2.828 -10.724 -3.951 1.00 0.00 H new ATOM 0 HB VAL A 84 -2.375 -9.367 -1.997 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -1.021 -10.265 -0.129 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -2.638 -11.004 -0.208 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -1.219 -11.905 -0.793 1.00 0.00 H new ATOM 0 HG21 VAL A 84 0.108 -9.490 -2.139 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -0.032 -11.077 -2.931 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -0.662 -9.621 -3.738 1.00 0.00 H new ATOM 1320 N THR A 85 -1.629 -12.822 -4.377 1.00 0.00 N ATOM 1321 CA THR A 85 -1.035 -14.076 -4.819 1.00 0.00 C ATOM 1322 C THR A 85 -0.008 -13.690 -5.887 1.00 0.00 C ATOM 1323 O THR A 85 -0.101 -12.594 -6.433 1.00 0.00 O ATOM 1324 CB THR A 85 -2.145 -14.999 -5.363 1.00 0.00 C ATOM 1325 OG1 THR A 85 -2.987 -15.423 -4.308 1.00 0.00 O ATOM 1326 CG2 THR A 85 -1.621 -16.268 -6.042 1.00 0.00 C ATOM 0 H THR A 85 -1.522 -12.080 -5.068 1.00 0.00 H new ATOM 0 HA THR A 85 -0.545 -14.629 -4.018 1.00 0.00 H new ATOM 0 HB THR A 85 -2.673 -14.399 -6.104 1.00 0.00 H new ATOM 0 HG1 THR A 85 -2.781 -14.910 -3.499 1.00 0.00 H new ATOM 0 HG21 THR A 85 -2.462 -16.864 -6.397 1.00 0.00 H new ATOM 0 HG22 THR A 85 -0.988 -15.994 -6.886 1.00 0.00 H new ATOM 0 HG23 THR A 85 -1.040 -16.850 -5.327 1.00 0.00 H new ATOM 1334 N LEU A 86 0.982 -14.537 -6.179 1.00 0.00 N ATOM 1335 CA LEU A 86 1.878 -14.322 -7.306 1.00 0.00 C ATOM 1336 C LEU A 86 1.518 -15.302 -8.413 1.00 0.00 C ATOM 1337 O LEU A 86 1.190 -16.453 -8.129 1.00 0.00 O ATOM 1338 CB LEU A 86 3.346 -14.351 -6.858 1.00 0.00 C ATOM 1339 CG LEU A 86 3.853 -15.690 -6.288 1.00 0.00 C ATOM 1340 CD1 LEU A 86 4.444 -16.579 -7.393 1.00 0.00 C ATOM 1341 CD2 LEU A 86 4.938 -15.427 -5.233 1.00 0.00 C ATOM 0 H LEU A 86 1.180 -15.382 -5.643 1.00 0.00 H new ATOM 0 HA LEU A 86 1.750 -13.323 -7.723 1.00 0.00 H new ATOM 0 HB2 LEU A 86 3.970 -14.082 -7.710 1.00 0.00 H new ATOM 0 HB3 LEU A 86 3.489 -13.579 -6.102 1.00 0.00 H new ATOM 0 HG LEU A 86 3.003 -16.205 -5.839 1.00 0.00 H new ATOM 0 HD11 LEU A 86 4.793 -17.516 -6.959 1.00 0.00 H new ATOM 0 HD12 LEU A 86 3.678 -16.788 -8.140 1.00 0.00 H new ATOM 0 HD13 LEU A 86 5.281 -16.064 -7.865 1.00 0.00 H new ATOM 0 HD21 LEU A 86 5.294 -16.376 -4.832 1.00 0.00 H new ATOM 0 HD22 LEU A 86 5.770 -14.892 -5.692 1.00 0.00 H new ATOM 0 HD23 LEU A 86 4.522 -14.826 -4.425 1.00 0.00 H new ATOM 1353 N ASP A 87 1.510 -14.821 -9.657 1.00 0.00 N ATOM 1354 CA ASP A 87 1.076 -15.598 -10.813 1.00 0.00 C ATOM 1355 C ASP A 87 2.206 -16.477 -11.360 1.00 0.00 C ATOM 1356 O ASP A 87 1.954 -17.363 -12.174 1.00 0.00 O ATOM 1357 CB ASP A 87 0.456 -14.677 -11.879 1.00 0.00 C ATOM 1358 CG ASP A 87 1.407 -13.612 -12.406 1.00 0.00 C ATOM 1359 OD1 ASP A 87 2.595 -13.948 -12.589 1.00 0.00 O ATOM 1360 OD2 ASP A 87 0.946 -12.468 -12.599 1.00 0.00 O ATOM 0 H ASP A 87 1.807 -13.873 -9.890 1.00 0.00 H new ATOM 0 HA ASP A 87 0.294 -16.288 -10.495 1.00 0.00 H new ATOM 0 HB2 ASP A 87 0.110 -15.286 -12.714 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -0.422 -14.188 -11.456 1.00 0.00 H new ATOM 1365 N GLY A 88 3.440 -16.252 -10.896 1.00 0.00 N ATOM 1366 CA GLY A 88 4.631 -16.958 -11.344 1.00 0.00 C ATOM 1367 C GLY A 88 5.575 -15.996 -12.061 1.00 0.00 C ATOM 1368 O GLY A 88 6.791 -16.147 -11.978 1.00 0.00 O ATOM 0 H GLY A 88 3.636 -15.553 -10.179 1.00 0.00 H new ATOM 0 HA2 GLY A 88 5.138 -17.409 -10.491 1.00 0.00 H new ATOM 0 HA3 GLY A 88 4.351 -17.771 -12.014 1.00 0.00 H new ATOM 1372 N GLY A 89 5.013 -15.002 -12.751 1.00 0.00 N ATOM 1373 CA GLY A 89 5.735 -13.943 -13.428 1.00 0.00 C ATOM 1374 C GLY A 89 5.757 -12.671 -12.582 1.00 0.00 C ATOM 1375 O GLY A 89 6.769 -11.974 -12.585 1.00 0.00 O ATOM 0 H GLY A 89 4.002 -14.917 -12.853 1.00 0.00 H new ATOM 0 HA2 GLY A 89 6.756 -14.266 -13.632 1.00 0.00 H new ATOM 0 HA3 GLY A 89 5.267 -13.736 -14.391 1.00 0.00 H new ATOM 1379 N LYS A 90 4.646 -12.337 -11.910 1.00 0.00 N ATOM 1380 CA LYS A 90 4.487 -11.118 -11.123 1.00 0.00 C ATOM 1381 C LYS A 90 3.682 -11.377 -9.848 1.00 0.00 C ATOM 1382 O LYS A 90 3.049 -12.427 -9.704 1.00 0.00 O ATOM 1383 CB LYS A 90 3.817 -10.028 -11.974 1.00 0.00 C ATOM 1384 CG LYS A 90 4.642 -9.725 -13.229 1.00 0.00 C ATOM 1385 CD LYS A 90 4.180 -8.425 -13.893 1.00 0.00 C ATOM 1386 CE LYS A 90 5.066 -8.143 -15.114 1.00 0.00 C ATOM 1387 NZ LYS A 90 4.675 -6.900 -15.810 1.00 0.00 N ATOM 0 H LYS A 90 3.814 -12.927 -11.902 1.00 0.00 H new ATOM 0 HA LYS A 90 5.477 -10.776 -10.822 1.00 0.00 H new ATOM 0 HB2 LYS A 90 2.816 -10.350 -12.262 1.00 0.00 H new ATOM 0 HB3 LYS A 90 3.702 -9.120 -11.383 1.00 0.00 H new ATOM 0 HG2 LYS A 90 5.697 -9.647 -12.964 1.00 0.00 H new ATOM 0 HG3 LYS A 90 4.551 -10.550 -13.936 1.00 0.00 H new ATOM 0 HD2 LYS A 90 3.136 -8.508 -14.197 1.00 0.00 H new ATOM 0 HD3 LYS A 90 4.241 -7.599 -13.185 1.00 0.00 H new ATOM 0 HE2 LYS A 90 6.106 -8.068 -14.797 1.00 0.00 H new ATOM 0 HE3 LYS A 90 5.004 -8.981 -15.808 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 4.926 -6.972 -16.817 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 3.649 -6.759 -15.718 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 5.175 -6.093 -15.386 1.00 0.00 H new ATOM 1401 N LEU A 91 3.689 -10.403 -8.927 1.00 0.00 N ATOM 1402 CA LEU A 91 2.909 -10.433 -7.699 1.00 0.00 C ATOM 1403 C LEU A 91 1.620 -9.637 -7.922 1.00 0.00 C ATOM 1404 O LEU A 91 1.650 -8.426 -8.153 1.00 0.00 O ATOM 1405 CB LEU A 91 3.770 -9.952 -6.524 1.00 0.00 C ATOM 1406 CG LEU A 91 3.085 -10.066 -5.150 1.00 0.00 C ATOM 1407 CD1 LEU A 91 4.129 -9.918 -4.039 1.00 0.00 C ATOM 1408 CD2 LEU A 91 1.995 -9.008 -4.945 1.00 0.00 C ATOM 0 H LEU A 91 4.252 -9.558 -9.025 1.00 0.00 H new ATOM 0 HA LEU A 91 2.606 -11.446 -7.434 1.00 0.00 H new ATOM 0 HB2 LEU A 91 4.694 -10.529 -6.505 1.00 0.00 H new ATOM 0 HB3 LEU A 91 4.047 -8.912 -6.694 1.00 0.00 H new ATOM 0 HG LEU A 91 2.612 -11.047 -5.112 1.00 0.00 H new ATOM 0 HD11 LEU A 91 3.641 -9.999 -3.068 1.00 0.00 H new ATOM 0 HD12 LEU A 91 4.877 -10.705 -4.136 1.00 0.00 H new ATOM 0 HD13 LEU A 91 4.613 -8.945 -4.122 1.00 0.00 H new ATOM 0 HD21 LEU A 91 1.545 -9.135 -3.960 1.00 0.00 H new ATOM 0 HD22 LEU A 91 2.435 -8.013 -5.018 1.00 0.00 H new ATOM 0 HD23 LEU A 91 1.228 -9.122 -5.711 1.00 0.00 H new ATOM 1420 N VAL A 92 0.484 -10.336 -7.871 1.00 0.00 N ATOM 1421 CA VAL A 92 -0.845 -9.831 -8.165 1.00 0.00 C ATOM 1422 C VAL A 92 -1.552 -9.510 -6.847 1.00 0.00 C ATOM 1423 O VAL A 92 -1.887 -10.418 -6.087 1.00 0.00 O ATOM 1424 CB VAL A 92 -1.623 -10.899 -8.961 1.00 0.00 C ATOM 1425 CG1 VAL A 92 -2.967 -10.355 -9.461 1.00 0.00 C ATOM 1426 CG2 VAL A 92 -0.807 -11.419 -10.153 1.00 0.00 C ATOM 0 H VAL A 92 0.474 -11.322 -7.609 1.00 0.00 H new ATOM 0 HA VAL A 92 -0.789 -8.923 -8.765 1.00 0.00 H new ATOM 0 HB VAL A 92 -1.809 -11.726 -8.276 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -3.490 -11.133 -10.018 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -3.574 -10.048 -8.610 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -2.793 -9.498 -10.111 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -1.386 -12.170 -10.691 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -0.574 -10.592 -10.823 1.00 0.00 H new ATOM 0 HG23 VAL A 92 0.120 -11.865 -9.792 1.00 0.00 H new ATOM 1436 N HIS A 93 -1.803 -8.225 -6.579 1.00 0.00 N ATOM 1437 CA HIS A 93 -2.707 -7.784 -5.527 1.00 0.00 C ATOM 1438 C HIS A 93 -3.993 -7.333 -6.210 1.00 0.00 C ATOM 1439 O HIS A 93 -3.996 -6.293 -6.864 1.00 0.00 O ATOM 1440 CB HIS A 93 -2.049 -6.646 -4.737 1.00 0.00 C ATOM 1441 CG HIS A 93 -2.958 -5.890 -3.789 1.00 0.00 C ATOM 1442 ND1 HIS A 93 -2.952 -4.517 -3.628 1.00 0.00 N ATOM 1443 CD2 HIS A 93 -3.812 -6.420 -2.856 1.00 0.00 C ATOM 1444 CE1 HIS A 93 -3.765 -4.219 -2.601 1.00 0.00 C ATOM 1445 NE2 HIS A 93 -4.308 -5.354 -2.120 1.00 0.00 N ATOM 0 H HIS A 93 -1.376 -7.457 -7.096 1.00 0.00 H new ATOM 0 HA HIS A 93 -2.931 -8.580 -4.817 1.00 0.00 H new ATOM 0 HB2 HIS A 93 -1.220 -7.060 -4.163 1.00 0.00 H new ATOM 0 HB3 HIS A 93 -1.623 -5.936 -5.446 1.00 0.00 H new ATOM 0 HD1 HIS A 93 -2.424 -3.849 -4.189 1.00 0.00 H new ATOM 0 HD2 HIS A 93 -4.052 -7.464 -2.721 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -3.954 -3.226 -2.221 1.00 0.00 H new ATOM 1454 N VAL A 94 -5.078 -8.095 -6.066 1.00 0.00 N ATOM 1455 CA VAL A 94 -6.395 -7.654 -6.495 1.00 0.00 C ATOM 1456 C VAL A 94 -7.124 -7.127 -5.254 1.00 0.00 C ATOM 1457 O VAL A 94 -7.144 -7.775 -4.204 1.00 0.00 O ATOM 1458 CB VAL A 94 -7.116 -8.743 -7.311 1.00 0.00 C ATOM 1459 CG1 VAL A 94 -7.440 -10.016 -6.530 1.00 0.00 C ATOM 1460 CG2 VAL A 94 -8.399 -8.192 -7.945 1.00 0.00 C ATOM 0 H VAL A 94 -5.064 -9.027 -5.652 1.00 0.00 H new ATOM 0 HA VAL A 94 -6.348 -6.829 -7.206 1.00 0.00 H new ATOM 0 HB VAL A 94 -6.402 -9.030 -8.083 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -7.946 -10.725 -7.184 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -6.516 -10.460 -6.159 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -8.089 -9.772 -5.689 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -8.890 -8.980 -8.516 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -9.070 -7.840 -7.161 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -8.150 -7.364 -8.609 1.00 0.00 H new ATOM 1470 N GLN A 95 -7.615 -5.890 -5.347 1.00 0.00 N ATOM 1471 CA GLN A 95 -8.178 -5.132 -4.242 1.00 0.00 C ATOM 1472 C GLN A 95 -9.679 -5.013 -4.493 1.00 0.00 C ATOM 1473 O GLN A 95 -10.077 -4.460 -5.514 1.00 0.00 O ATOM 1474 CB GLN A 95 -7.484 -3.765 -4.199 1.00 0.00 C ATOM 1475 CG GLN A 95 -7.860 -2.901 -2.992 1.00 0.00 C ATOM 1476 CD GLN A 95 -7.080 -3.295 -1.747 1.00 0.00 C ATOM 1477 OE1 GLN A 95 -6.087 -2.668 -1.399 1.00 0.00 O ATOM 1478 NE2 GLN A 95 -7.466 -4.381 -1.092 1.00 0.00 N ATOM 0 H GLN A 95 -7.629 -5.375 -6.228 1.00 0.00 H new ATOM 0 HA GLN A 95 -8.024 -5.614 -3.277 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -6.405 -3.919 -4.198 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -7.727 -3.219 -5.111 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -7.670 -1.853 -3.223 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -8.928 -2.996 -2.796 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -8.295 -4.892 -1.395 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -6.934 -4.706 -0.285 1.00 0.00 H new ATOM 1487 N LYS A 96 -10.498 -5.577 -3.603 1.00 0.00 N ATOM 1488 CA LYS A 96 -11.909 -5.846 -3.828 1.00 0.00 C ATOM 1489 C LYS A 96 -12.727 -5.344 -2.647 1.00 0.00 C ATOM 1490 O LYS A 96 -12.528 -5.811 -1.533 1.00 0.00 O ATOM 1491 CB LYS A 96 -12.056 -7.365 -3.992 1.00 0.00 C ATOM 1492 CG LYS A 96 -13.503 -7.837 -4.188 1.00 0.00 C ATOM 1493 CD LYS A 96 -13.476 -9.317 -4.596 1.00 0.00 C ATOM 1494 CE LYS A 96 -14.824 -9.785 -5.165 1.00 0.00 C ATOM 1495 NZ LYS A 96 -14.633 -10.621 -6.368 1.00 0.00 N ATOM 0 H LYS A 96 -10.181 -5.866 -2.678 1.00 0.00 H new ATOM 0 HA LYS A 96 -12.273 -5.333 -4.718 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -11.461 -7.687 -4.847 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -11.641 -7.856 -3.112 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -14.073 -7.707 -3.268 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -13.996 -7.240 -4.955 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -12.695 -9.473 -5.340 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -13.217 -9.927 -3.730 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -15.365 -10.351 -4.407 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -15.437 -8.919 -5.414 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -15.459 -11.240 -6.495 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -14.527 -10.009 -7.202 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -13.779 -11.203 -6.254 1.00 0.00 H new ATOM 1509 N TRP A 97 -13.662 -4.423 -2.877 1.00 0.00 N ATOM 1510 CA TRP A 97 -14.524 -3.910 -1.817 1.00 0.00 C ATOM 1511 C TRP A 97 -15.868 -4.627 -1.859 1.00 0.00 C ATOM 1512 O TRP A 97 -16.269 -5.238 -0.872 1.00 0.00 O ATOM 1513 CB TRP A 97 -14.651 -2.385 -1.896 1.00 0.00 C ATOM 1514 CG TRP A 97 -14.497 -1.785 -3.256 1.00 0.00 C ATOM 1515 CD1 TRP A 97 -15.496 -1.347 -4.047 1.00 0.00 C ATOM 1516 CD2 TRP A 97 -13.265 -1.569 -4.004 1.00 0.00 C ATOM 1517 NE1 TRP A 97 -14.976 -0.882 -5.233 1.00 0.00 N ATOM 1518 CE2 TRP A 97 -13.605 -1.023 -5.274 1.00 0.00 C ATOM 1519 CE3 TRP A 97 -11.898 -1.798 -3.745 1.00 0.00 C ATOM 1520 CZ2 TRP A 97 -12.642 -0.731 -6.244 1.00 0.00 C ATOM 1521 CZ3 TRP A 97 -10.917 -1.451 -4.688 1.00 0.00 C ATOM 1522 CH2 TRP A 97 -11.288 -0.928 -5.935 1.00 0.00 C ATOM 0 H TRP A 97 -13.841 -4.016 -3.795 1.00 0.00 H new ATOM 0 HA TRP A 97 -14.073 -4.119 -0.847 1.00 0.00 H new ATOM 0 HB2 TRP A 97 -15.627 -2.101 -1.503 1.00 0.00 H new ATOM 0 HB3 TRP A 97 -13.902 -1.943 -1.239 1.00 0.00 H new ATOM 0 HD1 TRP A 97 -16.545 -1.359 -3.789 1.00 0.00 H new ATOM 0 HE1 TRP A 97 -15.535 -0.483 -5.987 1.00 0.00 H new ATOM 0 HE3 TRP A 97 -11.601 -2.246 -2.808 1.00 0.00 H new ATOM 0 HZ2 TRP A 97 -12.935 -0.360 -7.215 1.00 0.00 H new ATOM 0 HZ3 TRP A 97 -9.872 -1.588 -4.452 1.00 0.00 H new ATOM 0 HH2 TRP A 97 -10.528 -0.676 -6.660 1.00 0.00 H new ATOM 1533 N ASN A 98 -16.562 -4.580 -3.001 1.00 0.00 N ATOM 1534 CA ASN A 98 -17.863 -5.228 -3.135 1.00 0.00 C ATOM 1535 C ASN A 98 -18.251 -5.427 -4.601 1.00 0.00 C ATOM 1536 O ASN A 98 -18.025 -6.504 -5.145 1.00 0.00 O ATOM 1537 CB ASN A 98 -18.951 -4.532 -2.290 1.00 0.00 C ATOM 1538 CG ASN A 98 -19.070 -3.025 -2.518 1.00 0.00 C ATOM 1539 OD1 ASN A 98 -18.211 -2.253 -2.108 1.00 0.00 O ATOM 1540 ND2 ASN A 98 -20.125 -2.581 -3.197 1.00 0.00 N ATOM 0 H ASN A 98 -16.242 -4.100 -3.842 1.00 0.00 H new ATOM 0 HA ASN A 98 -17.775 -6.231 -2.717 1.00 0.00 H new ATOM 0 HB2 ASN A 98 -19.913 -4.996 -2.508 1.00 0.00 H new ATOM 0 HB3 ASN A 98 -18.742 -4.711 -1.235 1.00 0.00 H new ATOM 0 HD21 ASN A 98 -20.228 -1.584 -3.384 1.00 0.00 H new ATOM 0 HD22 ASN A 98 -20.830 -3.238 -3.531 1.00 0.00 H new ATOM 1547 N GLY A 99 -18.833 -4.416 -5.252 1.00 0.00 N ATOM 1548 CA GLY A 99 -19.405 -4.568 -6.584 1.00 0.00 C ATOM 1549 C GLY A 99 -18.339 -4.694 -7.669 1.00 0.00 C ATOM 1550 O GLY A 99 -18.640 -5.085 -8.794 1.00 0.00 O ATOM 0 H GLY A 99 -18.919 -3.475 -4.869 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -20.043 -5.451 -6.603 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -20.041 -3.710 -6.802 1.00 0.00 H new ATOM 1554 N GLN A 100 -17.100 -4.324 -7.346 1.00 0.00 N ATOM 1555 CA GLN A 100 -15.987 -4.310 -8.263 1.00 0.00 C ATOM 1556 C GLN A 100 -14.695 -4.291 -7.452 1.00 0.00 C ATOM 1557 O GLN A 100 -14.726 -4.163 -6.222 1.00 0.00 O ATOM 1558 CB GLN A 100 -16.089 -3.124 -9.235 1.00 0.00 C ATOM 1559 CG GLN A 100 -16.179 -1.741 -8.575 1.00 0.00 C ATOM 1560 CD GLN A 100 -17.576 -1.415 -8.049 1.00 0.00 C ATOM 1561 OE1 GLN A 100 -18.466 -1.080 -8.821 1.00 0.00 O ATOM 1562 NE2 GLN A 100 -17.786 -1.483 -6.736 1.00 0.00 N ATOM 0 H GLN A 100 -16.847 -4.018 -6.406 1.00 0.00 H new ATOM 0 HA GLN A 100 -15.997 -5.207 -8.882 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -15.220 -3.139 -9.893 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -16.967 -3.266 -9.864 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -15.467 -1.692 -7.751 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -15.883 -0.981 -9.298 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -17.029 -1.765 -6.112 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -18.703 -1.254 -6.354 1.00 0.00 H new ATOM 1571 N GLU A 101 -13.581 -4.419 -8.170 1.00 0.00 N ATOM 1572 CA GLU A 101 -12.252 -4.622 -7.644 1.00 0.00 C ATOM 1573 C GLU A 101 -11.250 -4.093 -8.665 1.00 0.00 C ATOM 1574 O GLU A 101 -11.578 -4.013 -9.850 1.00 0.00 O ATOM 1575 CB GLU A 101 -12.066 -6.122 -7.368 1.00 0.00 C ATOM 1576 CG GLU A 101 -12.332 -7.051 -8.563 1.00 0.00 C ATOM 1577 CD GLU A 101 -12.632 -8.460 -8.072 1.00 0.00 C ATOM 1578 OE1 GLU A 101 -11.708 -9.118 -7.556 1.00 0.00 O ATOM 1579 OE2 GLU A 101 -13.818 -8.854 -8.132 1.00 0.00 O ATOM 0 H GLU A 101 -13.593 -4.380 -9.189 1.00 0.00 H new ATOM 0 HA GLU A 101 -12.096 -4.086 -6.708 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -11.046 -6.286 -7.022 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -12.729 -6.409 -6.552 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -13.172 -6.674 -9.147 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -11.465 -7.064 -9.224 1.00 0.00 H new ATOM 1586 N THR A 102 -10.059 -3.708 -8.212 1.00 0.00 N ATOM 1587 CA THR A 102 -8.955 -3.267 -9.053 1.00 0.00 C ATOM 1588 C THR A 102 -7.848 -4.314 -9.052 1.00 0.00 C ATOM 1589 O THR A 102 -7.597 -4.955 -8.032 1.00 0.00 O ATOM 1590 CB THR A 102 -8.425 -1.924 -8.540 1.00 0.00 C ATOM 1591 OG1 THR A 102 -8.412 -1.934 -7.124 1.00 0.00 O ATOM 1592 CG2 THR A 102 -9.307 -0.782 -9.059 1.00 0.00 C ATOM 0 H THR A 102 -9.831 -3.695 -7.218 1.00 0.00 H new ATOM 0 HA THR A 102 -9.307 -3.140 -10.077 1.00 0.00 H new ATOM 0 HB THR A 102 -7.409 -1.769 -8.904 1.00 0.00 H new ATOM 0 HG1 THR A 102 -9.332 -1.900 -6.788 1.00 0.00 H new ATOM 0 HG21 THR A 102 -8.924 0.170 -8.690 1.00 0.00 H new ATOM 0 HG22 THR A 102 -9.296 -0.780 -10.149 1.00 0.00 H new ATOM 0 HG23 THR A 102 -10.329 -0.923 -8.707 1.00 0.00 H new ATOM 1600 N SER A 103 -7.164 -4.458 -10.189 1.00 0.00 N ATOM 1601 CA SER A 103 -5.969 -5.277 -10.316 1.00 0.00 C ATOM 1602 C SER A 103 -4.746 -4.379 -10.135 1.00 0.00 C ATOM 1603 O SER A 103 -4.592 -3.417 -10.888 1.00 0.00 O ATOM 1604 CB SER A 103 -5.959 -5.966 -11.688 1.00 0.00 C ATOM 1605 OG SER A 103 -6.635 -5.204 -12.672 1.00 0.00 O ATOM 0 H SER A 103 -7.434 -3.999 -11.059 1.00 0.00 H new ATOM 0 HA SER A 103 -5.953 -6.056 -9.553 1.00 0.00 H new ATOM 0 HB2 SER A 103 -4.929 -6.131 -12.003 1.00 0.00 H new ATOM 0 HB3 SER A 103 -6.428 -6.947 -11.604 1.00 0.00 H new ATOM 0 HG SER A 103 -6.395 -4.259 -12.575 1.00 0.00 H new ATOM 1611 N LEU A 104 -3.901 -4.684 -9.142 1.00 0.00 N ATOM 1612 CA LEU A 104 -2.633 -4.021 -8.880 1.00 0.00 C ATOM 1613 C LEU A 104 -1.526 -5.073 -9.009 1.00 0.00 C ATOM 1614 O LEU A 104 -1.299 -5.847 -8.077 1.00 0.00 O ATOM 1615 CB LEU A 104 -2.625 -3.383 -7.478 1.00 0.00 C ATOM 1616 CG LEU A 104 -3.731 -2.338 -7.235 1.00 0.00 C ATOM 1617 CD1 LEU A 104 -5.039 -2.985 -6.762 1.00 0.00 C ATOM 1618 CD2 LEU A 104 -3.278 -1.330 -6.166 1.00 0.00 C ATOM 0 H LEU A 104 -4.097 -5.431 -8.476 1.00 0.00 H new ATOM 0 HA LEU A 104 -2.473 -3.214 -9.596 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -2.723 -4.174 -6.734 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -1.656 -2.910 -7.315 1.00 0.00 H new ATOM 0 HG LEU A 104 -3.911 -1.838 -8.187 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -5.791 -2.212 -6.603 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -5.393 -3.685 -7.519 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -4.864 -3.518 -5.828 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -4.066 -0.595 -6.001 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -3.072 -1.856 -5.234 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -2.374 -0.823 -6.504 1.00 0.00 H new ATOM 1630 N VAL A 105 -0.851 -5.130 -10.161 1.00 0.00 N ATOM 1631 CA VAL A 105 0.227 -6.090 -10.387 1.00 0.00 C ATOM 1632 C VAL A 105 1.565 -5.386 -10.162 1.00 0.00 C ATOM 1633 O VAL A 105 1.846 -4.409 -10.856 1.00 0.00 O ATOM 1634 CB VAL A 105 0.111 -6.748 -11.777 1.00 0.00 C ATOM 1635 CG1 VAL A 105 -1.123 -7.655 -11.817 1.00 0.00 C ATOM 1636 CG2 VAL A 105 0.020 -5.773 -12.957 1.00 0.00 C ATOM 0 H VAL A 105 -1.036 -4.517 -10.955 1.00 0.00 H new ATOM 0 HA VAL A 105 0.153 -6.911 -9.674 1.00 0.00 H new ATOM 0 HB VAL A 105 1.041 -7.302 -11.901 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -1.202 -8.118 -12.800 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -1.029 -8.431 -11.057 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -2.017 -7.062 -11.622 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -0.058 -6.335 -13.888 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -0.860 -5.141 -12.840 1.00 0.00 H new ATOM 0 HG23 VAL A 105 0.914 -5.149 -12.984 1.00 0.00 H new ATOM 1646 N ARG A 106 2.363 -5.847 -9.188 1.00 0.00 N ATOM 1647 CA ARG A 106 3.711 -5.345 -8.931 1.00 0.00 C ATOM 1648 C ARG A 106 4.729 -6.430 -9.272 1.00 0.00 C ATOM 1649 O ARG A 106 4.468 -7.612 -9.045 1.00 0.00 O ATOM 1650 CB ARG A 106 3.905 -4.861 -7.476 1.00 0.00 C ATOM 1651 CG ARG A 106 3.383 -5.851 -6.430 1.00 0.00 C ATOM 1652 CD ARG A 106 3.836 -5.537 -4.996 1.00 0.00 C ATOM 1653 NE ARG A 106 3.155 -4.362 -4.423 1.00 0.00 N ATOM 1654 CZ ARG A 106 3.686 -3.142 -4.239 1.00 0.00 C ATOM 1655 NH1 ARG A 106 4.886 -2.844 -4.744 1.00 0.00 N ATOM 1656 NH2 ARG A 106 3.009 -2.218 -3.548 1.00 0.00 N ATOM 0 H ARG A 106 2.081 -6.591 -8.549 1.00 0.00 H new ATOM 0 HA ARG A 106 3.864 -4.474 -9.568 1.00 0.00 H new ATOM 0 HB2 ARG A 106 4.966 -4.683 -7.299 1.00 0.00 H new ATOM 0 HB3 ARG A 106 3.395 -3.906 -7.348 1.00 0.00 H new ATOM 0 HG2 ARG A 106 2.294 -5.859 -6.463 1.00 0.00 H new ATOM 0 HG3 ARG A 106 3.717 -6.854 -6.695 1.00 0.00 H new ATOM 0 HD2 ARG A 106 3.648 -6.404 -4.363 1.00 0.00 H new ATOM 0 HD3 ARG A 106 4.912 -5.365 -4.990 1.00 0.00 H new ATOM 0 HE ARG A 106 2.184 -4.488 -4.138 1.00 0.00 H new ATOM 0 HH11 ARG A 106 5.405 -3.545 -5.273 1.00 0.00 H new ATOM 0 HH12 ARG A 106 5.283 -1.916 -4.601 1.00 0.00 H new ATOM 0 HH21 ARG A 106 2.091 -2.441 -3.162 1.00 0.00 H new ATOM 0 HH22 ARG A 106 3.410 -1.291 -3.407 1.00 0.00 H new ATOM 1670 N GLU A 107 5.900 -6.025 -9.772 1.00 0.00 N ATOM 1671 CA GLU A 107 7.067 -6.892 -9.840 1.00 0.00 C ATOM 1672 C GLU A 107 8.323 -6.039 -9.995 1.00 0.00 C ATOM 1673 O GLU A 107 8.226 -4.904 -10.462 1.00 0.00 O ATOM 1674 CB GLU A 107 6.912 -7.915 -10.981 1.00 0.00 C ATOM 1675 CG GLU A 107 7.990 -9.006 -10.971 1.00 0.00 C ATOM 1676 CD GLU A 107 8.139 -9.615 -9.586 1.00 0.00 C ATOM 1677 OE1 GLU A 107 7.273 -10.430 -9.207 1.00 0.00 O ATOM 1678 OE2 GLU A 107 9.062 -9.146 -8.889 1.00 0.00 O ATOM 0 H GLU A 107 6.060 -5.087 -10.139 1.00 0.00 H new ATOM 0 HA GLU A 107 7.159 -7.462 -8.915 1.00 0.00 H new ATOM 0 HB2 GLU A 107 5.931 -8.384 -10.908 1.00 0.00 H new ATOM 0 HB3 GLU A 107 6.945 -7.391 -11.936 1.00 0.00 H new ATOM 0 HG2 GLU A 107 7.730 -9.785 -11.688 1.00 0.00 H new ATOM 0 HG3 GLU A 107 8.943 -8.583 -11.290 1.00 0.00 H new ATOM 1685 N MET A 108 9.484 -6.570 -9.608 1.00 0.00 N ATOM 1686 CA MET A 108 10.780 -5.979 -9.881 1.00 0.00 C ATOM 1687 C MET A 108 11.627 -6.967 -10.668 1.00 0.00 C ATOM 1688 O MET A 108 11.989 -8.028 -10.167 1.00 0.00 O ATOM 1689 CB MET A 108 11.477 -5.562 -8.579 1.00 0.00 C ATOM 1690 CG MET A 108 12.942 -5.150 -8.781 1.00 0.00 C ATOM 1691 SD MET A 108 14.154 -6.505 -8.738 1.00 0.00 S ATOM 1692 CE MET A 108 15.642 -5.566 -9.157 1.00 0.00 C ATOM 0 H MET A 108 9.543 -7.443 -9.084 1.00 0.00 H new ATOM 0 HA MET A 108 10.645 -5.077 -10.477 1.00 0.00 H new ATOM 0 HB2 MET A 108 10.931 -4.731 -8.133 1.00 0.00 H new ATOM 0 HB3 MET A 108 11.434 -6.389 -7.870 1.00 0.00 H new ATOM 0 HG2 MET A 108 13.028 -4.640 -9.741 1.00 0.00 H new ATOM 0 HG3 MET A 108 13.206 -4.426 -8.010 1.00 0.00 H new ATOM 0 HE1 MET A 108 16.495 -6.242 -9.214 1.00 0.00 H new ATOM 0 HE2 MET A 108 15.503 -5.075 -10.120 1.00 0.00 H new ATOM 0 HE3 MET A 108 15.826 -4.814 -8.390 1.00 0.00 H new ATOM 1702 N VAL A 109 12.064 -6.539 -11.847 1.00 0.00 N ATOM 1703 CA VAL A 109 13.180 -7.124 -12.569 1.00 0.00 C ATOM 1704 C VAL A 109 14.064 -5.950 -12.980 1.00 0.00 C ATOM 1705 O VAL A 109 13.761 -4.813 -12.604 1.00 0.00 O ATOM 1706 CB VAL A 109 12.685 -7.989 -13.744 1.00 0.00 C ATOM 1707 CG1 VAL A 109 11.962 -9.236 -13.223 1.00 0.00 C ATOM 1708 CG2 VAL A 109 11.749 -7.225 -14.685 1.00 0.00 C ATOM 0 H VAL A 109 11.637 -5.753 -12.338 1.00 0.00 H new ATOM 0 HA VAL A 109 13.760 -7.818 -11.961 1.00 0.00 H new ATOM 0 HB VAL A 109 13.570 -8.276 -14.311 1.00 0.00 H new ATOM 0 HG11 VAL A 109 11.619 -9.836 -14.066 1.00 0.00 H new ATOM 0 HG12 VAL A 109 12.647 -9.825 -12.613 1.00 0.00 H new ATOM 0 HG13 VAL A 109 11.106 -8.935 -12.619 1.00 0.00 H new ATOM 0 HG21 VAL A 109 11.431 -7.882 -15.494 1.00 0.00 H new ATOM 0 HG22 VAL A 109 10.875 -6.883 -14.130 1.00 0.00 H new ATOM 0 HG23 VAL A 109 12.274 -6.365 -15.101 1.00 0.00 H new ATOM 1718 N ASP A 110 15.154 -6.219 -13.704 1.00 0.00 N ATOM 1719 CA ASP A 110 16.105 -5.194 -14.110 1.00 0.00 C ATOM 1720 C ASP A 110 16.560 -4.413 -12.865 1.00 0.00 C ATOM 1721 O ASP A 110 17.243 -4.985 -12.015 1.00 0.00 O ATOM 1722 CB ASP A 110 15.480 -4.362 -15.241 1.00 0.00 C ATOM 1723 CG ASP A 110 16.330 -3.163 -15.621 1.00 0.00 C ATOM 1724 OD1 ASP A 110 17.333 -3.367 -16.334 1.00 0.00 O ATOM 1725 OD2 ASP A 110 15.962 -2.072 -15.132 1.00 0.00 O ATOM 0 H ASP A 110 15.397 -7.157 -14.023 1.00 0.00 H new ATOM 0 HA ASP A 110 17.021 -5.608 -14.532 1.00 0.00 H new ATOM 0 HB2 ASP A 110 15.338 -4.995 -16.117 1.00 0.00 H new ATOM 0 HB3 ASP A 110 14.492 -4.020 -14.932 1.00 0.00 H new ATOM 1730 N GLY A 111 16.136 -3.160 -12.702 1.00 0.00 N ATOM 1731 CA GLY A 111 16.459 -2.320 -11.562 1.00 0.00 C ATOM 1732 C GLY A 111 15.319 -1.357 -11.241 1.00 0.00 C ATOM 1733 O GLY A 111 15.563 -0.280 -10.700 1.00 0.00 O ATOM 0 H GLY A 111 15.540 -2.692 -13.385 1.00 0.00 H new ATOM 0 HA2 GLY A 111 16.665 -2.946 -10.693 1.00 0.00 H new ATOM 0 HA3 GLY A 111 17.367 -1.755 -11.770 1.00 0.00 H new ATOM 1737 N LYS A 112 14.071 -1.743 -11.531 1.00 0.00 N ATOM 1738 CA LYS A 112 12.895 -0.974 -11.151 1.00 0.00 C ATOM 1739 C LYS A 112 11.801 -1.927 -10.697 1.00 0.00 C ATOM 1740 O LYS A 112 11.667 -3.024 -11.237 1.00 0.00 O ATOM 1741 CB LYS A 112 12.386 -0.103 -12.312 1.00 0.00 C ATOM 1742 CG LYS A 112 13.188 1.196 -12.443 1.00 0.00 C ATOM 1743 CD LYS A 112 12.493 2.190 -13.389 1.00 0.00 C ATOM 1744 CE LYS A 112 13.158 3.563 -13.220 1.00 0.00 C ATOM 1745 NZ LYS A 112 12.570 4.626 -14.062 1.00 0.00 N ATOM 0 H LYS A 112 13.855 -2.601 -12.038 1.00 0.00 H new ATOM 0 HA LYS A 112 13.171 -0.305 -10.336 1.00 0.00 H new ATOM 0 HB2 LYS A 112 12.450 -0.665 -13.244 1.00 0.00 H new ATOM 0 HB3 LYS A 112 11.334 0.134 -12.155 1.00 0.00 H new ATOM 0 HG2 LYS A 112 13.310 1.651 -11.460 1.00 0.00 H new ATOM 0 HG3 LYS A 112 14.187 0.973 -12.817 1.00 0.00 H new ATOM 0 HD2 LYS A 112 12.576 1.852 -14.422 1.00 0.00 H new ATOM 0 HD3 LYS A 112 11.429 2.253 -13.159 1.00 0.00 H new ATOM 0 HE2 LYS A 112 13.088 3.862 -12.174 1.00 0.00 H new ATOM 0 HE3 LYS A 112 14.218 3.473 -13.456 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 13.153 5.484 -13.995 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 12.536 4.306 -15.051 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 11.606 4.836 -13.733 1.00 0.00 H new ATOM 1759 N LEU A 113 11.018 -1.489 -9.711 1.00 0.00 N ATOM 1760 CA LEU A 113 9.782 -2.134 -9.322 1.00 0.00 C ATOM 1761 C LEU A 113 8.693 -1.471 -10.161 1.00 0.00 C ATOM 1762 O LEU A 113 8.419 -0.281 -9.991 1.00 0.00 O ATOM 1763 CB LEU A 113 9.596 -1.982 -7.805 1.00 0.00 C ATOM 1764 CG LEU A 113 8.475 -2.853 -7.214 1.00 0.00 C ATOM 1765 CD1 LEU A 113 8.587 -2.875 -5.688 1.00 0.00 C ATOM 1766 CD2 LEU A 113 7.087 -2.331 -7.584 1.00 0.00 C ATOM 0 H LEU A 113 11.236 -0.661 -9.156 1.00 0.00 H new ATOM 0 HA LEU A 113 9.761 -3.208 -9.508 1.00 0.00 H new ATOM 0 HB2 LEU A 113 10.534 -2.232 -7.309 1.00 0.00 H new ATOM 0 HB3 LEU A 113 9.385 -0.937 -7.580 1.00 0.00 H new ATOM 0 HG LEU A 113 8.594 -3.854 -7.629 1.00 0.00 H new ATOM 0 HD11 LEU A 113 7.791 -3.493 -5.274 1.00 0.00 H new ATOM 0 HD12 LEU A 113 9.554 -3.288 -5.400 1.00 0.00 H new ATOM 0 HD13 LEU A 113 8.496 -1.860 -5.302 1.00 0.00 H new ATOM 0 HD21 LEU A 113 6.326 -2.977 -7.145 1.00 0.00 H new ATOM 0 HD22 LEU A 113 6.966 -1.317 -7.203 1.00 0.00 H new ATOM 0 HD23 LEU A 113 6.977 -2.326 -8.668 1.00 0.00 H new ATOM 1778 N ILE A 114 8.115 -2.210 -11.106 1.00 0.00 N ATOM 1779 CA ILE A 114 7.014 -1.750 -11.939 1.00 0.00 C ATOM 1780 C ILE A 114 5.700 -2.169 -11.280 1.00 0.00 C ATOM 1781 O ILE A 114 5.620 -3.251 -10.697 1.00 0.00 O ATOM 1782 CB ILE A 114 7.184 -2.216 -13.403 1.00 0.00 C ATOM 1783 CG1 ILE A 114 7.555 -3.696 -13.636 1.00 0.00 C ATOM 1784 CG2 ILE A 114 8.289 -1.372 -14.056 1.00 0.00 C ATOM 1785 CD1 ILE A 114 6.426 -4.694 -13.371 1.00 0.00 C ATOM 0 H ILE A 114 8.408 -3.164 -11.316 1.00 0.00 H new ATOM 0 HA ILE A 114 7.006 -0.662 -12.008 1.00 0.00 H new ATOM 0 HB ILE A 114 6.192 -2.090 -13.836 1.00 0.00 H new ATOM 0 HG12 ILE A 114 7.889 -3.813 -14.667 1.00 0.00 H new ATOM 0 HG13 ILE A 114 8.401 -3.948 -12.996 1.00 0.00 H new ATOM 0 HG21 ILE A 114 8.424 -1.687 -15.091 1.00 0.00 H new ATOM 0 HG22 ILE A 114 8.006 -0.320 -14.031 1.00 0.00 H new ATOM 0 HG23 ILE A 114 9.223 -1.510 -13.510 1.00 0.00 H new ATOM 0 HD11 ILE A 114 6.783 -5.706 -13.562 1.00 0.00 H new ATOM 0 HD12 ILE A 114 6.104 -4.612 -12.333 1.00 0.00 H new ATOM 0 HD13 ILE A 114 5.585 -4.475 -14.029 1.00 0.00 H new ATOM 1797 N LEU A 115 4.691 -1.291 -11.307 1.00 0.00 N ATOM 1798 CA LEU A 115 3.411 -1.518 -10.653 1.00 0.00 C ATOM 1799 C LEU A 115 2.295 -0.954 -11.529 1.00 0.00 C ATOM 1800 O LEU A 115 2.124 0.261 -11.618 1.00 0.00 O ATOM 1801 CB LEU A 115 3.450 -0.919 -9.242 1.00 0.00 C ATOM 1802 CG LEU A 115 2.103 -0.872 -8.497 1.00 0.00 C ATOM 1803 CD1 LEU A 115 1.275 -2.156 -8.646 1.00 0.00 C ATOM 1804 CD2 LEU A 115 2.340 -0.617 -7.001 1.00 0.00 C ATOM 0 H LEU A 115 4.748 -0.395 -11.791 1.00 0.00 H new ATOM 0 HA LEU A 115 3.209 -2.582 -10.533 1.00 0.00 H new ATOM 0 HB2 LEU A 115 4.155 -1.495 -8.643 1.00 0.00 H new ATOM 0 HB3 LEU A 115 3.842 0.096 -9.309 1.00 0.00 H new ATOM 0 HG LEU A 115 1.536 -0.060 -8.952 1.00 0.00 H new ATOM 0 HD11 LEU A 115 0.340 -2.052 -8.096 1.00 0.00 H new ATOM 0 HD12 LEU A 115 1.058 -2.329 -9.700 1.00 0.00 H new ATOM 0 HD13 LEU A 115 1.838 -3.000 -8.248 1.00 0.00 H new ATOM 0 HD21 LEU A 115 1.382 -0.585 -6.481 1.00 0.00 H new ATOM 0 HD22 LEU A 115 2.951 -1.419 -6.587 1.00 0.00 H new ATOM 0 HD23 LEU A 115 2.855 0.335 -6.871 1.00 0.00 H new ATOM 1816 N THR A 116 1.536 -1.833 -12.185 1.00 0.00 N ATOM 1817 CA THR A 116 0.417 -1.436 -13.026 1.00 0.00 C ATOM 1818 C THR A 116 -0.868 -1.593 -12.220 1.00 0.00 C ATOM 1819 O THR A 116 -1.162 -2.693 -11.747 1.00 0.00 O ATOM 1820 CB THR A 116 0.392 -2.275 -14.311 1.00 0.00 C ATOM 1821 OG1 THR A 116 1.696 -2.400 -14.839 1.00 0.00 O ATOM 1822 CG2 THR A 116 -0.491 -1.620 -15.375 1.00 0.00 C ATOM 0 H THR A 116 1.684 -2.841 -12.145 1.00 0.00 H new ATOM 0 HA THR A 116 0.518 -0.394 -13.330 1.00 0.00 H new ATOM 0 HB THR A 116 -0.009 -3.256 -14.054 1.00 0.00 H new ATOM 0 HG1 THR A 116 1.667 -2.939 -15.657 1.00 0.00 H new ATOM 0 HG21 THR A 116 -0.492 -2.234 -16.276 1.00 0.00 H new ATOM 0 HG22 THR A 116 -1.509 -1.529 -14.997 1.00 0.00 H new ATOM 0 HG23 THR A 116 -0.102 -0.630 -15.612 1.00 0.00 H new ATOM 1830 N LEU A 117 -1.618 -0.497 -12.060 1.00 0.00 N ATOM 1831 CA LEU A 117 -2.960 -0.522 -11.509 1.00 0.00 C ATOM 1832 C LEU A 117 -3.917 -0.434 -12.694 1.00 0.00 C ATOM 1833 O LEU A 117 -3.717 0.413 -13.568 1.00 0.00 O ATOM 1834 CB LEU A 117 -3.234 0.655 -10.554 1.00 0.00 C ATOM 1835 CG LEU A 117 -2.157 1.081 -9.540 1.00 0.00 C ATOM 1836 CD1 LEU A 117 -1.321 -0.071 -8.996 1.00 0.00 C ATOM 1837 CD2 LEU A 117 -1.207 2.130 -10.110 1.00 0.00 C ATOM 0 H LEU A 117 -1.299 0.438 -12.315 1.00 0.00 H new ATOM 0 HA LEU A 117 -3.090 -1.434 -10.926 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -3.466 1.525 -11.168 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -4.135 0.414 -9.990 1.00 0.00 H new ATOM 0 HG LEU A 117 -2.733 1.502 -8.716 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -0.587 0.315 -8.289 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -1.971 -0.785 -8.491 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -0.807 -0.568 -9.819 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -0.466 2.398 -9.357 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -0.703 1.726 -10.988 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -1.773 3.017 -10.394 1.00 0.00 H new ATOM 1849 N THR A 118 -4.953 -1.270 -12.746 1.00 0.00 N ATOM 1850 CA THR A 118 -5.970 -1.121 -13.775 1.00 0.00 C ATOM 1851 C THR A 118 -7.304 -1.717 -13.333 1.00 0.00 C ATOM 1852 O THR A 118 -7.347 -2.617 -12.487 1.00 0.00 O ATOM 1853 CB THR A 118 -5.464 -1.697 -15.112 1.00 0.00 C ATOM 1854 OG1 THR A 118 -6.296 -1.306 -16.182 1.00 0.00 O ATOM 1855 CG2 THR A 118 -5.343 -3.223 -15.104 1.00 0.00 C ATOM 0 H THR A 118 -5.106 -2.043 -12.098 1.00 0.00 H new ATOM 0 HA THR A 118 -6.158 -0.059 -13.934 1.00 0.00 H new ATOM 0 HB THR A 118 -4.464 -1.285 -15.248 1.00 0.00 H new ATOM 0 HG1 THR A 118 -5.952 -1.683 -17.019 1.00 0.00 H new ATOM 0 HG21 THR A 118 -4.982 -3.564 -16.074 1.00 0.00 H new ATOM 0 HG22 THR A 118 -4.641 -3.528 -14.328 1.00 0.00 H new ATOM 0 HG23 THR A 118 -6.319 -3.664 -14.904 1.00 0.00 H new ATOM 1863 N HIS A 119 -8.383 -1.217 -13.946 1.00 0.00 N ATOM 1864 CA HIS A 119 -9.717 -1.801 -13.945 1.00 0.00 C ATOM 1865 C HIS A 119 -10.474 -1.205 -15.135 1.00 0.00 C ATOM 1866 O HIS A 119 -10.019 -0.216 -15.699 1.00 0.00 O ATOM 1867 CB HIS A 119 -10.413 -1.485 -12.615 1.00 0.00 C ATOM 1868 CG HIS A 119 -11.804 -2.056 -12.482 1.00 0.00 C ATOM 1869 ND1 HIS A 119 -12.960 -1.335 -12.241 1.00 0.00 N ATOM 1870 CD2 HIS A 119 -12.140 -3.378 -12.583 1.00 0.00 C ATOM 1871 CE1 HIS A 119 -13.984 -2.208 -12.206 1.00 0.00 C ATOM 1872 NE2 HIS A 119 -13.508 -3.455 -12.401 1.00 0.00 N ATOM 0 H HIS A 119 -8.341 -0.350 -14.482 1.00 0.00 H new ATOM 0 HA HIS A 119 -9.682 -2.886 -14.042 1.00 0.00 H new ATOM 0 HB2 HIS A 119 -9.799 -1.866 -11.799 1.00 0.00 H new ATOM 0 HB3 HIS A 119 -10.466 -0.403 -12.496 1.00 0.00 H new ATOM 0 HD2 HIS A 119 -11.467 -4.202 -12.769 1.00 0.00 H new ATOM 0 HE1 HIS A 119 -15.021 -1.951 -12.047 1.00 0.00 H new ATOM 0 HE2 HIS A 119 -14.064 -4.310 -12.412 1.00 0.00 H new ATOM 1881 N GLY A 120 -11.639 -1.752 -15.498 1.00 0.00 N ATOM 1882 CA GLY A 120 -12.488 -1.192 -16.551 1.00 0.00 C ATOM 1883 C GLY A 120 -12.671 0.325 -16.411 1.00 0.00 C ATOM 1884 O GLY A 120 -12.731 1.043 -17.403 1.00 0.00 O ATOM 0 H GLY A 120 -12.019 -2.596 -15.069 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -12.049 -1.414 -17.524 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -13.464 -1.677 -16.523 1.00 0.00 H new ATOM 1888 N THR A 121 -12.737 0.802 -15.165 1.00 0.00 N ATOM 1889 CA THR A 121 -12.755 2.207 -14.798 1.00 0.00 C ATOM 1890 C THR A 121 -11.693 3.034 -15.536 1.00 0.00 C ATOM 1891 O THR A 121 -12.016 4.106 -16.040 1.00 0.00 O ATOM 1892 CB THR A 121 -12.556 2.291 -13.276 1.00 0.00 C ATOM 1893 OG1 THR A 121 -13.404 1.334 -12.657 1.00 0.00 O ATOM 1894 CG2 THR A 121 -12.861 3.685 -12.720 1.00 0.00 C ATOM 0 H THR A 121 -12.781 0.186 -14.353 1.00 0.00 H new ATOM 0 HA THR A 121 -13.712 2.637 -15.093 1.00 0.00 H new ATOM 0 HB THR A 121 -11.508 2.085 -13.059 1.00 0.00 H new ATOM 0 HG1 THR A 121 -12.878 0.549 -12.399 1.00 0.00 H new ATOM 0 HG21 THR A 121 -12.705 3.689 -11.641 1.00 0.00 H new ATOM 0 HG22 THR A 121 -12.199 4.415 -13.185 1.00 0.00 H new ATOM 0 HG23 THR A 121 -13.897 3.945 -12.937 1.00 0.00 H new ATOM 1902 N ALA A 122 -10.434 2.576 -15.540 1.00 0.00 N ATOM 1903 CA ALA A 122 -9.277 3.333 -16.005 1.00 0.00 C ATOM 1904 C ALA A 122 -8.006 2.512 -15.756 1.00 0.00 C ATOM 1905 O ALA A 122 -8.040 1.493 -15.064 1.00 0.00 O ATOM 1906 CB ALA A 122 -9.206 4.699 -15.304 1.00 0.00 C ATOM 0 H ALA A 122 -10.192 1.642 -15.209 1.00 0.00 H new ATOM 0 HA ALA A 122 -9.370 3.522 -17.074 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -8.336 5.248 -15.665 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -10.110 5.267 -15.522 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -9.121 4.551 -14.227 1.00 0.00 H new ATOM 1912 N VAL A 123 -6.884 2.967 -16.318 1.00 0.00 N ATOM 1913 CA VAL A 123 -5.600 2.279 -16.316 1.00 0.00 C ATOM 1914 C VAL A 123 -4.532 3.246 -15.810 1.00 0.00 C ATOM 1915 O VAL A 123 -4.625 4.441 -16.078 1.00 0.00 O ATOM 1916 CB VAL A 123 -5.307 1.772 -17.741 1.00 0.00 C ATOM 1917 CG1 VAL A 123 -5.348 2.884 -18.799 1.00 0.00 C ATOM 1918 CG2 VAL A 123 -3.957 1.053 -17.825 1.00 0.00 C ATOM 0 H VAL A 123 -6.848 3.862 -16.806 1.00 0.00 H new ATOM 0 HA VAL A 123 -5.609 1.414 -15.653 1.00 0.00 H new ATOM 0 HB VAL A 123 -6.109 1.067 -17.960 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -5.133 2.461 -19.780 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -6.338 3.340 -18.809 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -4.602 3.642 -18.560 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -3.790 0.712 -18.847 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -3.161 1.739 -17.537 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -3.959 0.196 -17.152 1.00 0.00 H new ATOM 1928 N CYS A 124 -3.528 2.761 -15.071 1.00 0.00 N ATOM 1929 CA CYS A 124 -2.480 3.614 -14.531 1.00 0.00 C ATOM 1930 C CYS A 124 -1.222 2.818 -14.200 1.00 0.00 C ATOM 1931 O CYS A 124 -1.217 2.035 -13.255 1.00 0.00 O ATOM 1932 CB CYS A 124 -3.007 4.317 -13.276 1.00 0.00 C ATOM 1933 SG CYS A 124 -1.666 5.177 -12.405 1.00 0.00 S ATOM 0 H CYS A 124 -3.425 1.774 -14.836 1.00 0.00 H new ATOM 0 HA CYS A 124 -2.208 4.351 -15.286 1.00 0.00 H new ATOM 0 HB2 CYS A 124 -3.783 5.031 -13.553 1.00 0.00 H new ATOM 0 HB3 CYS A 124 -3.468 3.586 -12.611 1.00 0.00 H new ATOM 0 HG CYS A 124 -1.070 5.993 -13.223 1.00 0.00 H new ATOM 1939 N THR A 125 -0.118 3.110 -14.884 1.00 0.00 N ATOM 1940 CA THR A 125 1.206 2.674 -14.481 1.00 0.00 C ATOM 1941 C THR A 125 1.663 3.482 -13.263 1.00 0.00 C ATOM 1942 O THR A 125 1.255 4.636 -13.105 1.00 0.00 O ATOM 1943 CB THR A 125 2.142 2.923 -15.672 1.00 0.00 C ATOM 1944 OG1 THR A 125 1.826 4.179 -16.242 1.00 0.00 O ATOM 1945 CG2 THR A 125 1.941 1.862 -16.755 1.00 0.00 C ATOM 0 H THR A 125 -0.123 3.662 -15.742 1.00 0.00 H new ATOM 0 HA THR A 125 1.211 1.619 -14.206 1.00 0.00 H new ATOM 0 HB THR A 125 3.171 2.889 -15.314 1.00 0.00 H new ATOM 0 HG1 THR A 125 2.418 4.351 -17.003 1.00 0.00 H new ATOM 0 HG21 THR A 125 2.615 2.060 -17.588 1.00 0.00 H new ATOM 0 HG22 THR A 125 2.154 0.876 -16.342 1.00 0.00 H new ATOM 0 HG23 THR A 125 0.910 1.893 -17.108 1.00 0.00 H new ATOM 1953 N ARG A 126 2.507 2.878 -12.422 1.00 0.00 N ATOM 1954 CA ARG A 126 3.431 3.528 -11.504 1.00 0.00 C ATOM 1955 C ARG A 126 4.721 2.703 -11.538 1.00 0.00 C ATOM 1956 O ARG A 126 4.671 1.506 -11.827 1.00 0.00 O ATOM 1957 CB ARG A 126 2.874 3.542 -10.072 1.00 0.00 C ATOM 1958 CG ARG A 126 1.665 4.469 -9.912 1.00 0.00 C ATOM 1959 CD ARG A 126 1.205 4.506 -8.448 1.00 0.00 C ATOM 1960 NE ARG A 126 0.013 5.359 -8.294 1.00 0.00 N ATOM 1961 CZ ARG A 126 -1.018 5.171 -7.452 1.00 0.00 C ATOM 1962 NH1 ARG A 126 -1.048 4.115 -6.629 1.00 0.00 N ATOM 1963 NH2 ARG A 126 -2.024 6.052 -7.441 1.00 0.00 N ATOM 0 H ARG A 126 2.563 1.861 -12.365 1.00 0.00 H new ATOM 0 HA ARG A 126 3.596 4.564 -11.800 1.00 0.00 H new ATOM 0 HB2 ARG A 126 2.589 2.529 -9.789 1.00 0.00 H new ATOM 0 HB3 ARG A 126 3.660 3.856 -9.385 1.00 0.00 H new ATOM 0 HG2 ARG A 126 1.924 5.475 -10.243 1.00 0.00 H new ATOM 0 HG3 ARG A 126 0.849 4.125 -10.547 1.00 0.00 H new ATOM 0 HD2 ARG A 126 0.981 3.495 -8.107 1.00 0.00 H new ATOM 0 HD3 ARG A 126 2.011 4.883 -7.819 1.00 0.00 H new ATOM 0 HE ARG A 126 -0.035 6.183 -8.893 1.00 0.00 H new ATOM 0 HH11 ARG A 126 -0.282 3.441 -6.636 1.00 0.00 H new ATOM 0 HH12 ARG A 126 -1.836 3.985 -5.995 1.00 0.00 H new ATOM 0 HH21 ARG A 126 -2.004 6.857 -8.067 1.00 0.00 H new ATOM 0 HH22 ARG A 126 -2.811 5.919 -6.806 1.00 0.00 H new ATOM 1977 N THR A 127 5.872 3.302 -11.229 1.00 0.00 N ATOM 1978 CA THR A 127 7.086 2.529 -11.016 1.00 0.00 C ATOM 1979 C THR A 127 8.024 3.252 -10.052 1.00 0.00 C ATOM 1980 O THR A 127 8.017 4.484 -9.953 1.00 0.00 O ATOM 1981 CB THR A 127 7.744 2.140 -12.347 1.00 0.00 C ATOM 1982 OG1 THR A 127 8.940 1.420 -12.133 1.00 0.00 O ATOM 1983 CG2 THR A 127 8.048 3.356 -13.207 1.00 0.00 C ATOM 0 H THR A 127 5.984 4.310 -11.123 1.00 0.00 H new ATOM 0 HA THR A 127 6.824 1.586 -10.536 1.00 0.00 H new ATOM 0 HB THR A 127 7.027 1.509 -12.872 1.00 0.00 H new ATOM 0 HG1 THR A 127 8.814 0.789 -11.394 1.00 0.00 H new ATOM 0 HG21 THR A 127 8.513 3.035 -14.139 1.00 0.00 H new ATOM 0 HG22 THR A 127 7.122 3.887 -13.427 1.00 0.00 H new ATOM 0 HG23 THR A 127 8.728 4.019 -12.672 1.00 0.00 H new ATOM 1991 N TYR A 128 8.776 2.447 -9.298 1.00 0.00 N ATOM 1992 CA TYR A 128 9.554 2.854 -8.148 1.00 0.00 C ATOM 1993 C TYR A 128 10.972 2.315 -8.306 1.00 0.00 C ATOM 1994 O TYR A 128 11.159 1.178 -8.743 1.00 0.00 O ATOM 1995 CB TYR A 128 8.917 2.318 -6.858 1.00 0.00 C ATOM 1996 CG TYR A 128 7.434 2.579 -6.682 1.00 0.00 C ATOM 1997 CD1 TYR A 128 6.501 1.837 -7.428 1.00 0.00 C ATOM 1998 CD2 TYR A 128 6.977 3.507 -5.727 1.00 0.00 C ATOM 1999 CE1 TYR A 128 5.131 2.095 -7.296 1.00 0.00 C ATOM 2000 CE2 TYR A 128 5.599 3.729 -5.567 1.00 0.00 C ATOM 2001 CZ TYR A 128 4.676 3.003 -6.332 1.00 0.00 C ATOM 2002 OH TYR A 128 3.337 3.196 -6.166 1.00 0.00 O ATOM 0 H TYR A 128 8.856 1.448 -9.490 1.00 0.00 H new ATOM 0 HA TYR A 128 9.579 3.942 -8.084 1.00 0.00 H new ATOM 0 HB2 TYR A 128 9.082 1.241 -6.817 1.00 0.00 H new ATOM 0 HB3 TYR A 128 9.444 2.754 -6.009 1.00 0.00 H new ATOM 0 HD1 TYR A 128 6.842 1.067 -8.104 1.00 0.00 H new ATOM 0 HD2 TYR A 128 7.686 4.048 -5.118 1.00 0.00 H new ATOM 0 HE1 TYR A 128 4.424 1.593 -7.939 1.00 0.00 H new ATOM 0 HE2 TYR A 128 5.250 4.461 -4.853 1.00 0.00 H new ATOM 0 HH TYR A 128 3.187 3.856 -5.458 1.00 0.00 H new ATOM 2012 N GLU A 129 11.956 3.139 -7.952 1.00 0.00 N ATOM 2013 CA GLU A 129 13.372 2.851 -8.127 1.00 0.00 C ATOM 2014 C GLU A 129 14.009 2.641 -6.751 1.00 0.00 C ATOM 2015 O GLU A 129 13.658 3.335 -5.794 1.00 0.00 O ATOM 2016 CB GLU A 129 13.995 4.012 -8.908 1.00 0.00 C ATOM 2017 CG GLU A 129 15.335 3.669 -9.563 1.00 0.00 C ATOM 2018 CD GLU A 129 15.772 4.804 -10.483 1.00 0.00 C ATOM 2019 OE1 GLU A 129 15.104 4.970 -11.529 1.00 0.00 O ATOM 2020 OE2 GLU A 129 16.739 5.498 -10.110 1.00 0.00 O ATOM 0 H GLU A 129 11.783 4.049 -7.524 1.00 0.00 H new ATOM 0 HA GLU A 129 13.540 1.936 -8.696 1.00 0.00 H new ATOM 0 HB2 GLU A 129 13.296 4.334 -9.680 1.00 0.00 H new ATOM 0 HB3 GLU A 129 14.137 4.856 -8.233 1.00 0.00 H new ATOM 0 HG2 GLU A 129 16.091 3.500 -8.796 1.00 0.00 H new ATOM 0 HG3 GLU A 129 15.245 2.743 -10.131 1.00 0.00 H new ATOM 2027 N LYS A 130 14.896 1.649 -6.624 1.00 0.00 N ATOM 2028 CA LYS A 130 15.445 1.247 -5.336 1.00 0.00 C ATOM 2029 C LYS A 130 16.444 2.280 -4.818 1.00 0.00 C ATOM 2030 O LYS A 130 17.652 2.104 -4.956 1.00 0.00 O ATOM 2031 CB LYS A 130 16.072 -0.150 -5.435 1.00 0.00 C ATOM 2032 CG LYS A 130 16.553 -0.637 -4.059 1.00 0.00 C ATOM 2033 CD LYS A 130 16.540 -2.170 -3.989 1.00 0.00 C ATOM 2034 CE LYS A 130 17.087 -2.721 -2.664 1.00 0.00 C ATOM 2035 NZ LYS A 130 18.539 -2.496 -2.512 1.00 0.00 N ATOM 0 H LYS A 130 15.250 1.107 -7.412 1.00 0.00 H new ATOM 0 HA LYS A 130 14.631 1.197 -4.613 1.00 0.00 H new ATOM 0 HB2 LYS A 130 15.342 -0.852 -5.838 1.00 0.00 H new ATOM 0 HB3 LYS A 130 16.911 -0.127 -6.130 1.00 0.00 H new ATOM 0 HG2 LYS A 130 17.561 -0.268 -3.870 1.00 0.00 H new ATOM 0 HG3 LYS A 130 15.912 -0.227 -3.279 1.00 0.00 H new ATOM 0 HD2 LYS A 130 15.519 -2.525 -4.128 1.00 0.00 H new ATOM 0 HD3 LYS A 130 17.131 -2.570 -4.813 1.00 0.00 H new ATOM 0 HE2 LYS A 130 16.561 -2.249 -1.834 1.00 0.00 H new ATOM 0 HE3 LYS A 130 16.881 -3.790 -2.606 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 18.967 -3.308 -2.023 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 18.974 -2.389 -3.451 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 18.700 -1.633 -1.955 1.00 0.00 H new ATOM 2049 N GLN A 131 15.946 3.329 -4.162 1.00 0.00 N ATOM 2050 CA GLN A 131 16.813 4.336 -3.566 1.00 0.00 C ATOM 2051 C GLN A 131 17.750 3.702 -2.533 1.00 0.00 C ATOM 2052 O GLN A 131 18.907 4.094 -2.411 1.00 0.00 O ATOM 2053 CB GLN A 131 16.003 5.506 -2.995 1.00 0.00 C ATOM 2054 CG GLN A 131 15.169 5.138 -1.761 1.00 0.00 C ATOM 2055 CD GLN A 131 14.320 6.309 -1.280 1.00 0.00 C ATOM 2056 OE1 GLN A 131 13.116 6.177 -1.111 1.00 0.00 O ATOM 2057 NE2 GLN A 131 14.927 7.470 -1.060 1.00 0.00 N ATOM 0 H GLN A 131 14.949 3.500 -4.032 1.00 0.00 H new ATOM 0 HA GLN A 131 17.443 4.757 -4.350 1.00 0.00 H new ATOM 0 HB2 GLN A 131 16.685 6.314 -2.733 1.00 0.00 H new ATOM 0 HB3 GLN A 131 15.339 5.888 -3.770 1.00 0.00 H new ATOM 0 HG2 GLN A 131 14.522 4.294 -1.999 1.00 0.00 H new ATOM 0 HG3 GLN A 131 15.832 4.816 -0.958 1.00 0.00 H new ATOM 0 HE21 GLN A 131 15.933 7.556 -1.208 1.00 0.00 H new ATOM 0 HE22 GLN A 131 14.388 8.276 -0.743 1.00 0.00 H new ATOM 2066 N ALA A 132 17.263 2.698 -1.794 1.00 0.00 N ATOM 2067 CA ALA A 132 18.118 1.940 -0.892 1.00 0.00 C ATOM 2068 C ALA A 132 19.234 1.259 -1.688 1.00 0.00 C ATOM 2069 O ALA A 132 19.162 0.060 -1.950 1.00 0.00 O ATOM 2070 CB ALA A 132 17.281 0.933 -0.097 1.00 0.00 C ATOM 2071 OXT ALA A 132 20.322 1.993 -2.113 1.00 0.00 O ATOM 0 H ALA A 132 16.288 2.398 -1.807 1.00 0.00 H new ATOM 0 HA ALA A 132 18.586 2.613 -0.174 1.00 0.00 H new ATOM 0 HB1 ALA A 132 17.930 0.371 0.575 1.00 0.00 H new ATOM 0 HB2 ALA A 132 16.529 1.465 0.485 1.00 0.00 H new ATOM 0 HB3 ALA A 132 16.788 0.246 -0.785 1.00 0.00 H new