USER MOD reduce.3.24.130724 H: found=0, std=0, add=1436, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 1430 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 74 MET CE :methyl -179:sc= -0.0063 (180deg=-0.00776) USER MOD Set 1.2: B 74 MET CE :methyl 159:sc= 0 (180deg=-0.667) USER MOD Set 1.3: B 81 THR OG1 : rot 86:sc= 1.22 USER MOD Set 2.1: B 57 MET CE :methyl -159:sc= -0.208 (180deg=-1.72) USER MOD Set 2.2: B 68 CYS SG : rot 49:sc= 0.0471 USER MOD Set 3.1: A 85 HIS : no HE2:sc= -0.591 K(o=0.1,f=-1.1!) USER MOD Set 3.2: B 25 HIS : no HE2:sc= 0.692 K(o=0.1,f=-5.4!) USER MOD Set 4.1: B 17 TYR OH : rot 120:sc= 0.624 USER MOD Set 4.2: B 38 ASN : amide:sc= 0.782 K(o=1.4,f=-0.53) USER MOD Set 5.1: A 38 ASN : amide:sc= 0.93 K(o=2.4,f=-0.54) USER MOD Set 5.2: B 1 SER OG : rot 133:sc= 1.49 USER MOD Set 6.1: A 57 MET CE :methyl -159:sc= -0.45 (180deg=-2.17) USER MOD Set 6.2: A 68 CYS SG : rot 48:sc= 0.0221 USER MOD Set 7.1: A 25 HIS : no HE2:sc= 1.31 K(o=1.9,f=-9!) USER MOD Set 7.2: B 85 HIS : no HE2:sc= 0.572 K(o=1.9,f=-9.6!) USER MOD Single : A 1 SER N :NH3+ 152:sc= 0.103 (180deg=-0.654) USER MOD Single : A 1 SER OG : rot -61:sc= 1.39 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 HIS : no HE2:sc= -0.648 K(o=-0.65,f=-1.5) USER MOD Single : A 16 GLN : amide:sc= 0.605 K(o=0.6,f=0) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 SER OG : rot 153:sc= 1.57 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 135:sc= 0.233 (180deg=-0.106) USER MOD Single : A 28 LYS NZ :NH3+ 172:sc=-0.00707 (180deg=-0.13) USER MOD Single : A 29 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00258) USER MOD Single : A 30 SER OG : rot 170:sc= 1.31 USER MOD Single : A 33 LYS NZ :NH3+ -149:sc= 0.659 (180deg=0.281) USER MOD Single : A 37 ASN : amide:sc= 0.716 K(o=0.72,f=-5.5!) USER MOD Single : A 41 SER OG : rot -46:sc= 1.21 USER MOD Single : A 42 HIS : no HE2:sc= 0.943 K(o=0.94,f=-3.3!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 GLN : amide:sc=-0.00416 X(o=-0.0042,f=-0.0096) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 THR OG1 : rot 77:sc= 1.16 USER MOD Single : A 62 SER OG : rot -162:sc= 0.96 USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 79 MET CE :methyl 173:sc= -0.0665 (180deg=-0.189) USER MOD Single : A 81 THR OG1 : rot 82:sc= 1.2 USER MOD Single : A 82 THR OG1 : rot 72:sc= 1.2 USER MOD Single : A 84 CYS SG : rot 163:sc= 0.234 USER MOD Single : B 1 SER N :NH3+ -111:sc= 0.0222 (180deg=0) USER MOD Single : B 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 15 HIS : no HE2:sc= 0.47 K(o=0.47,f=-3.5!) USER MOD Single : B 16 GLN : amide:sc= 1.14 K(o=1.1,f=0) USER MOD Single : B 18 SER OG : rot -153:sc= 1.11 USER MOD Single : B 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 26 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.118) USER MOD Single : B 28 LYS NZ :NH3+ 180:sc= 0.0958 (180deg=0.0958) USER MOD Single : B 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 30 SER OG : rot 99:sc= 1.23 USER MOD Single : B 33 LYS NZ :NH3+ -173:sc=-0.00401 (180deg=-0.114) USER MOD Single : B 37 ASN : amide:sc= 1.9 K(o=1.9,f=-4.7!) USER MOD Single : B 41 SER OG : rot -98:sc= 1.21 USER MOD Single : B 42 HIS : no HE2:sc= 1.18 K(o=1.2,f=-3.5!) USER MOD Single : B 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 50 GLN : amide:sc= -0.678! C(o=-0.68!,f=-3.4!) USER MOD Single : B 55 LYS NZ :NH3+ 170:sc=-0.00809 (180deg=-0.123) USER MOD Single : B 59 THR OG1 : rot 75:sc= 1.17 USER MOD Single : B 62 SER OG : rot 160:sc= -0.397 USER MOD Single : B 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 79 MET CE :methyl 174:sc= 0 (180deg=-0.0883) USER MOD Single : B 82 THR OG1 : rot 74:sc= 1.21 USER MOD Single : B 84 CYS SG : rot 167:sc= 0.435 USER MOD Single : D 74 THR OG1 : rot -25:sc= 0.762 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 9.106 3.160 -12.896 1.00 0.00 N ATOM 2 CA SER A 1 8.363 3.185 -14.165 1.00 0.00 C ATOM 3 C SER A 1 6.956 2.620 -13.952 1.00 0.00 C ATOM 4 O SER A 1 6.032 3.361 -13.619 1.00 0.00 O ATOM 5 CB SER A 1 9.145 2.445 -15.261 1.00 0.00 C ATOM 6 OG SER A 1 9.408 1.100 -14.892 1.00 0.00 O ATOM 0 H1 SER A 1 10.124 3.077 -13.091 1.00 0.00 H new ATOM 0 H2 SER A 1 8.925 4.039 -12.370 1.00 0.00 H new ATOM 0 H3 SER A 1 8.795 2.347 -12.328 1.00 0.00 H new ATOM 0 HA SER A 1 8.250 4.214 -14.507 1.00 0.00 H new ATOM 0 HB2 SER A 1 8.577 2.464 -16.191 1.00 0.00 H new ATOM 0 HB3 SER A 1 10.085 2.962 -15.451 1.00 0.00 H new ATOM 0 HG SER A 1 9.950 1.085 -14.076 1.00 0.00 H new ATOM 14 N GLU A 2 6.819 1.297 -14.083 1.00 0.00 N ATOM 15 CA GLU A 2 5.592 0.553 -13.836 1.00 0.00 C ATOM 16 C GLU A 2 4.958 0.983 -12.515 1.00 0.00 C ATOM 17 O GLU A 2 3.778 1.330 -12.473 1.00 0.00 O ATOM 18 CB GLU A 2 5.891 -0.952 -13.812 1.00 0.00 C ATOM 19 CG GLU A 2 6.383 -1.478 -15.165 1.00 0.00 C ATOM 20 CD GLU A 2 6.556 -2.996 -15.143 1.00 0.00 C ATOM 21 OE1 GLU A 2 5.512 -3.681 -15.064 1.00 0.00 O ATOM 22 OE2 GLU A 2 7.723 -3.440 -15.192 1.00 0.00 O ATOM 0 H GLU A 2 7.591 0.698 -14.375 1.00 0.00 H new ATOM 0 HA GLU A 2 4.888 0.766 -14.640 1.00 0.00 H new ATOM 0 HB2 GLU A 2 6.644 -1.157 -13.051 1.00 0.00 H new ATOM 0 HB3 GLU A 2 4.990 -1.493 -13.522 1.00 0.00 H new ATOM 0 HG2 GLU A 2 5.673 -1.202 -15.944 1.00 0.00 H new ATOM 0 HG3 GLU A 2 7.332 -1.006 -15.417 1.00 0.00 H new ATOM 29 N LEU A 3 5.742 0.978 -11.431 1.00 0.00 N ATOM 30 CA LEU A 3 5.199 1.334 -10.127 1.00 0.00 C ATOM 31 C LEU A 3 4.725 2.785 -10.108 1.00 0.00 C ATOM 32 O LEU A 3 3.666 3.066 -9.562 1.00 0.00 O ATOM 33 CB LEU A 3 6.188 1.069 -8.989 1.00 0.00 C ATOM 34 CG LEU A 3 6.695 -0.380 -8.927 1.00 0.00 C ATOM 35 CD1 LEU A 3 7.426 -0.584 -7.598 1.00 0.00 C ATOM 36 CD2 LEU A 3 5.565 -1.408 -9.047 1.00 0.00 C ATOM 0 H LEU A 3 6.733 0.736 -11.434 1.00 0.00 H new ATOM 0 HA LEU A 3 4.339 0.687 -9.958 1.00 0.00 H new ATOM 0 HB2 LEU A 3 7.042 1.737 -9.100 1.00 0.00 H new ATOM 0 HB3 LEU A 3 5.710 1.317 -8.041 1.00 0.00 H new ATOM 0 HG LEU A 3 7.362 -0.537 -9.775 1.00 0.00 H new ATOM 0 HD11 LEU A 3 7.793 -1.609 -7.538 1.00 0.00 H new ATOM 0 HD12 LEU A 3 8.267 0.107 -7.536 1.00 0.00 H new ATOM 0 HD13 LEU A 3 6.740 -0.395 -6.773 1.00 0.00 H new ATOM 0 HD21 LEU A 3 5.982 -2.414 -8.997 1.00 0.00 H new ATOM 0 HD22 LEU A 3 4.857 -1.267 -8.230 1.00 0.00 H new ATOM 0 HD23 LEU A 3 5.052 -1.275 -9.999 1.00 0.00 H new ATOM 48 N GLU A 4 5.477 3.712 -10.707 1.00 0.00 N ATOM 49 CA GLU A 4 5.056 5.105 -10.763 1.00 0.00 C ATOM 50 C GLU A 4 3.751 5.238 -11.553 1.00 0.00 C ATOM 51 O GLU A 4 2.855 5.964 -11.136 1.00 0.00 O ATOM 52 CB GLU A 4 6.177 5.990 -11.320 1.00 0.00 C ATOM 53 CG GLU A 4 7.337 6.032 -10.314 1.00 0.00 C ATOM 54 CD GLU A 4 8.524 6.871 -10.785 1.00 0.00 C ATOM 55 OE1 GLU A 4 8.703 6.988 -12.017 1.00 0.00 O ATOM 56 OE2 GLU A 4 9.235 7.401 -9.901 1.00 0.00 O ATOM 0 H GLU A 4 6.373 3.521 -11.155 1.00 0.00 H new ATOM 0 HA GLU A 4 4.854 5.457 -9.751 1.00 0.00 H new ATOM 0 HB2 GLU A 4 6.524 5.599 -12.276 1.00 0.00 H new ATOM 0 HB3 GLU A 4 5.803 6.997 -11.504 1.00 0.00 H new ATOM 0 HG2 GLU A 4 6.972 6.432 -9.368 1.00 0.00 H new ATOM 0 HG3 GLU A 4 7.676 5.014 -10.120 1.00 0.00 H new ATOM 63 N LYS A 5 3.628 4.514 -12.669 1.00 0.00 N ATOM 64 CA LYS A 5 2.417 4.494 -13.483 1.00 0.00 C ATOM 65 C LYS A 5 1.241 4.017 -12.620 1.00 0.00 C ATOM 66 O LYS A 5 0.215 4.690 -12.499 1.00 0.00 O ATOM 67 CB LYS A 5 2.645 3.603 -14.718 1.00 0.00 C ATOM 68 CG LYS A 5 1.738 3.934 -15.914 1.00 0.00 C ATOM 69 CD LYS A 5 0.240 3.776 -15.617 1.00 0.00 C ATOM 70 CE LYS A 5 -0.571 3.832 -16.917 1.00 0.00 C ATOM 71 NZ LYS A 5 -2.016 3.732 -16.652 1.00 0.00 N ATOM 0 H LYS A 5 4.374 3.922 -13.033 1.00 0.00 H new ATOM 0 HA LYS A 5 2.176 5.493 -13.846 1.00 0.00 H new ATOM 0 HB2 LYS A 5 3.685 3.694 -15.030 1.00 0.00 H new ATOM 0 HB3 LYS A 5 2.487 2.562 -14.435 1.00 0.00 H new ATOM 0 HG2 LYS A 5 1.930 4.959 -16.231 1.00 0.00 H new ATOM 0 HG3 LYS A 5 2.004 3.287 -16.750 1.00 0.00 H new ATOM 0 HD2 LYS A 5 0.061 2.828 -15.110 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -0.089 4.566 -14.941 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -0.359 4.764 -17.440 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -0.263 3.020 -17.575 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -2.537 3.773 -17.551 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -2.220 2.831 -16.174 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -2.313 4.521 -16.043 1.00 0.00 H new ATOM 85 N ALA A 6 1.416 2.851 -11.996 1.00 0.00 N ATOM 86 CA ALA A 6 0.451 2.254 -11.088 1.00 0.00 C ATOM 87 C ALA A 6 0.015 3.272 -10.027 1.00 0.00 C ATOM 88 O ALA A 6 -1.172 3.536 -9.848 1.00 0.00 O ATOM 89 CB ALA A 6 1.099 1.016 -10.457 1.00 0.00 C ATOM 0 H ALA A 6 2.257 2.286 -12.115 1.00 0.00 H new ATOM 0 HA ALA A 6 -0.449 1.954 -11.625 1.00 0.00 H new ATOM 0 HB1 ALA A 6 0.395 0.547 -9.769 1.00 0.00 H new ATOM 0 HB2 ALA A 6 1.368 0.307 -11.240 1.00 0.00 H new ATOM 0 HB3 ALA A 6 1.995 1.312 -9.912 1.00 0.00 H new ATOM 95 N VAL A 7 0.995 3.859 -9.345 1.00 0.00 N ATOM 96 CA VAL A 7 0.813 4.869 -8.319 1.00 0.00 C ATOM 97 C VAL A 7 -0.009 6.056 -8.838 1.00 0.00 C ATOM 98 O VAL A 7 -1.038 6.380 -8.245 1.00 0.00 O ATOM 99 CB VAL A 7 2.200 5.241 -7.773 1.00 0.00 C ATOM 100 CG1 VAL A 7 2.238 6.582 -7.051 1.00 0.00 C ATOM 101 CG2 VAL A 7 2.688 4.145 -6.814 1.00 0.00 C ATOM 0 H VAL A 7 1.977 3.631 -9.503 1.00 0.00 H new ATOM 0 HA VAL A 7 0.220 4.484 -7.489 1.00 0.00 H new ATOM 0 HB VAL A 7 2.854 5.329 -8.640 1.00 0.00 H new ATOM 0 HG11 VAL A 7 3.250 6.775 -6.694 1.00 0.00 H new ATOM 0 HG12 VAL A 7 1.938 7.374 -7.738 1.00 0.00 H new ATOM 0 HG13 VAL A 7 1.553 6.558 -6.203 1.00 0.00 H new ATOM 0 HG21 VAL A 7 3.672 4.411 -6.428 1.00 0.00 H new ATOM 0 HG22 VAL A 7 1.987 4.048 -5.985 1.00 0.00 H new ATOM 0 HG23 VAL A 7 2.752 3.197 -7.348 1.00 0.00 H new ATOM 111 N VAL A 8 0.397 6.708 -9.934 1.00 0.00 N ATOM 112 CA VAL A 8 -0.367 7.855 -10.418 1.00 0.00 C ATOM 113 C VAL A 8 -1.783 7.438 -10.817 1.00 0.00 C ATOM 114 O VAL A 8 -2.722 8.185 -10.554 1.00 0.00 O ATOM 115 CB VAL A 8 0.350 8.675 -11.504 1.00 0.00 C ATOM 116 CG1 VAL A 8 1.674 9.243 -10.977 1.00 0.00 C ATOM 117 CG2 VAL A 8 0.574 7.915 -12.813 1.00 0.00 C ATOM 0 H VAL A 8 1.222 6.469 -10.484 1.00 0.00 H new ATOM 0 HA VAL A 8 -0.450 8.547 -9.580 1.00 0.00 H new ATOM 0 HB VAL A 8 -0.326 9.495 -11.745 1.00 0.00 H new ATOM 0 HG11 VAL A 8 2.162 9.819 -11.764 1.00 0.00 H new ATOM 0 HG12 VAL A 8 1.478 9.890 -10.122 1.00 0.00 H new ATOM 0 HG13 VAL A 8 2.325 8.424 -10.670 1.00 0.00 H new ATOM 0 HG21 VAL A 8 1.085 8.562 -13.526 1.00 0.00 H new ATOM 0 HG22 VAL A 8 1.185 7.033 -12.622 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -0.388 7.608 -13.225 1.00 0.00 H new ATOM 127 N ALA A 9 -1.968 6.248 -11.403 1.00 0.00 N ATOM 128 CA ALA A 9 -3.312 5.748 -11.680 1.00 0.00 C ATOM 129 C ALA A 9 -4.130 5.653 -10.387 1.00 0.00 C ATOM 130 O ALA A 9 -5.227 6.207 -10.310 1.00 0.00 O ATOM 131 CB ALA A 9 -3.264 4.404 -12.408 1.00 0.00 C ATOM 0 H ALA A 9 -1.213 5.625 -11.689 1.00 0.00 H new ATOM 0 HA ALA A 9 -3.808 6.458 -12.341 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -4.280 4.058 -12.600 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -2.736 4.521 -13.354 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -2.743 3.674 -11.789 1.00 0.00 H new ATOM 137 N LEU A 10 -3.588 4.981 -9.364 1.00 0.00 N ATOM 138 CA LEU A 10 -4.248 4.826 -8.072 1.00 0.00 C ATOM 139 C LEU A 10 -4.632 6.198 -7.514 1.00 0.00 C ATOM 140 O LEU A 10 -5.790 6.410 -7.150 1.00 0.00 O ATOM 141 CB LEU A 10 -3.344 4.049 -7.098 1.00 0.00 C ATOM 142 CG LEU A 10 -3.203 2.558 -7.463 1.00 0.00 C ATOM 143 CD1 LEU A 10 -1.920 1.980 -6.858 1.00 0.00 C ATOM 144 CD2 LEU A 10 -4.387 1.733 -6.943 1.00 0.00 C ATOM 0 H LEU A 10 -2.675 4.529 -9.414 1.00 0.00 H new ATOM 0 HA LEU A 10 -5.163 4.248 -8.202 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -2.356 4.509 -7.084 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -3.749 4.133 -6.090 1.00 0.00 H new ATOM 0 HG LEU A 10 -3.174 2.500 -8.551 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -1.835 0.927 -7.124 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -1.058 2.523 -7.245 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -1.953 2.078 -5.773 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -4.252 0.688 -7.220 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -4.440 1.817 -5.858 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -5.312 2.108 -7.382 1.00 0.00 H new ATOM 156 N ILE A 11 -3.684 7.139 -7.480 1.00 0.00 N ATOM 157 CA ILE A 11 -3.949 8.485 -6.992 1.00 0.00 C ATOM 158 C ILE A 11 -5.067 9.143 -7.808 1.00 0.00 C ATOM 159 O ILE A 11 -6.049 9.617 -7.242 1.00 0.00 O ATOM 160 CB ILE A 11 -2.647 9.315 -6.975 1.00 0.00 C ATOM 161 CG1 ILE A 11 -1.698 8.763 -5.898 1.00 0.00 C ATOM 162 CG2 ILE A 11 -2.920 10.790 -6.669 1.00 0.00 C ATOM 163 CD1 ILE A 11 -0.379 9.531 -5.774 1.00 0.00 C ATOM 0 H ILE A 11 -2.723 6.987 -7.787 1.00 0.00 H new ATOM 0 HA ILE A 11 -4.304 8.434 -5.963 1.00 0.00 H new ATOM 0 HB ILE A 11 -2.197 9.240 -7.965 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -2.209 8.781 -4.935 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -1.479 7.719 -6.123 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -1.980 11.341 -6.666 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -3.580 11.204 -7.431 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -3.395 10.877 -5.692 1.00 0.00 H new ATOM 0 HD11 ILE A 11 0.233 9.079 -4.994 1.00 0.00 H new ATOM 0 HD12 ILE A 11 0.156 9.491 -6.723 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -0.586 10.570 -5.517 1.00 0.00 H new ATOM 175 N ASP A 12 -4.934 9.163 -9.135 1.00 0.00 N ATOM 176 CA ASP A 12 -5.854 9.862 -10.021 1.00 0.00 C ATOM 177 C ASP A 12 -7.278 9.325 -9.878 1.00 0.00 C ATOM 178 O ASP A 12 -8.234 10.086 -9.709 1.00 0.00 O ATOM 179 CB ASP A 12 -5.365 9.727 -11.468 1.00 0.00 C ATOM 180 CG ASP A 12 -6.350 10.347 -12.454 1.00 0.00 C ATOM 181 OD1 ASP A 12 -6.544 11.578 -12.361 1.00 0.00 O ATOM 182 OD2 ASP A 12 -6.905 9.574 -13.265 1.00 0.00 O ATOM 0 H ASP A 12 -4.176 8.689 -9.626 1.00 0.00 H new ATOM 0 HA ASP A 12 -5.876 10.916 -9.744 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -4.393 10.210 -11.571 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -5.224 8.673 -11.708 1.00 0.00 H new ATOM 187 N VAL A 13 -7.435 8.005 -9.975 1.00 0.00 N ATOM 188 CA VAL A 13 -8.747 7.386 -9.871 1.00 0.00 C ATOM 189 C VAL A 13 -9.315 7.645 -8.474 1.00 0.00 C ATOM 190 O VAL A 13 -10.449 8.108 -8.346 1.00 0.00 O ATOM 191 CB VAL A 13 -8.656 5.892 -10.210 1.00 0.00 C ATOM 192 CG1 VAL A 13 -10.015 5.203 -10.034 1.00 0.00 C ATOM 193 CG2 VAL A 13 -8.227 5.691 -11.669 1.00 0.00 C ATOM 0 H VAL A 13 -6.669 7.349 -10.125 1.00 0.00 H new ATOM 0 HA VAL A 13 -9.434 7.827 -10.593 1.00 0.00 H new ATOM 0 HB VAL A 13 -7.922 5.458 -9.531 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -9.921 4.145 -10.281 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -10.344 5.307 -9.000 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -10.746 5.667 -10.696 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -8.169 4.625 -11.888 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -8.957 6.158 -12.330 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -7.250 6.148 -11.827 1.00 0.00 H new ATOM 203 N PHE A 14 -8.523 7.378 -7.428 1.00 0.00 N ATOM 204 CA PHE A 14 -8.964 7.609 -6.062 1.00 0.00 C ATOM 205 C PHE A 14 -9.466 9.041 -5.886 1.00 0.00 C ATOM 206 O PHE A 14 -10.562 9.241 -5.363 1.00 0.00 O ATOM 207 CB PHE A 14 -7.841 7.295 -5.071 1.00 0.00 C ATOM 208 CG PHE A 14 -8.266 7.467 -3.630 1.00 0.00 C ATOM 209 CD1 PHE A 14 -8.281 8.748 -3.047 1.00 0.00 C ATOM 210 CD2 PHE A 14 -8.755 6.368 -2.904 1.00 0.00 C ATOM 211 CE1 PHE A 14 -8.716 8.914 -1.725 1.00 0.00 C ATOM 212 CE2 PHE A 14 -9.191 6.540 -1.580 1.00 0.00 C ATOM 213 CZ PHE A 14 -9.174 7.812 -0.991 1.00 0.00 C ATOM 0 H PHE A 14 -7.578 7.003 -7.509 1.00 0.00 H new ATOM 0 HA PHE A 14 -9.796 6.936 -5.854 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -7.502 6.270 -5.225 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -6.991 7.946 -5.274 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -7.957 9.605 -3.619 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -8.796 5.392 -3.364 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -8.698 9.894 -1.271 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -9.541 5.689 -1.014 1.00 0.00 H new ATOM 0 HZ PHE A 14 -9.513 7.942 0.026 1.00 0.00 H new ATOM 223 N HIS A 15 -8.673 10.031 -6.319 1.00 0.00 N ATOM 224 CA HIS A 15 -9.023 11.441 -6.208 1.00 0.00 C ATOM 225 C HIS A 15 -10.395 11.677 -6.832 1.00 0.00 C ATOM 226 O HIS A 15 -11.278 12.238 -6.185 1.00 0.00 O ATOM 227 CB HIS A 15 -7.991 12.325 -6.928 1.00 0.00 C ATOM 228 CG HIS A 15 -6.731 12.643 -6.163 1.00 0.00 C ATOM 229 ND1 HIS A 15 -5.972 13.781 -6.328 1.00 0.00 N ATOM 230 CD2 HIS A 15 -6.129 11.884 -5.194 1.00 0.00 C ATOM 231 CE1 HIS A 15 -4.941 13.708 -5.474 1.00 0.00 C ATOM 232 NE2 HIS A 15 -4.991 12.571 -4.763 1.00 0.00 N ATOM 0 H HIS A 15 -7.767 9.868 -6.758 1.00 0.00 H new ATOM 0 HA HIS A 15 -9.036 11.705 -5.151 1.00 0.00 H new ATOM 0 HB2 HIS A 15 -7.710 11.833 -7.859 1.00 0.00 H new ATOM 0 HB3 HIS A 15 -8.474 13.265 -7.197 1.00 0.00 H new ATOM 0 HD1 HIS A 15 -6.160 14.541 -6.981 1.00 0.00 H new ATOM 0 HD2 HIS A 15 -6.472 10.927 -4.829 1.00 0.00 H new ATOM 0 HE1 HIS A 15 -4.174 14.462 -5.372 1.00 0.00 H new ATOM 240 N GLN A 16 -10.576 11.248 -8.085 1.00 0.00 N ATOM 241 CA GLN A 16 -11.829 11.494 -8.783 1.00 0.00 C ATOM 242 C GLN A 16 -12.992 10.872 -8.011 1.00 0.00 C ATOM 243 O GLN A 16 -13.941 11.572 -7.658 1.00 0.00 O ATOM 244 CB GLN A 16 -11.750 10.915 -10.203 1.00 0.00 C ATOM 245 CG GLN A 16 -10.870 11.785 -11.107 1.00 0.00 C ATOM 246 CD GLN A 16 -10.469 11.041 -12.376 1.00 0.00 C ATOM 247 OE1 GLN A 16 -10.972 11.312 -13.461 1.00 0.00 O ATOM 248 NE2 GLN A 16 -9.546 10.101 -12.228 1.00 0.00 N ATOM 0 H GLN A 16 -9.878 10.736 -8.625 1.00 0.00 H new ATOM 0 HA GLN A 16 -12.000 12.568 -8.851 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -11.348 9.903 -10.164 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -12.752 10.844 -10.626 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -11.407 12.696 -11.372 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -9.975 12.089 -10.563 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -9.156 9.910 -11.305 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -9.226 9.569 -13.037 1.00 0.00 H new ATOM 257 N TYR A 17 -12.888 9.585 -7.678 1.00 0.00 N ATOM 258 CA TYR A 17 -13.976 8.846 -7.046 1.00 0.00 C ATOM 259 C TYR A 17 -14.320 9.503 -5.702 1.00 0.00 C ATOM 260 O TYR A 17 -15.463 9.888 -5.454 1.00 0.00 O ATOM 261 CB TYR A 17 -13.592 7.359 -6.933 1.00 0.00 C ATOM 262 CG TYR A 17 -13.753 6.544 -8.214 1.00 0.00 C ATOM 263 CD1 TYR A 17 -13.177 6.969 -9.428 1.00 0.00 C ATOM 264 CD2 TYR A 17 -14.486 5.341 -8.194 1.00 0.00 C ATOM 265 CE1 TYR A 17 -13.324 6.204 -10.596 1.00 0.00 C ATOM 266 CE2 TYR A 17 -14.561 4.534 -9.346 1.00 0.00 C ATOM 267 CZ TYR A 17 -13.964 4.957 -10.544 1.00 0.00 C ATOM 268 OH TYR A 17 -14.082 4.214 -11.679 1.00 0.00 O ATOM 0 H TYR A 17 -12.048 9.029 -7.839 1.00 0.00 H new ATOM 0 HA TYR A 17 -14.881 8.883 -7.652 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -12.554 7.293 -6.608 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -14.200 6.902 -6.152 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -12.617 7.892 -9.460 1.00 0.00 H new ATOM 0 HD2 TYR A 17 -14.993 5.036 -7.291 1.00 0.00 H new ATOM 0 HE1 TYR A 17 -12.944 6.576 -11.536 1.00 0.00 H new ATOM 0 HE2 TYR A 17 -15.079 3.587 -9.307 1.00 0.00 H new ATOM 0 HH TYR A 17 -14.549 3.377 -11.475 1.00 0.00 H new ATOM 278 N SER A 18 -13.299 9.720 -4.873 1.00 0.00 N ATOM 279 CA SER A 18 -13.381 10.448 -3.612 1.00 0.00 C ATOM 280 C SER A 18 -13.925 11.871 -3.767 1.00 0.00 C ATOM 281 O SER A 18 -14.391 12.450 -2.786 1.00 0.00 O ATOM 282 CB SER A 18 -12.005 10.468 -2.958 1.00 0.00 C ATOM 283 OG SER A 18 -11.539 9.147 -2.810 1.00 0.00 O ATOM 0 H SER A 18 -12.358 9.380 -5.071 1.00 0.00 H new ATOM 0 HA SER A 18 -14.095 9.924 -2.977 1.00 0.00 H new ATOM 0 HB2 SER A 18 -11.309 11.045 -3.567 1.00 0.00 H new ATOM 0 HB3 SER A 18 -12.059 10.957 -1.986 1.00 0.00 H new ATOM 0 HG SER A 18 -10.559 9.145 -2.804 1.00 0.00 H new ATOM 289 N GLY A 19 -13.812 12.475 -4.954 1.00 0.00 N ATOM 290 CA GLY A 19 -14.398 13.768 -5.242 1.00 0.00 C ATOM 291 C GLY A 19 -15.889 13.605 -5.517 1.00 0.00 C ATOM 292 O GLY A 19 -16.692 14.405 -5.048 1.00 0.00 O ATOM 0 H GLY A 19 -13.306 12.069 -5.741 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -14.245 14.443 -4.400 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -13.906 14.217 -6.105 1.00 0.00 H new ATOM 296 N ARG A 20 -16.258 12.572 -6.283 1.00 0.00 N ATOM 297 CA ARG A 20 -17.638 12.359 -6.696 1.00 0.00 C ATOM 298 C ARG A 20 -18.556 12.194 -5.486 1.00 0.00 C ATOM 299 O ARG A 20 -19.533 12.931 -5.368 1.00 0.00 O ATOM 300 CB ARG A 20 -17.751 11.165 -7.648 1.00 0.00 C ATOM 301 CG ARG A 20 -16.854 11.350 -8.878 1.00 0.00 C ATOM 302 CD ARG A 20 -17.515 10.762 -10.129 1.00 0.00 C ATOM 303 NE ARG A 20 -17.584 9.296 -10.032 1.00 0.00 N ATOM 304 CZ ARG A 20 -16.549 8.471 -10.246 1.00 0.00 C ATOM 305 NH1 ARG A 20 -15.373 8.952 -10.663 1.00 0.00 N ATOM 306 NH2 ARG A 20 -16.685 7.159 -10.038 1.00 0.00 N ATOM 0 H ARG A 20 -15.607 11.867 -6.629 1.00 0.00 H new ATOM 0 HA ARG A 20 -17.965 13.246 -7.239 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -17.471 10.251 -7.124 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -18.787 11.046 -7.965 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -16.654 12.411 -9.031 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -15.892 10.866 -8.708 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -18.518 11.173 -10.245 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -16.949 11.048 -11.016 1.00 0.00 H new ATOM 0 HE ARG A 20 -18.481 8.878 -9.785 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -15.258 9.953 -10.821 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -14.591 8.318 -10.823 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -17.577 6.783 -9.716 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -15.897 6.532 -10.201 1.00 0.00 H new ATOM 320 N GLU A 21 -18.243 11.256 -4.584 1.00 0.00 N ATOM 321 CA GLU A 21 -18.928 11.180 -3.298 1.00 0.00 C ATOM 322 C GLU A 21 -17.918 10.790 -2.222 1.00 0.00 C ATOM 323 O GLU A 21 -17.590 9.617 -2.041 1.00 0.00 O ATOM 324 CB GLU A 21 -20.122 10.210 -3.346 1.00 0.00 C ATOM 325 CG GLU A 21 -21.190 10.597 -4.380 1.00 0.00 C ATOM 326 CD GLU A 21 -22.447 9.734 -4.291 1.00 0.00 C ATOM 327 OE1 GLU A 21 -22.398 8.710 -3.573 1.00 0.00 O ATOM 328 OE2 GLU A 21 -23.443 10.116 -4.940 1.00 0.00 O ATOM 0 H GLU A 21 -17.524 10.546 -4.724 1.00 0.00 H new ATOM 0 HA GLU A 21 -19.345 12.157 -3.055 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -19.756 9.208 -3.572 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -20.583 10.166 -2.359 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -21.463 11.643 -4.238 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -20.767 10.511 -5.381 1.00 0.00 H new ATOM 335 N GLY A 22 -17.468 11.771 -1.445 1.00 0.00 N ATOM 336 CA GLY A 22 -16.385 11.566 -0.510 1.00 0.00 C ATOM 337 C GLY A 22 -15.776 12.905 -0.136 1.00 0.00 C ATOM 338 O GLY A 22 -16.416 13.942 -0.312 1.00 0.00 O ATOM 0 H GLY A 22 -17.845 12.719 -1.451 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -16.753 11.060 0.383 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -15.626 10.921 -0.952 1.00 0.00 H new ATOM 342 N ASP A 23 -14.552 12.867 0.394 1.00 0.00 N ATOM 343 CA ASP A 23 -13.863 14.026 0.950 1.00 0.00 C ATOM 344 C ASP A 23 -12.575 14.317 0.170 1.00 0.00 C ATOM 345 O ASP A 23 -11.664 14.938 0.711 1.00 0.00 O ATOM 346 CB ASP A 23 -13.595 13.731 2.436 1.00 0.00 C ATOM 347 CG ASP A 23 -12.926 14.874 3.197 1.00 0.00 C ATOM 348 OD1 ASP A 23 -13.471 15.998 3.137 1.00 0.00 O ATOM 349 OD2 ASP A 23 -11.894 14.592 3.845 1.00 0.00 O ATOM 0 H ASP A 23 -14.003 12.009 0.448 1.00 0.00 H new ATOM 0 HA ASP A 23 -14.474 14.925 0.864 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -14.541 13.492 2.922 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -12.965 12.844 2.510 1.00 0.00 H new ATOM 354 N LYS A 24 -12.462 13.826 -1.074 1.00 0.00 N ATOM 355 CA LYS A 24 -11.238 13.840 -1.886 1.00 0.00 C ATOM 356 C LYS A 24 -10.169 12.896 -1.315 1.00 0.00 C ATOM 357 O LYS A 24 -9.638 12.052 -2.032 1.00 0.00 O ATOM 358 CB LYS A 24 -10.673 15.250 -2.101 1.00 0.00 C ATOM 359 CG LYS A 24 -11.726 16.264 -2.564 1.00 0.00 C ATOM 360 CD LYS A 24 -11.068 17.545 -3.098 1.00 0.00 C ATOM 361 CE LYS A 24 -10.181 18.225 -2.046 1.00 0.00 C ATOM 362 NZ LYS A 24 -9.669 19.518 -2.532 1.00 0.00 N ATOM 0 H LYS A 24 -13.249 13.393 -1.558 1.00 0.00 H new ATOM 0 HA LYS A 24 -11.528 13.470 -2.870 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -10.227 15.600 -1.170 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -9.874 15.204 -2.841 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -12.346 15.819 -3.342 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -12.387 16.511 -1.733 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -10.468 17.304 -3.975 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -11.842 18.241 -3.422 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -10.752 18.379 -1.130 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -9.345 17.572 -1.795 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -9.073 19.953 -1.799 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -9.105 19.367 -3.392 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -10.467 20.148 -2.748 1.00 0.00 H new ATOM 376 N HIS A 25 -9.886 13.009 -0.017 1.00 0.00 N ATOM 377 CA HIS A 25 -9.019 12.125 0.742 1.00 0.00 C ATOM 378 C HIS A 25 -9.706 10.807 1.103 1.00 0.00 C ATOM 379 O HIS A 25 -9.010 9.883 1.525 1.00 0.00 O ATOM 380 CB HIS A 25 -8.599 12.839 2.033 1.00 0.00 C ATOM 381 CG HIS A 25 -7.930 14.166 1.797 1.00 0.00 C ATOM 382 ND1 HIS A 25 -6.753 14.361 1.117 1.00 0.00 N ATOM 383 CD2 HIS A 25 -8.391 15.391 2.197 1.00 0.00 C ATOM 384 CE1 HIS A 25 -6.505 15.680 1.116 1.00 0.00 C ATOM 385 NE2 HIS A 25 -7.473 16.351 1.763 1.00 0.00 N ATOM 0 H HIS A 25 -10.277 13.757 0.556 1.00 0.00 H new ATOM 0 HA HIS A 25 -8.155 11.887 0.121 1.00 0.00 H new ATOM 0 HB2 HIS A 25 -9.480 12.991 2.657 1.00 0.00 H new ATOM 0 HB3 HIS A 25 -7.921 12.194 2.591 1.00 0.00 H new ATOM 0 HD1 HIS A 25 -6.174 13.637 0.691 1.00 0.00 H new ATOM 0 HD2 HIS A 25 -9.300 15.581 2.748 1.00 0.00 H new ATOM 0 HE1 HIS A 25 -5.643 16.141 0.657 1.00 0.00 H new ATOM 393 N LYS A 26 -11.043 10.718 1.004 1.00 0.00 N ATOM 394 CA LYS A 26 -11.814 9.584 1.507 1.00 0.00 C ATOM 395 C LYS A 26 -12.975 9.245 0.567 1.00 0.00 C ATOM 396 O LYS A 26 -13.556 10.163 -0.013 1.00 0.00 O ATOM 397 CB LYS A 26 -12.357 9.867 2.919 1.00 0.00 C ATOM 398 CG LYS A 26 -11.383 10.582 3.866 1.00 0.00 C ATOM 399 CD LYS A 26 -11.980 10.666 5.278 1.00 0.00 C ATOM 400 CE LYS A 26 -10.999 11.302 6.270 1.00 0.00 C ATOM 401 NZ LYS A 26 -10.610 12.666 5.870 1.00 0.00 N ATOM 0 H LYS A 26 -11.617 11.440 0.568 1.00 0.00 H new ATOM 0 HA LYS A 26 -11.140 8.729 1.554 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -13.260 10.471 2.829 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -12.651 8.921 3.374 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -10.434 10.046 3.896 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -11.171 11.584 3.493 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -12.900 11.250 5.250 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -12.247 9.666 5.620 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -11.454 11.331 7.260 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -10.108 10.679 6.347 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -10.646 13.294 6.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -9.643 12.653 5.487 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -11.266 13.015 5.142 1.00 0.00 H new ATOM 415 N LEU A 27 -13.310 7.949 0.459 1.00 0.00 N ATOM 416 CA LEU A 27 -14.352 7.373 -0.398 1.00 0.00 C ATOM 417 C LEU A 27 -15.591 7.004 0.428 1.00 0.00 C ATOM 418 O LEU A 27 -15.435 6.337 1.452 1.00 0.00 O ATOM 419 CB LEU A 27 -13.851 6.036 -0.971 1.00 0.00 C ATOM 420 CG LEU A 27 -12.611 6.087 -1.870 1.00 0.00 C ATOM 421 CD1 LEU A 27 -11.983 4.692 -1.854 1.00 0.00 C ATOM 422 CD2 LEU A 27 -12.951 6.425 -3.325 1.00 0.00 C ATOM 0 H LEU A 27 -12.829 7.233 1.003 1.00 0.00 H new ATOM 0 HA LEU A 27 -14.586 8.108 -1.168 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -13.637 5.368 -0.136 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -14.664 5.585 -1.540 1.00 0.00 H new ATOM 0 HG LEU A 27 -11.946 6.863 -1.492 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -11.094 4.686 -2.485 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -11.706 4.430 -0.833 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -12.701 3.965 -2.233 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -12.036 6.448 -3.917 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -13.624 5.668 -3.727 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -13.435 7.400 -3.368 1.00 0.00 H new ATOM 434 N LYS A 28 -16.805 7.362 -0.015 1.00 0.00 N ATOM 435 CA LYS A 28 -18.047 6.859 0.589 1.00 0.00 C ATOM 436 C LYS A 28 -18.258 5.386 0.232 1.00 0.00 C ATOM 437 O LYS A 28 -17.557 4.856 -0.620 1.00 0.00 O ATOM 438 CB LYS A 28 -19.240 7.654 0.055 1.00 0.00 C ATOM 439 CG LYS A 28 -19.188 9.109 0.506 1.00 0.00 C ATOM 440 CD LYS A 28 -19.934 9.355 1.822 1.00 0.00 C ATOM 441 CE LYS A 28 -19.655 10.767 2.355 1.00 0.00 C ATOM 442 NZ LYS A 28 -19.989 11.812 1.369 1.00 0.00 N ATOM 0 H LYS A 28 -16.953 8.002 -0.795 1.00 0.00 H new ATOM 0 HA LYS A 28 -17.968 6.969 1.671 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -19.250 7.610 -1.034 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -20.167 7.197 0.401 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -18.147 9.410 0.623 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -19.617 9.740 -0.272 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -21.005 9.226 1.667 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -19.628 8.616 2.562 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -20.233 10.931 3.265 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -18.603 10.849 2.627 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -19.914 12.748 1.816 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -19.328 11.757 0.568 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -20.961 11.669 1.027 1.00 0.00 H new ATOM 456 N LYS A 29 -19.256 4.732 0.841 1.00 0.00 N ATOM 457 CA LYS A 29 -19.620 3.357 0.502 1.00 0.00 C ATOM 458 C LYS A 29 -19.964 3.227 -0.981 1.00 0.00 C ATOM 459 O LYS A 29 -19.585 2.249 -1.618 1.00 0.00 O ATOM 460 CB LYS A 29 -20.729 2.835 1.437 1.00 0.00 C ATOM 461 CG LYS A 29 -22.026 3.659 1.410 1.00 0.00 C ATOM 462 CD LYS A 29 -23.168 2.936 2.139 1.00 0.00 C ATOM 463 CE LYS A 29 -22.850 2.535 3.584 1.00 0.00 C ATOM 464 NZ LYS A 29 -22.491 3.692 4.423 1.00 0.00 N ATOM 0 H LYS A 29 -19.829 5.142 1.579 1.00 0.00 H new ATOM 0 HA LYS A 29 -18.755 2.714 0.666 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -20.962 1.806 1.164 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -20.347 2.816 2.458 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -21.852 4.629 1.876 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -22.316 3.850 0.377 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -24.047 3.581 2.140 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -23.431 2.040 1.577 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -23.714 2.030 4.016 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -22.028 1.819 3.587 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -22.302 3.371 5.394 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -21.641 4.150 4.037 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -23.277 4.373 4.431 1.00 0.00 H new ATOM 478 N SER A 30 -20.636 4.224 -1.557 1.00 0.00 N ATOM 479 CA SER A 30 -20.920 4.246 -2.978 1.00 0.00 C ATOM 480 C SER A 30 -19.611 4.175 -3.764 1.00 0.00 C ATOM 481 O SER A 30 -19.437 3.298 -4.614 1.00 0.00 O ATOM 482 CB SER A 30 -21.669 5.549 -3.277 1.00 0.00 C ATOM 483 OG SER A 30 -21.189 6.573 -2.418 1.00 0.00 O ATOM 0 H SER A 30 -20.994 5.032 -1.048 1.00 0.00 H new ATOM 0 HA SER A 30 -21.530 3.392 -3.272 1.00 0.00 H new ATOM 0 HB2 SER A 30 -21.524 5.835 -4.319 1.00 0.00 H new ATOM 0 HB3 SER A 30 -22.740 5.408 -3.131 1.00 0.00 H new ATOM 0 HG SER A 30 -21.544 7.438 -2.710 1.00 0.00 H new ATOM 489 N GLU A 31 -18.664 5.065 -3.441 1.00 0.00 N ATOM 490 CA GLU A 31 -17.405 5.110 -4.166 1.00 0.00 C ATOM 491 C GLU A 31 -16.596 3.835 -3.949 1.00 0.00 C ATOM 492 O GLU A 31 -16.072 3.272 -4.905 1.00 0.00 O ATOM 493 CB GLU A 31 -16.616 6.373 -3.824 1.00 0.00 C ATOM 494 CG GLU A 31 -17.386 7.624 -4.260 1.00 0.00 C ATOM 495 CD GLU A 31 -17.675 7.698 -5.758 1.00 0.00 C ATOM 496 OE1 GLU A 31 -16.827 7.215 -6.540 1.00 0.00 O ATOM 497 OE2 GLU A 31 -18.753 8.236 -6.095 1.00 0.00 O ATOM 0 H GLU A 31 -18.751 5.752 -2.692 1.00 0.00 H new ATOM 0 HA GLU A 31 -17.627 5.159 -5.232 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -16.427 6.411 -2.751 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -15.645 6.347 -4.318 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -18.331 7.661 -3.718 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -16.816 8.506 -3.968 1.00 0.00 H new ATOM 504 N LEU A 32 -16.504 3.370 -2.704 1.00 0.00 N ATOM 505 CA LEU A 32 -15.795 2.155 -2.332 1.00 0.00 C ATOM 506 C LEU A 32 -16.353 0.984 -3.146 1.00 0.00 C ATOM 507 O LEU A 32 -15.589 0.264 -3.781 1.00 0.00 O ATOM 508 CB LEU A 32 -15.888 1.960 -0.804 1.00 0.00 C ATOM 509 CG LEU A 32 -14.776 1.144 -0.112 1.00 0.00 C ATOM 510 CD1 LEU A 32 -14.729 -0.336 -0.497 1.00 0.00 C ATOM 511 CD2 LEU A 32 -13.390 1.774 -0.291 1.00 0.00 C ATOM 0 H LEU A 32 -16.933 3.843 -1.908 1.00 0.00 H new ATOM 0 HA LEU A 32 -14.733 2.220 -2.568 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -15.916 2.947 -0.342 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -16.841 1.479 -0.586 1.00 0.00 H new ATOM 0 HG LEU A 32 -15.052 1.180 0.942 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -13.916 -0.826 0.039 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -15.675 -0.810 -0.235 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -14.563 -0.428 -1.570 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -12.644 1.161 0.215 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -13.152 1.833 -1.353 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -13.388 2.776 0.138 1.00 0.00 H new ATOM 523 N LYS A 33 -17.681 0.830 -3.206 1.00 0.00 N ATOM 524 CA LYS A 33 -18.320 -0.220 -3.992 1.00 0.00 C ATOM 525 C LYS A 33 -17.873 -0.141 -5.454 1.00 0.00 C ATOM 526 O LYS A 33 -17.354 -1.120 -5.995 1.00 0.00 O ATOM 527 CB LYS A 33 -19.852 -0.104 -3.849 1.00 0.00 C ATOM 528 CG LYS A 33 -20.622 -0.966 -4.867 1.00 0.00 C ATOM 529 CD LYS A 33 -22.151 -0.870 -4.778 1.00 0.00 C ATOM 530 CE LYS A 33 -22.691 -1.224 -3.390 1.00 0.00 C ATOM 531 NZ LYS A 33 -24.112 -1.611 -3.441 1.00 0.00 N ATOM 0 H LYS A 33 -18.338 1.432 -2.710 1.00 0.00 H new ATOM 0 HA LYS A 33 -18.016 -1.198 -3.618 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -20.140 -0.400 -2.840 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -20.144 0.939 -3.971 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -20.313 -0.677 -5.872 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -20.331 -2.008 -4.732 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -22.462 0.142 -5.036 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -22.595 -1.538 -5.516 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -22.106 -2.042 -2.969 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -22.570 -0.370 -2.724 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -24.577 -1.342 -2.551 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -24.576 -1.125 -4.235 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -24.187 -2.640 -3.573 1.00 0.00 H new ATOM 545 N GLU A 34 -18.113 0.988 -6.128 1.00 0.00 N ATOM 546 CA GLU A 34 -17.883 1.066 -7.570 1.00 0.00 C ATOM 547 C GLU A 34 -16.391 0.910 -7.859 1.00 0.00 C ATOM 548 O GLU A 34 -16.007 0.156 -8.751 1.00 0.00 O ATOM 549 CB GLU A 34 -18.525 2.325 -8.176 1.00 0.00 C ATOM 550 CG GLU A 34 -17.954 3.630 -7.619 1.00 0.00 C ATOM 551 CD GLU A 34 -18.808 4.845 -7.966 1.00 0.00 C ATOM 552 OE1 GLU A 34 -18.577 5.406 -9.060 1.00 0.00 O ATOM 553 OE2 GLU A 34 -19.675 5.191 -7.135 1.00 0.00 O ATOM 0 H GLU A 34 -18.461 1.848 -5.704 1.00 0.00 H new ATOM 0 HA GLU A 34 -18.384 0.239 -8.072 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -18.386 2.309 -9.257 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -19.599 2.300 -7.992 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -17.868 3.550 -6.535 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -16.947 3.776 -8.009 1.00 0.00 H new ATOM 560 N LEU A 35 -15.555 1.575 -7.066 1.00 0.00 N ATOM 561 CA LEU A 35 -14.111 1.476 -7.148 1.00 0.00 C ATOM 562 C LEU A 35 -13.655 0.021 -7.016 1.00 0.00 C ATOM 563 O LEU A 35 -12.912 -0.467 -7.863 1.00 0.00 O ATOM 564 CB LEU A 35 -13.499 2.374 -6.069 1.00 0.00 C ATOM 565 CG LEU A 35 -11.965 2.415 -6.118 1.00 0.00 C ATOM 566 CD1 LEU A 35 -11.468 2.867 -7.493 1.00 0.00 C ATOM 567 CD2 LEU A 35 -11.441 3.397 -5.072 1.00 0.00 C ATOM 0 H LEU A 35 -15.875 2.210 -6.335 1.00 0.00 H new ATOM 0 HA LEU A 35 -13.767 1.817 -8.124 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -13.887 3.386 -6.184 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -13.816 2.020 -5.088 1.00 0.00 H new ATOM 0 HG LEU A 35 -11.599 1.408 -5.917 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -10.378 2.886 -7.498 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -11.822 2.172 -8.254 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -11.850 3.865 -7.708 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -10.352 3.423 -5.110 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -11.835 4.392 -5.278 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -11.762 3.078 -4.080 1.00 0.00 H new ATOM 579 N ILE A 36 -14.098 -0.692 -5.977 1.00 0.00 N ATOM 580 CA ILE A 36 -13.729 -2.091 -5.800 1.00 0.00 C ATOM 581 C ILE A 36 -14.231 -2.920 -6.982 1.00 0.00 C ATOM 582 O ILE A 36 -13.442 -3.649 -7.568 1.00 0.00 O ATOM 583 CB ILE A 36 -14.186 -2.622 -4.426 1.00 0.00 C ATOM 584 CG1 ILE A 36 -13.156 -2.334 -3.317 1.00 0.00 C ATOM 585 CG2 ILE A 36 -14.385 -4.147 -4.428 1.00 0.00 C ATOM 586 CD1 ILE A 36 -12.460 -0.970 -3.335 1.00 0.00 C ATOM 0 H ILE A 36 -14.710 -0.321 -5.250 1.00 0.00 H new ATOM 0 HA ILE A 36 -12.643 -2.181 -5.795 1.00 0.00 H new ATOM 0 HB ILE A 36 -15.125 -2.104 -4.232 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -13.658 -2.443 -2.356 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -12.387 -3.105 -3.364 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -14.707 -4.473 -3.439 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -15.144 -4.414 -5.163 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -13.445 -4.636 -4.684 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -11.763 -0.906 -2.499 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -11.915 -0.852 -4.272 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -13.206 -0.180 -3.247 1.00 0.00 H new ATOM 598 N ASN A 37 -15.507 -2.827 -7.368 1.00 0.00 N ATOM 599 CA ASN A 37 -15.999 -3.563 -8.538 1.00 0.00 C ATOM 600 C ASN A 37 -15.112 -3.298 -9.763 1.00 0.00 C ATOM 601 O ASN A 37 -14.783 -4.215 -10.513 1.00 0.00 O ATOM 602 CB ASN A 37 -17.455 -3.201 -8.864 1.00 0.00 C ATOM 603 CG ASN A 37 -18.461 -3.892 -7.948 1.00 0.00 C ATOM 604 OD1 ASN A 37 -18.865 -5.025 -8.182 1.00 0.00 O ATOM 605 ND2 ASN A 37 -18.904 -3.223 -6.892 1.00 0.00 N ATOM 0 H ASN A 37 -16.210 -2.258 -6.896 1.00 0.00 H new ATOM 0 HA ASN A 37 -15.958 -4.624 -8.290 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -17.582 -2.121 -8.785 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -17.668 -3.472 -9.898 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -19.587 -3.651 -6.267 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -18.562 -2.280 -6.705 1.00 0.00 H new ATOM 612 N ASN A 38 -14.728 -2.035 -9.957 1.00 0.00 N ATOM 613 CA ASN A 38 -13.902 -1.578 -11.065 1.00 0.00 C ATOM 614 C ASN A 38 -12.480 -2.150 -11.007 1.00 0.00 C ATOM 615 O ASN A 38 -11.922 -2.527 -12.033 1.00 0.00 O ATOM 616 CB ASN A 38 -13.877 -0.045 -11.036 1.00 0.00 C ATOM 617 CG ASN A 38 -13.254 0.546 -12.287 1.00 0.00 C ATOM 618 OD1 ASN A 38 -12.041 0.700 -12.378 1.00 0.00 O ATOM 619 ND2 ASN A 38 -14.097 0.919 -13.246 1.00 0.00 N ATOM 0 H ASN A 38 -14.995 -1.281 -9.324 1.00 0.00 H new ATOM 0 HA ASN A 38 -14.332 -1.936 -12.001 1.00 0.00 H new ATOM 0 HB2 ASN A 38 -14.895 0.330 -10.928 1.00 0.00 H new ATOM 0 HB3 ASN A 38 -13.319 0.290 -10.162 1.00 0.00 H new ATOM 0 HD21 ASN A 38 -13.741 1.352 -14.098 1.00 0.00 H new ATOM 0 HD22 ASN A 38 -15.100 0.772 -13.129 1.00 0.00 H new ATOM 626 N GLU A 39 -11.873 -2.166 -9.817 1.00 0.00 N ATOM 627 CA GLU A 39 -10.469 -2.498 -9.606 1.00 0.00 C ATOM 628 C GLU A 39 -10.250 -4.007 -9.420 1.00 0.00 C ATOM 629 O GLU A 39 -9.276 -4.559 -9.920 1.00 0.00 O ATOM 630 CB GLU A 39 -9.983 -1.701 -8.385 1.00 0.00 C ATOM 631 CG GLU A 39 -8.495 -1.906 -8.058 1.00 0.00 C ATOM 632 CD GLU A 39 -8.023 -1.023 -6.900 1.00 0.00 C ATOM 633 OE1 GLU A 39 -8.897 -0.559 -6.134 1.00 0.00 O ATOM 634 OE2 GLU A 39 -6.793 -0.831 -6.796 1.00 0.00 O ATOM 0 H GLU A 39 -12.363 -1.941 -8.951 1.00 0.00 H new ATOM 0 HA GLU A 39 -9.891 -2.227 -10.490 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -10.163 -0.640 -8.561 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -10.578 -1.986 -7.517 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -8.322 -2.952 -7.807 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -7.898 -1.688 -8.944 1.00 0.00 H new ATOM 641 N LEU A 40 -11.128 -4.669 -8.667 1.00 0.00 N ATOM 642 CA LEU A 40 -10.982 -6.046 -8.199 1.00 0.00 C ATOM 643 C LEU A 40 -11.859 -7.016 -8.999 1.00 0.00 C ATOM 644 O LEU A 40 -12.221 -8.077 -8.492 1.00 0.00 O ATOM 645 CB LEU A 40 -11.318 -6.087 -6.692 1.00 0.00 C ATOM 646 CG LEU A 40 -10.111 -5.904 -5.763 1.00 0.00 C ATOM 647 CD1 LEU A 40 -9.243 -4.703 -6.124 1.00 0.00 C ATOM 648 CD2 LEU A 40 -10.624 -5.711 -4.338 1.00 0.00 C ATOM 0 H LEU A 40 -11.999 -4.241 -8.353 1.00 0.00 H new ATOM 0 HA LEU A 40 -9.954 -6.373 -8.353 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -12.048 -5.308 -6.475 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -11.793 -7.041 -6.465 1.00 0.00 H new ATOM 0 HG LEU A 40 -9.491 -6.794 -5.865 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -8.409 -4.634 -5.426 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -8.860 -4.823 -7.137 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -9.840 -3.793 -6.067 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -9.779 -5.579 -3.662 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -11.262 -4.828 -4.298 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -11.197 -6.588 -4.036 1.00 0.00 H new ATOM 660 N SER A 41 -12.173 -6.703 -10.258 1.00 0.00 N ATOM 661 CA SER A 41 -13.066 -7.500 -11.088 1.00 0.00 C ATOM 662 C SER A 41 -12.656 -8.980 -11.170 1.00 0.00 C ATOM 663 O SER A 41 -13.501 -9.867 -11.119 1.00 0.00 O ATOM 664 CB SER A 41 -13.123 -6.853 -12.475 1.00 0.00 C ATOM 665 OG SER A 41 -13.111 -5.442 -12.337 1.00 0.00 O ATOM 0 H SER A 41 -11.807 -5.877 -10.732 1.00 0.00 H new ATOM 0 HA SER A 41 -14.056 -7.509 -10.631 1.00 0.00 H new ATOM 0 HB2 SER A 41 -12.273 -7.178 -13.075 1.00 0.00 H new ATOM 0 HB3 SER A 41 -14.024 -7.171 -13.000 1.00 0.00 H new ATOM 0 HG SER A 41 -13.749 -5.176 -11.642 1.00 0.00 H new ATOM 671 N HIS A 42 -11.353 -9.247 -11.302 1.00 0.00 N ATOM 672 CA HIS A 42 -10.781 -10.594 -11.363 1.00 0.00 C ATOM 673 C HIS A 42 -10.519 -11.170 -9.955 1.00 0.00 C ATOM 674 O HIS A 42 -10.103 -12.320 -9.813 1.00 0.00 O ATOM 675 CB HIS A 42 -9.491 -10.514 -12.202 1.00 0.00 C ATOM 676 CG HIS A 42 -8.960 -11.818 -12.755 1.00 0.00 C ATOM 677 ND1 HIS A 42 -8.910 -13.032 -12.109 1.00 0.00 N ATOM 678 CD2 HIS A 42 -8.346 -11.980 -13.969 1.00 0.00 C ATOM 679 CE1 HIS A 42 -8.293 -13.906 -12.920 1.00 0.00 C ATOM 680 NE2 HIS A 42 -7.928 -13.311 -14.067 1.00 0.00 N ATOM 0 H HIS A 42 -10.649 -8.512 -11.371 1.00 0.00 H new ATOM 0 HA HIS A 42 -11.487 -11.279 -11.832 1.00 0.00 H new ATOM 0 HB2 HIS A 42 -9.670 -9.837 -13.038 1.00 0.00 H new ATOM 0 HB3 HIS A 42 -8.712 -10.063 -11.587 1.00 0.00 H new ATOM 0 HD1 HIS A 42 -9.277 -13.232 -11.179 1.00 0.00 H new ATOM 0 HD2 HIS A 42 -8.209 -11.215 -14.718 1.00 0.00 H new ATOM 0 HE1 HIS A 42 -8.115 -14.944 -12.683 1.00 0.00 H new ATOM 688 N PHE A 43 -10.693 -10.362 -8.908 1.00 0.00 N ATOM 689 CA PHE A 43 -10.279 -10.661 -7.547 1.00 0.00 C ATOM 690 C PHE A 43 -11.475 -11.068 -6.685 1.00 0.00 C ATOM 691 O PHE A 43 -11.470 -12.147 -6.096 1.00 0.00 O ATOM 692 CB PHE A 43 -9.548 -9.448 -6.963 1.00 0.00 C ATOM 693 CG PHE A 43 -8.247 -9.084 -7.665 1.00 0.00 C ATOM 694 CD1 PHE A 43 -8.244 -8.651 -9.005 1.00 0.00 C ATOM 695 CD2 PHE A 43 -7.030 -9.155 -6.966 1.00 0.00 C ATOM 696 CE1 PHE A 43 -7.033 -8.418 -9.675 1.00 0.00 C ATOM 697 CE2 PHE A 43 -5.836 -8.758 -7.592 1.00 0.00 C ATOM 698 CZ PHE A 43 -5.825 -8.471 -8.966 1.00 0.00 C ATOM 0 H PHE A 43 -11.143 -9.450 -8.993 1.00 0.00 H new ATOM 0 HA PHE A 43 -9.595 -11.510 -7.557 1.00 0.00 H new ATOM 0 HB2 PHE A 43 -10.216 -8.588 -6.999 1.00 0.00 H new ATOM 0 HB3 PHE A 43 -9.335 -9.642 -5.912 1.00 0.00 H new ATOM 0 HD1 PHE A 43 -9.180 -8.497 -9.521 1.00 0.00 H new ATOM 0 HD2 PHE A 43 -7.012 -9.515 -5.948 1.00 0.00 H new ATOM 0 HE1 PHE A 43 -7.032 -8.199 -10.733 1.00 0.00 H new ATOM 0 HE2 PHE A 43 -4.927 -8.674 -7.016 1.00 0.00 H new ATOM 0 HZ PHE A 43 -4.889 -8.292 -9.475 1.00 0.00 H new ATOM 708 N LEU A 44 -12.477 -10.190 -6.586 1.00 0.00 N ATOM 709 CA LEU A 44 -13.664 -10.377 -5.760 1.00 0.00 C ATOM 710 C LEU A 44 -14.890 -10.516 -6.659 1.00 0.00 C ATOM 711 O LEU A 44 -14.882 -10.078 -7.807 1.00 0.00 O ATOM 712 CB LEU A 44 -13.841 -9.176 -4.813 1.00 0.00 C ATOM 713 CG LEU A 44 -13.235 -9.396 -3.418 1.00 0.00 C ATOM 714 CD1 LEU A 44 -11.726 -9.660 -3.462 1.00 0.00 C ATOM 715 CD2 LEU A 44 -13.533 -8.180 -2.533 1.00 0.00 C ATOM 0 H LEU A 44 -12.481 -9.306 -7.094 1.00 0.00 H new ATOM 0 HA LEU A 44 -13.549 -11.281 -5.162 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -13.381 -8.297 -5.265 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -14.904 -8.961 -4.708 1.00 0.00 H new ATOM 0 HG LEU A 44 -13.698 -10.289 -2.998 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -11.353 -9.808 -2.449 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -11.530 -10.553 -4.055 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -11.220 -8.807 -3.914 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -13.103 -8.336 -1.544 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -13.096 -7.288 -2.982 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -14.612 -8.051 -2.444 1.00 0.00 H new ATOM 727 N GLU A 45 -15.960 -11.102 -6.112 1.00 0.00 N ATOM 728 CA GLU A 45 -17.261 -11.112 -6.762 1.00 0.00 C ATOM 729 C GLU A 45 -17.820 -9.683 -6.781 1.00 0.00 C ATOM 730 O GLU A 45 -17.314 -8.803 -6.085 1.00 0.00 O ATOM 731 CB GLU A 45 -18.204 -12.077 -6.024 1.00 0.00 C ATOM 732 CG GLU A 45 -17.591 -13.467 -5.785 1.00 0.00 C ATOM 733 CD GLU A 45 -17.091 -14.110 -7.074 1.00 0.00 C ATOM 734 OE1 GLU A 45 -17.945 -14.335 -7.959 1.00 0.00 O ATOM 735 OE2 GLU A 45 -15.869 -14.359 -7.152 1.00 0.00 O ATOM 0 H GLU A 45 -15.942 -11.579 -5.210 1.00 0.00 H new ATOM 0 HA GLU A 45 -17.168 -11.461 -7.790 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -18.480 -11.640 -5.064 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -19.123 -12.187 -6.600 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -16.764 -13.380 -5.081 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -18.336 -14.115 -5.324 1.00 0.00 H new ATOM 742 N GLU A 46 -18.883 -9.447 -7.553 1.00 0.00 N ATOM 743 CA GLU A 46 -19.478 -8.125 -7.667 1.00 0.00 C ATOM 744 C GLU A 46 -20.078 -7.685 -6.325 1.00 0.00 C ATOM 745 O GLU A 46 -20.857 -8.413 -5.706 1.00 0.00 O ATOM 746 CB GLU A 46 -20.463 -8.087 -8.840 1.00 0.00 C ATOM 747 CG GLU A 46 -21.794 -8.693 -8.413 1.00 0.00 C ATOM 748 CD GLU A 46 -22.724 -9.002 -9.579 1.00 0.00 C ATOM 749 OE1 GLU A 46 -22.740 -8.189 -10.529 1.00 0.00 O ATOM 750 OE2 GLU A 46 -23.413 -10.042 -9.492 1.00 0.00 O ATOM 0 H GLU A 46 -19.348 -10.164 -8.110 1.00 0.00 H new ATOM 0 HA GLU A 46 -18.708 -7.389 -7.898 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -20.610 -7.059 -9.171 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -20.056 -8.639 -9.687 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -21.604 -9.611 -7.857 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -22.295 -8.005 -7.732 1.00 0.00 H new ATOM 757 N ILE A 47 -19.724 -6.489 -5.862 1.00 0.00 N ATOM 758 CA ILE A 47 -20.128 -5.989 -4.544 1.00 0.00 C ATOM 759 C ILE A 47 -21.554 -5.428 -4.627 1.00 0.00 C ATOM 760 O ILE A 47 -21.794 -4.254 -4.353 1.00 0.00 O ATOM 761 CB ILE A 47 -19.136 -4.957 -3.954 1.00 0.00 C ATOM 762 CG1 ILE A 47 -17.662 -5.128 -4.348 1.00 0.00 C ATOM 763 CG2 ILE A 47 -19.270 -4.929 -2.422 1.00 0.00 C ATOM 764 CD1 ILE A 47 -16.995 -6.340 -3.706 1.00 0.00 C ATOM 0 H ILE A 47 -19.147 -5.834 -6.390 1.00 0.00 H new ATOM 0 HA ILE A 47 -20.112 -6.829 -3.849 1.00 0.00 H new ATOM 0 HB ILE A 47 -19.426 -4.007 -4.402 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -17.592 -5.217 -5.432 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -17.113 -4.230 -4.066 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -18.571 -4.202 -2.009 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -20.288 -4.648 -2.151 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -19.046 -5.917 -2.019 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -15.956 -6.397 -4.030 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -17.032 -6.244 -2.621 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -17.520 -7.247 -4.008 1.00 0.00 H new ATOM 776 N LYS A 48 -22.512 -6.261 -5.034 1.00 0.00 N ATOM 777 CA LYS A 48 -23.887 -5.825 -5.239 1.00 0.00 C ATOM 778 C LYS A 48 -24.538 -5.404 -3.917 1.00 0.00 C ATOM 779 O LYS A 48 -25.136 -4.333 -3.823 1.00 0.00 O ATOM 780 CB LYS A 48 -24.687 -6.898 -5.995 1.00 0.00 C ATOM 781 CG LYS A 48 -24.690 -8.291 -5.344 1.00 0.00 C ATOM 782 CD LYS A 48 -25.381 -9.298 -6.268 1.00 0.00 C ATOM 783 CE LYS A 48 -25.392 -10.684 -5.617 1.00 0.00 C ATOM 784 NZ LYS A 48 -26.031 -11.682 -6.492 1.00 0.00 N ATOM 0 H LYS A 48 -22.355 -7.250 -5.229 1.00 0.00 H new ATOM 0 HA LYS A 48 -23.885 -4.935 -5.869 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -25.718 -6.558 -6.093 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -24.283 -6.987 -7.004 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -23.667 -8.610 -5.144 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -25.205 -8.252 -4.384 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -26.402 -8.975 -6.473 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -24.862 -9.341 -7.226 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -24.370 -10.992 -5.396 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -25.923 -10.637 -4.666 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -26.023 -12.610 -6.023 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -27.013 -11.399 -6.682 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -25.508 -11.743 -7.389 1.00 0.00 H new ATOM 798 N GLU A 49 -24.429 -6.251 -2.892 1.00 0.00 N ATOM 799 CA GLU A 49 -25.107 -6.047 -1.624 1.00 0.00 C ATOM 800 C GLU A 49 -24.391 -4.954 -0.823 1.00 0.00 C ATOM 801 O GLU A 49 -23.253 -5.144 -0.390 1.00 0.00 O ATOM 802 CB GLU A 49 -25.173 -7.380 -0.870 1.00 0.00 C ATOM 803 CG GLU A 49 -26.049 -7.278 0.383 1.00 0.00 C ATOM 804 CD GLU A 49 -26.094 -8.603 1.135 1.00 0.00 C ATOM 805 OE1 GLU A 49 -25.107 -8.885 1.848 1.00 0.00 O ATOM 806 OE2 GLU A 49 -27.109 -9.314 0.980 1.00 0.00 O ATOM 0 H GLU A 49 -23.864 -7.100 -2.925 1.00 0.00 H new ATOM 0 HA GLU A 49 -26.130 -5.706 -1.786 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -25.569 -8.152 -1.529 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -24.167 -7.688 -0.587 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -25.661 -6.498 1.038 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -27.060 -6.983 0.100 1.00 0.00 H new ATOM 813 N GLN A 50 -25.066 -3.822 -0.593 1.00 0.00 N ATOM 814 CA GLN A 50 -24.496 -2.664 0.092 1.00 0.00 C ATOM 815 C GLN A 50 -23.925 -3.018 1.477 1.00 0.00 C ATOM 816 O GLN A 50 -22.964 -2.401 1.935 1.00 0.00 O ATOM 817 CB GLN A 50 -25.520 -1.522 0.146 1.00 0.00 C ATOM 818 CG GLN A 50 -24.819 -0.179 0.401 1.00 0.00 C ATOM 819 CD GLN A 50 -25.803 0.984 0.403 1.00 0.00 C ATOM 820 OE1 GLN A 50 -26.084 1.562 1.447 1.00 0.00 O ATOM 821 NE2 GLN A 50 -26.324 1.347 -0.764 1.00 0.00 N ATOM 0 H GLN A 50 -26.035 -3.686 -0.882 1.00 0.00 H new ATOM 0 HA GLN A 50 -23.641 -2.317 -0.489 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -26.073 -1.477 -0.792 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -26.247 -1.715 0.935 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -24.300 -0.217 1.359 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -24.062 -0.013 -0.366 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -26.069 0.845 -1.615 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -26.979 2.128 -0.809 1.00 0.00 H new ATOM 830 N GLU A 51 -24.475 -4.051 2.126 1.00 0.00 N ATOM 831 CA GLU A 51 -23.978 -4.530 3.408 1.00 0.00 C ATOM 832 C GLU A 51 -22.493 -4.892 3.298 1.00 0.00 C ATOM 833 O GLU A 51 -21.722 -4.627 4.217 1.00 0.00 O ATOM 834 CB GLU A 51 -24.758 -5.777 3.853 1.00 0.00 C ATOM 835 CG GLU A 51 -26.264 -5.544 4.026 1.00 0.00 C ATOM 836 CD GLU A 51 -26.983 -6.852 4.357 1.00 0.00 C ATOM 837 OE1 GLU A 51 -26.749 -7.368 5.471 1.00 0.00 O ATOM 838 OE2 GLU A 51 -27.741 -7.319 3.479 1.00 0.00 O ATOM 0 H GLU A 51 -25.276 -4.574 1.772 1.00 0.00 H new ATOM 0 HA GLU A 51 -24.111 -3.735 4.141 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -24.605 -6.569 3.120 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -24.345 -6.133 4.797 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -26.435 -4.819 4.822 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -26.678 -5.118 3.112 1.00 0.00 H new ATOM 845 N VAL A 52 -22.087 -5.495 2.176 1.00 0.00 N ATOM 846 CA VAL A 52 -20.726 -5.979 2.019 1.00 0.00 C ATOM 847 C VAL A 52 -19.776 -4.793 1.940 1.00 0.00 C ATOM 848 O VAL A 52 -18.818 -4.729 2.707 1.00 0.00 O ATOM 849 CB VAL A 52 -20.614 -6.865 0.771 1.00 0.00 C ATOM 850 CG1 VAL A 52 -19.182 -7.379 0.571 1.00 0.00 C ATOM 851 CG2 VAL A 52 -21.576 -8.054 0.877 1.00 0.00 C ATOM 0 H VAL A 52 -22.687 -5.656 1.367 1.00 0.00 H new ATOM 0 HA VAL A 52 -20.454 -6.588 2.881 1.00 0.00 H new ATOM 0 HB VAL A 52 -20.881 -6.254 -0.091 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -19.141 -8.003 -0.322 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -18.505 -6.533 0.454 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -18.882 -7.967 1.438 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -21.487 -8.675 -0.015 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -21.327 -8.646 1.758 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -22.599 -7.688 0.963 1.00 0.00 H new ATOM 861 N VAL A 53 -20.046 -3.842 1.041 1.00 0.00 N ATOM 862 CA VAL A 53 -19.196 -2.664 0.942 1.00 0.00 C ATOM 863 C VAL A 53 -19.124 -1.963 2.295 1.00 0.00 C ATOM 864 O VAL A 53 -18.034 -1.627 2.761 1.00 0.00 O ATOM 865 CB VAL A 53 -19.609 -1.720 -0.191 1.00 0.00 C ATOM 866 CG1 VAL A 53 -21.085 -1.345 -0.190 1.00 0.00 C ATOM 867 CG2 VAL A 53 -18.795 -0.436 -0.092 1.00 0.00 C ATOM 0 H VAL A 53 -20.829 -3.867 0.388 1.00 0.00 H new ATOM 0 HA VAL A 53 -18.193 -2.996 0.674 1.00 0.00 H new ATOM 0 HB VAL A 53 -19.419 -2.263 -1.117 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -21.291 -0.675 -1.025 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -21.689 -2.246 -0.291 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -21.333 -0.845 0.746 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -19.084 0.241 -0.896 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -18.984 0.041 0.870 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -17.734 -0.670 -0.179 1.00 0.00 H new ATOM 877 N ASP A 54 -20.279 -1.767 2.937 1.00 0.00 N ATOM 878 CA ASP A 54 -20.324 -1.108 4.229 1.00 0.00 C ATOM 879 C ASP A 54 -19.412 -1.846 5.214 1.00 0.00 C ATOM 880 O ASP A 54 -18.575 -1.227 5.867 1.00 0.00 O ATOM 881 CB ASP A 54 -21.762 -1.061 4.755 1.00 0.00 C ATOM 882 CG ASP A 54 -21.815 -0.361 6.109 1.00 0.00 C ATOM 883 OD1 ASP A 54 -21.904 0.886 6.099 1.00 0.00 O ATOM 884 OD2 ASP A 54 -21.751 -1.084 7.126 1.00 0.00 O ATOM 0 H ASP A 54 -21.189 -2.057 2.578 1.00 0.00 H new ATOM 0 HA ASP A 54 -19.970 -0.083 4.120 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -22.399 -0.536 4.043 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -22.155 -2.074 4.847 1.00 0.00 H new ATOM 889 N LYS A 55 -19.558 -3.170 5.319 1.00 0.00 N ATOM 890 CA LYS A 55 -18.781 -3.959 6.260 1.00 0.00 C ATOM 891 C LYS A 55 -17.286 -3.876 5.952 1.00 0.00 C ATOM 892 O LYS A 55 -16.492 -3.627 6.861 1.00 0.00 O ATOM 893 CB LYS A 55 -19.282 -5.409 6.286 1.00 0.00 C ATOM 894 CG LYS A 55 -18.601 -6.239 7.389 1.00 0.00 C ATOM 895 CD LYS A 55 -17.403 -7.054 6.883 1.00 0.00 C ATOM 896 CE LYS A 55 -16.810 -7.865 8.041 1.00 0.00 C ATOM 897 NZ LYS A 55 -15.781 -8.808 7.568 1.00 0.00 N ATOM 0 H LYS A 55 -20.213 -3.714 4.757 1.00 0.00 H new ATOM 0 HA LYS A 55 -18.921 -3.542 7.257 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -20.361 -5.416 6.442 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -19.097 -5.873 5.317 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -18.268 -5.571 8.183 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -19.333 -6.917 7.829 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -17.717 -7.722 6.081 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -16.647 -6.389 6.466 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -16.374 -7.188 8.775 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -17.604 -8.415 8.546 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -15.400 -9.341 8.376 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -16.204 -9.469 6.886 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -15.012 -8.280 7.108 1.00 0.00 H new ATOM 911 N VAL A 56 -16.875 -4.099 4.698 1.00 0.00 N ATOM 912 CA VAL A 56 -15.449 -4.097 4.391 1.00 0.00 C ATOM 913 C VAL A 56 -14.862 -2.702 4.615 1.00 0.00 C ATOM 914 O VAL A 56 -13.789 -2.589 5.200 1.00 0.00 O ATOM 915 CB VAL A 56 -15.104 -4.701 3.015 1.00 0.00 C ATOM 916 CG1 VAL A 56 -15.658 -6.127 2.870 1.00 0.00 C ATOM 917 CG2 VAL A 56 -15.563 -3.833 1.843 1.00 0.00 C ATOM 0 H VAL A 56 -17.491 -4.277 3.905 1.00 0.00 H new ATOM 0 HA VAL A 56 -14.964 -4.776 5.092 1.00 0.00 H new ATOM 0 HB VAL A 56 -14.015 -4.740 2.976 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -15.396 -6.521 1.888 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -15.229 -6.764 3.643 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -16.743 -6.108 2.976 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -15.290 -4.315 0.904 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -16.645 -3.708 1.885 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -15.082 -2.857 1.903 1.00 0.00 H new ATOM 927 N MET A 57 -15.561 -1.632 4.213 1.00 0.00 N ATOM 928 CA MET A 57 -15.061 -0.293 4.489 1.00 0.00 C ATOM 929 C MET A 57 -14.950 -0.095 6.005 1.00 0.00 C ATOM 930 O MET A 57 -13.889 0.263 6.510 1.00 0.00 O ATOM 931 CB MET A 57 -15.881 0.783 3.754 1.00 0.00 C ATOM 932 CG MET A 57 -16.915 1.529 4.609 1.00 0.00 C ATOM 933 SD MET A 57 -17.941 2.731 3.740 1.00 0.00 S ATOM 934 CE MET A 57 -16.671 3.670 2.880 1.00 0.00 C ATOM 0 H MET A 57 -16.448 -1.670 3.711 1.00 0.00 H new ATOM 0 HA MET A 57 -14.055 -0.178 4.086 1.00 0.00 H new ATOM 0 HB2 MET A 57 -15.192 1.513 3.331 1.00 0.00 H new ATOM 0 HB3 MET A 57 -16.399 0.312 2.919 1.00 0.00 H new ATOM 0 HG2 MET A 57 -17.569 0.793 5.076 1.00 0.00 H new ATOM 0 HG3 MET A 57 -16.389 2.044 5.413 1.00 0.00 H new ATOM 0 HE1 MET A 57 -17.065 4.649 2.606 1.00 0.00 H new ATOM 0 HE2 MET A 57 -15.807 3.796 3.533 1.00 0.00 H new ATOM 0 HE3 MET A 57 -16.370 3.135 1.979 1.00 0.00 H new ATOM 944 N GLU A 58 -16.025 -0.400 6.739 1.00 0.00 N ATOM 945 CA GLU A 58 -16.094 -0.246 8.187 1.00 0.00 C ATOM 946 C GLU A 58 -14.905 -0.948 8.840 1.00 0.00 C ATOM 947 O GLU A 58 -14.218 -0.372 9.679 1.00 0.00 O ATOM 948 CB GLU A 58 -17.432 -0.805 8.687 1.00 0.00 C ATOM 949 CG GLU A 58 -17.555 -0.747 10.212 1.00 0.00 C ATOM 950 CD GLU A 58 -18.947 -1.182 10.659 1.00 0.00 C ATOM 951 OE1 GLU A 58 -19.190 -2.408 10.639 1.00 0.00 O ATOM 952 OE2 GLU A 58 -19.740 -0.282 11.011 1.00 0.00 O ATOM 0 H GLU A 58 -16.885 -0.767 6.331 1.00 0.00 H new ATOM 0 HA GLU A 58 -16.041 0.808 8.459 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -18.249 -0.241 8.238 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -17.538 -1.838 8.356 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -16.804 -1.392 10.667 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -17.357 0.267 10.559 1.00 0.00 H new ATOM 959 N THR A 59 -14.621 -2.166 8.384 1.00 0.00 N ATOM 960 CA THR A 59 -13.521 -2.982 8.871 1.00 0.00 C ATOM 961 C THR A 59 -12.177 -2.243 8.770 1.00 0.00 C ATOM 962 O THR A 59 -11.317 -2.463 9.620 1.00 0.00 O ATOM 963 CB THR A 59 -13.525 -4.318 8.101 1.00 0.00 C ATOM 964 OG1 THR A 59 -14.704 -5.033 8.413 1.00 0.00 O ATOM 965 CG2 THR A 59 -12.314 -5.209 8.389 1.00 0.00 C ATOM 0 H THR A 59 -15.164 -2.619 7.649 1.00 0.00 H new ATOM 0 HA THR A 59 -13.657 -3.189 9.932 1.00 0.00 H new ATOM 0 HB THR A 59 -13.478 -4.060 7.043 1.00 0.00 H new ATOM 0 HG1 THR A 59 -15.461 -4.644 7.926 1.00 0.00 H new ATOM 0 HG21 THR A 59 -12.393 -6.128 7.809 1.00 0.00 H new ATOM 0 HG22 THR A 59 -11.401 -4.682 8.112 1.00 0.00 H new ATOM 0 HG23 THR A 59 -12.285 -5.452 9.451 1.00 0.00 H new ATOM 973 N LEU A 60 -11.975 -1.378 7.765 1.00 0.00 N ATOM 974 CA LEU A 60 -10.761 -0.572 7.638 1.00 0.00 C ATOM 975 C LEU A 60 -10.974 0.894 8.034 1.00 0.00 C ATOM 976 O LEU A 60 -10.052 1.689 7.880 1.00 0.00 O ATOM 977 CB LEU A 60 -10.186 -0.649 6.214 1.00 0.00 C ATOM 978 CG LEU A 60 -9.646 -2.012 5.744 1.00 0.00 C ATOM 979 CD1 LEU A 60 -8.770 -2.694 6.803 1.00 0.00 C ATOM 980 CD2 LEU A 60 -10.742 -2.960 5.255 1.00 0.00 C ATOM 0 H LEU A 60 -12.652 -1.221 7.019 1.00 0.00 H new ATOM 0 HA LEU A 60 -10.044 -1.000 8.338 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -10.965 -0.336 5.518 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -9.378 0.079 6.136 1.00 0.00 H new ATOM 0 HG LEU A 60 -9.015 -1.784 4.885 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -8.415 -3.651 6.420 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -7.916 -2.057 7.034 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -9.355 -2.859 7.708 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -10.294 -3.902 4.938 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -11.448 -3.148 6.064 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -11.266 -2.507 4.414 1.00 0.00 H new ATOM 992 N ASP A 61 -12.158 1.294 8.509 1.00 0.00 N ATOM 993 CA ASP A 61 -12.488 2.704 8.732 1.00 0.00 C ATOM 994 C ASP A 61 -11.794 3.263 9.983 1.00 0.00 C ATOM 995 O ASP A 61 -12.446 3.648 10.953 1.00 0.00 O ATOM 996 CB ASP A 61 -14.014 2.886 8.776 1.00 0.00 C ATOM 997 CG ASP A 61 -14.451 4.342 8.966 1.00 0.00 C ATOM 998 OD1 ASP A 61 -13.661 5.248 8.622 1.00 0.00 O ATOM 999 OD2 ASP A 61 -15.582 4.538 9.464 1.00 0.00 O ATOM 0 H ASP A 61 -12.912 0.651 8.749 1.00 0.00 H new ATOM 0 HA ASP A 61 -12.105 3.286 7.894 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -14.444 2.504 7.850 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -14.420 2.284 9.589 1.00 0.00 H new ATOM 1004 N SER A 62 -10.465 3.376 9.929 1.00 0.00 N ATOM 1005 CA SER A 62 -9.630 4.000 10.947 1.00 0.00 C ATOM 1006 C SER A 62 -10.120 5.413 11.262 1.00 0.00 C ATOM 1007 O SER A 62 -10.025 5.874 12.397 1.00 0.00 O ATOM 1008 CB SER A 62 -8.188 4.043 10.433 1.00 0.00 C ATOM 1009 OG SER A 62 -8.129 4.799 9.241 1.00 0.00 O ATOM 0 H SER A 62 -9.923 3.020 9.142 1.00 0.00 H new ATOM 0 HA SER A 62 -9.683 3.418 11.867 1.00 0.00 H new ATOM 0 HB2 SER A 62 -7.536 4.484 11.187 1.00 0.00 H new ATOM 0 HB3 SER A 62 -7.826 3.031 10.251 1.00 0.00 H new ATOM 0 HG SER A 62 -7.300 4.590 8.762 1.00 0.00 H new ATOM 1015 N ASP A 63 -10.660 6.088 10.246 1.00 0.00 N ATOM 1016 CA ASP A 63 -11.123 7.462 10.341 1.00 0.00 C ATOM 1017 C ASP A 63 -12.408 7.559 11.167 1.00 0.00 C ATOM 1018 O ASP A 63 -12.781 8.658 11.566 1.00 0.00 O ATOM 1019 CB ASP A 63 -11.401 7.996 8.928 1.00 0.00 C ATOM 1020 CG ASP A 63 -10.227 7.787 7.979 1.00 0.00 C ATOM 1021 OD1 ASP A 63 -9.309 8.634 8.021 1.00 0.00 O ATOM 1022 OD2 ASP A 63 -10.271 6.786 7.228 1.00 0.00 O ATOM 0 H ASP A 63 -10.788 5.682 9.319 1.00 0.00 H new ATOM 0 HA ASP A 63 -10.349 8.051 10.833 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -12.283 7.499 8.523 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -11.632 9.060 8.985 1.00 0.00 H new ATOM 1027 N GLY A 64 -13.097 6.433 11.402 1.00 0.00 N ATOM 1028 CA GLY A 64 -14.386 6.398 12.080 1.00 0.00 C ATOM 1029 C GLY A 64 -15.378 7.396 11.476 1.00 0.00 C ATOM 1030 O GLY A 64 -16.190 7.966 12.199 1.00 0.00 O ATOM 0 H GLY A 64 -12.763 5.511 11.119 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -14.801 5.392 12.019 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -14.246 6.621 13.138 1.00 0.00 H new ATOM 1034 N ASP A 65 -15.301 7.614 10.157 1.00 0.00 N ATOM 1035 CA ASP A 65 -16.059 8.643 9.452 1.00 0.00 C ATOM 1036 C ASP A 65 -16.994 8.001 8.426 1.00 0.00 C ATOM 1037 O ASP A 65 -17.560 8.684 7.576 1.00 0.00 O ATOM 1038 CB ASP A 65 -15.050 9.598 8.792 1.00 0.00 C ATOM 1039 CG ASP A 65 -15.681 10.864 8.216 1.00 0.00 C ATOM 1040 OD1 ASP A 65 -16.655 11.358 8.824 1.00 0.00 O ATOM 1041 OD2 ASP A 65 -15.143 11.339 7.192 1.00 0.00 O ATOM 0 H ASP A 65 -14.697 7.067 9.543 1.00 0.00 H new ATOM 0 HA ASP A 65 -16.689 9.206 10.141 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -14.298 9.881 9.528 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -14.531 9.067 7.994 1.00 0.00 H new ATOM 1046 N GLY A 66 -17.123 6.670 8.459 1.00 0.00 N ATOM 1047 CA GLY A 66 -17.797 5.911 7.425 1.00 0.00 C ATOM 1048 C GLY A 66 -16.911 5.874 6.187 1.00 0.00 C ATOM 1049 O GLY A 66 -16.319 4.844 5.865 1.00 0.00 O ATOM 0 H GLY A 66 -16.755 6.093 9.216 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -18.002 4.899 7.773 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -18.758 6.367 7.188 1.00 0.00 H new ATOM 1053 N GLU A 67 -16.803 7.020 5.514 1.00 0.00 N ATOM 1054 CA GLU A 67 -15.951 7.169 4.352 1.00 0.00 C ATOM 1055 C GLU A 67 -14.502 6.829 4.711 1.00 0.00 C ATOM 1056 O GLU A 67 -14.001 7.243 5.757 1.00 0.00 O ATOM 1057 CB GLU A 67 -16.122 8.543 3.690 1.00 0.00 C ATOM 1058 CG GLU A 67 -15.858 9.739 4.615 1.00 0.00 C ATOM 1059 CD GLU A 67 -16.084 11.061 3.888 1.00 0.00 C ATOM 1060 OE1 GLU A 67 -15.665 11.146 2.715 1.00 0.00 O ATOM 1061 OE2 GLU A 67 -16.700 11.958 4.502 1.00 0.00 O ATOM 0 H GLU A 67 -17.309 7.869 5.767 1.00 0.00 H new ATOM 0 HA GLU A 67 -16.261 6.452 3.591 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -15.448 8.606 2.836 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -17.137 8.620 3.301 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -16.514 9.682 5.483 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -14.834 9.696 4.986 1.00 0.00 H new ATOM 1068 N CYS A 68 -13.851 6.035 3.857 1.00 0.00 N ATOM 1069 CA CYS A 68 -12.550 5.432 4.142 1.00 0.00 C ATOM 1070 C CYS A 68 -11.441 6.172 3.409 1.00 0.00 C ATOM 1071 O CYS A 68 -11.589 6.491 2.229 1.00 0.00 O ATOM 1072 CB CYS A 68 -12.564 3.953 3.754 1.00 0.00 C ATOM 1073 SG CYS A 68 -13.340 3.030 5.098 1.00 0.00 S ATOM 0 H CYS A 68 -14.219 5.791 2.937 1.00 0.00 H new ATOM 0 HA CYS A 68 -12.354 5.511 5.211 1.00 0.00 H new ATOM 0 HB2 CYS A 68 -13.115 3.808 2.825 1.00 0.00 H new ATOM 0 HB3 CYS A 68 -11.549 3.595 3.582 1.00 0.00 H new ATOM 0 HG CYS A 68 -14.443 3.622 5.451 1.00 0.00 H new ATOM 1079 N ASP A 69 -10.346 6.456 4.122 1.00 0.00 N ATOM 1080 CA ASP A 69 -9.284 7.328 3.650 1.00 0.00 C ATOM 1081 C ASP A 69 -8.369 6.632 2.651 1.00 0.00 C ATOM 1082 O ASP A 69 -8.277 5.405 2.604 1.00 0.00 O ATOM 1083 CB ASP A 69 -8.503 7.882 4.853 1.00 0.00 C ATOM 1084 CG ASP A 69 -7.408 8.877 4.464 1.00 0.00 C ATOM 1085 OD1 ASP A 69 -7.740 10.078 4.371 1.00 0.00 O ATOM 1086 OD2 ASP A 69 -6.265 8.415 4.244 1.00 0.00 O ATOM 0 H ASP A 69 -10.177 6.078 5.054 1.00 0.00 H new ATOM 0 HA ASP A 69 -9.735 8.161 3.111 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -9.200 8.369 5.535 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -8.052 7.052 5.397 1.00 0.00 H new ATOM 1091 N PHE A 70 -7.628 7.455 1.909 1.00 0.00 N ATOM 1092 CA PHE A 70 -6.610 7.049 0.959 1.00 0.00 C ATOM 1093 C PHE A 70 -5.703 5.979 1.567 1.00 0.00 C ATOM 1094 O PHE A 70 -5.488 4.934 0.954 1.00 0.00 O ATOM 1095 CB PHE A 70 -5.825 8.308 0.554 1.00 0.00 C ATOM 1096 CG PHE A 70 -4.963 8.137 -0.678 1.00 0.00 C ATOM 1097 CD1 PHE A 70 -3.901 7.215 -0.699 1.00 0.00 C ATOM 1098 CD2 PHE A 70 -5.333 8.790 -1.865 1.00 0.00 C ATOM 1099 CE1 PHE A 70 -3.342 6.824 -1.927 1.00 0.00 C ATOM 1100 CE2 PHE A 70 -4.783 8.393 -3.091 1.00 0.00 C ATOM 1101 CZ PHE A 70 -3.823 7.369 -3.128 1.00 0.00 C ATOM 0 H PHE A 70 -7.731 8.468 1.962 1.00 0.00 H new ATOM 0 HA PHE A 70 -7.061 6.602 0.073 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -6.530 9.121 0.379 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -5.191 8.610 1.387 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -3.517 6.809 0.225 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -6.045 9.602 -1.833 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -2.539 6.102 -1.947 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -5.097 8.874 -4.006 1.00 0.00 H new ATOM 0 HZ PHE A 70 -3.457 7.003 -4.076 1.00 0.00 H new ATOM 1111 N GLN A 71 -5.197 6.202 2.784 1.00 0.00 N ATOM 1112 CA GLN A 71 -4.322 5.225 3.418 1.00 0.00 C ATOM 1113 C GLN A 71 -5.023 3.871 3.593 1.00 0.00 C ATOM 1114 O GLN A 71 -4.408 2.824 3.405 1.00 0.00 O ATOM 1115 CB GLN A 71 -3.756 5.767 4.738 1.00 0.00 C ATOM 1116 CG GLN A 71 -4.765 5.764 5.896 1.00 0.00 C ATOM 1117 CD GLN A 71 -4.162 6.331 7.173 1.00 0.00 C ATOM 1118 OE1 GLN A 71 -4.644 7.320 7.713 1.00 0.00 O ATOM 1119 NE2 GLN A 71 -3.097 5.707 7.667 1.00 0.00 N ATOM 0 H GLN A 71 -5.378 7.039 3.339 1.00 0.00 H new ATOM 0 HA GLN A 71 -3.474 5.051 2.755 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -2.889 5.170 5.023 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -3.403 6.786 4.579 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -5.641 6.350 5.616 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -5.107 4.745 6.077 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -2.721 4.886 7.192 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -2.656 6.049 8.521 1.00 0.00 H new ATOM 1128 N GLU A 72 -6.309 3.881 3.958 1.00 0.00 N ATOM 1129 CA GLU A 72 -7.076 2.664 4.179 1.00 0.00 C ATOM 1130 C GLU A 72 -7.333 1.966 2.848 1.00 0.00 C ATOM 1131 O GLU A 72 -7.218 0.745 2.755 1.00 0.00 O ATOM 1132 CB GLU A 72 -8.367 2.976 4.948 1.00 0.00 C ATOM 1133 CG GLU A 72 -8.084 3.589 6.331 1.00 0.00 C ATOM 1134 CD GLU A 72 -7.138 2.744 7.187 1.00 0.00 C ATOM 1135 OE1 GLU A 72 -7.241 1.499 7.128 1.00 0.00 O ATOM 1136 OE2 GLU A 72 -6.309 3.370 7.885 1.00 0.00 O ATOM 0 H GLU A 72 -6.843 4.737 4.107 1.00 0.00 H new ATOM 0 HA GLU A 72 -6.504 1.975 4.800 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -8.978 3.665 4.365 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -8.946 2.061 5.069 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -7.654 4.582 6.199 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -9.027 3.718 6.863 1.00 0.00 H new ATOM 1143 N PHE A 73 -7.630 2.741 1.802 1.00 0.00 N ATOM 1144 CA PHE A 73 -7.681 2.226 0.438 1.00 0.00 C ATOM 1145 C PHE A 73 -6.370 1.496 0.123 1.00 0.00 C ATOM 1146 O PHE A 73 -6.403 0.314 -0.213 1.00 0.00 O ATOM 1147 CB PHE A 73 -8.022 3.365 -0.538 1.00 0.00 C ATOM 1148 CG PHE A 73 -7.470 3.253 -1.955 1.00 0.00 C ATOM 1149 CD1 PHE A 73 -8.104 2.429 -2.907 1.00 0.00 C ATOM 1150 CD2 PHE A 73 -6.429 4.109 -2.366 1.00 0.00 C ATOM 1151 CE1 PHE A 73 -7.731 2.495 -4.264 1.00 0.00 C ATOM 1152 CE2 PHE A 73 -6.072 4.190 -3.724 1.00 0.00 C ATOM 1153 CZ PHE A 73 -6.740 3.402 -4.676 1.00 0.00 C ATOM 0 H PHE A 73 -7.840 3.736 1.879 1.00 0.00 H new ATOM 0 HA PHE A 73 -8.477 1.490 0.325 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -9.107 3.442 -0.603 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -7.662 4.299 -0.107 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -8.879 1.744 -2.595 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -5.903 4.705 -1.635 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -8.206 1.849 -4.987 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -5.283 4.859 -4.035 1.00 0.00 H new ATOM 0 HZ PHE A 73 -6.492 3.493 -5.723 1.00 0.00 H new ATOM 1163 N MET A 74 -5.219 2.152 0.300 1.00 0.00 N ATOM 1164 CA MET A 74 -3.932 1.507 0.061 1.00 0.00 C ATOM 1165 C MET A 74 -3.762 0.238 0.901 1.00 0.00 C ATOM 1166 O MET A 74 -3.354 -0.795 0.380 1.00 0.00 O ATOM 1167 CB MET A 74 -2.769 2.481 0.282 1.00 0.00 C ATOM 1168 CG MET A 74 -2.758 3.621 -0.742 1.00 0.00 C ATOM 1169 SD MET A 74 -2.691 3.171 -2.500 1.00 0.00 S ATOM 1170 CE MET A 74 -1.094 2.330 -2.585 1.00 0.00 C ATOM 0 H MET A 74 -5.156 3.123 0.606 1.00 0.00 H new ATOM 0 HA MET A 74 -3.917 1.203 -0.986 1.00 0.00 H new ATOM 0 HB2 MET A 74 -2.835 2.899 1.286 1.00 0.00 H new ATOM 0 HB3 MET A 74 -1.827 1.936 0.225 1.00 0.00 H new ATOM 0 HG2 MET A 74 -3.652 4.224 -0.583 1.00 0.00 H new ATOM 0 HG3 MET A 74 -1.901 4.259 -0.526 1.00 0.00 H new ATOM 0 HE1 MET A 74 -0.905 2.011 -3.610 1.00 0.00 H new ATOM 0 HE2 MET A 74 -0.306 3.012 -2.266 1.00 0.00 H new ATOM 0 HE3 MET A 74 -1.106 1.459 -1.930 1.00 0.00 H new ATOM 1180 N ALA A 75 -4.084 0.304 2.192 1.00 0.00 N ATOM 1181 CA ALA A 75 -3.977 -0.835 3.099 1.00 0.00 C ATOM 1182 C ALA A 75 -4.854 -2.007 2.639 1.00 0.00 C ATOM 1183 O ALA A 75 -4.450 -3.166 2.703 1.00 0.00 O ATOM 1184 CB ALA A 75 -4.346 -0.406 4.522 1.00 0.00 C ATOM 0 H ALA A 75 -4.428 1.154 2.639 1.00 0.00 H new ATOM 0 HA ALA A 75 -2.943 -1.181 3.089 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -4.264 -1.261 5.193 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -3.668 0.381 4.852 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -5.370 -0.032 4.535 1.00 0.00 H new ATOM 1190 N PHE A 76 -6.067 -1.712 2.170 1.00 0.00 N ATOM 1191 CA PHE A 76 -6.982 -2.725 1.672 1.00 0.00 C ATOM 1192 C PHE A 76 -6.387 -3.341 0.407 1.00 0.00 C ATOM 1193 O PHE A 76 -6.196 -4.555 0.320 1.00 0.00 O ATOM 1194 CB PHE A 76 -8.356 -2.084 1.436 1.00 0.00 C ATOM 1195 CG PHE A 76 -9.335 -2.927 0.650 1.00 0.00 C ATOM 1196 CD1 PHE A 76 -9.355 -2.805 -0.751 1.00 0.00 C ATOM 1197 CD2 PHE A 76 -10.268 -3.761 1.297 1.00 0.00 C ATOM 1198 CE1 PHE A 76 -10.290 -3.520 -1.508 1.00 0.00 C ATOM 1199 CE2 PHE A 76 -11.216 -4.468 0.533 1.00 0.00 C ATOM 1200 CZ PHE A 76 -11.233 -4.339 -0.868 1.00 0.00 C ATOM 0 H PHE A 76 -6.437 -0.763 2.127 1.00 0.00 H new ATOM 0 HA PHE A 76 -7.122 -3.529 2.394 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -8.800 -1.848 2.403 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -8.213 -1.139 0.912 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -8.646 -2.157 -1.245 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -10.256 -3.857 2.373 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -10.286 -3.441 -2.585 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -11.932 -5.111 1.024 1.00 0.00 H new ATOM 0 HZ PHE A 76 -11.971 -4.870 -1.451 1.00 0.00 H new ATOM 1210 N VAL A 77 -6.030 -2.484 -0.550 1.00 0.00 N ATOM 1211 CA VAL A 77 -5.400 -2.900 -1.789 1.00 0.00 C ATOM 1212 C VAL A 77 -4.149 -3.734 -1.484 1.00 0.00 C ATOM 1213 O VAL A 77 -3.874 -4.697 -2.195 1.00 0.00 O ATOM 1214 CB VAL A 77 -5.120 -1.669 -2.670 1.00 0.00 C ATOM 1215 CG1 VAL A 77 -4.327 -2.041 -3.929 1.00 0.00 C ATOM 1216 CG2 VAL A 77 -6.430 -1.028 -3.155 1.00 0.00 C ATOM 0 H VAL A 77 -6.174 -1.477 -0.480 1.00 0.00 H new ATOM 0 HA VAL A 77 -6.069 -3.544 -2.360 1.00 0.00 H new ATOM 0 HB VAL A 77 -4.550 -0.979 -2.048 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -4.149 -1.146 -4.525 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -3.372 -2.481 -3.641 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -4.895 -2.761 -4.517 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -6.203 -0.161 -3.775 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -6.996 -1.754 -3.739 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -7.022 -0.714 -2.295 1.00 0.00 H new ATOM 1226 N ALA A 78 -3.402 -3.408 -0.425 1.00 0.00 N ATOM 1227 CA ALA A 78 -2.199 -4.138 -0.062 1.00 0.00 C ATOM 1228 C ALA A 78 -2.498 -5.614 0.173 1.00 0.00 C ATOM 1229 O ALA A 78 -1.893 -6.472 -0.470 1.00 0.00 O ATOM 1230 CB ALA A 78 -1.558 -3.530 1.192 1.00 0.00 C ATOM 0 H ALA A 78 -3.620 -2.631 0.199 1.00 0.00 H new ATOM 0 HA ALA A 78 -1.500 -4.058 -0.894 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -0.659 -4.090 1.449 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -1.295 -2.490 0.999 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -2.264 -3.578 2.021 1.00 0.00 H new ATOM 1236 N MET A 79 -3.448 -5.923 1.061 1.00 0.00 N ATOM 1237 CA MET A 79 -3.750 -7.317 1.367 1.00 0.00 C ATOM 1238 C MET A 79 -4.338 -8.025 0.148 1.00 0.00 C ATOM 1239 O MET A 79 -3.987 -9.171 -0.127 1.00 0.00 O ATOM 1240 CB MET A 79 -4.620 -7.488 2.617 1.00 0.00 C ATOM 1241 CG MET A 79 -5.831 -6.565 2.735 1.00 0.00 C ATOM 1242 SD MET A 79 -6.868 -6.973 4.159 1.00 0.00 S ATOM 1243 CE MET A 79 -7.923 -5.518 4.179 1.00 0.00 C ATOM 0 H MET A 79 -4.009 -5.239 1.569 1.00 0.00 H new ATOM 0 HA MET A 79 -2.804 -7.800 1.611 1.00 0.00 H new ATOM 0 HB2 MET A 79 -4.972 -8.519 2.649 1.00 0.00 H new ATOM 0 HB3 MET A 79 -3.990 -7.339 3.494 1.00 0.00 H new ATOM 0 HG2 MET A 79 -5.491 -5.533 2.819 1.00 0.00 H new ATOM 0 HG3 MET A 79 -6.426 -6.631 1.824 1.00 0.00 H new ATOM 0 HE1 MET A 79 -8.712 -5.651 4.919 1.00 0.00 H new ATOM 0 HE2 MET A 79 -7.329 -4.641 4.435 1.00 0.00 H new ATOM 0 HE3 MET A 79 -8.369 -5.379 3.194 1.00 0.00 H new ATOM 1253 N ILE A 80 -5.195 -7.338 -0.605 1.00 0.00 N ATOM 1254 CA ILE A 80 -5.753 -7.888 -1.833 1.00 0.00 C ATOM 1255 C ILE A 80 -4.617 -8.286 -2.787 1.00 0.00 C ATOM 1256 O ILE A 80 -4.567 -9.413 -3.285 1.00 0.00 O ATOM 1257 CB ILE A 80 -6.697 -6.851 -2.462 1.00 0.00 C ATOM 1258 CG1 ILE A 80 -7.879 -6.515 -1.530 1.00 0.00 C ATOM 1259 CG2 ILE A 80 -7.163 -7.294 -3.854 1.00 0.00 C ATOM 1260 CD1 ILE A 80 -9.014 -7.537 -1.530 1.00 0.00 C ATOM 0 H ILE A 80 -5.517 -6.396 -0.383 1.00 0.00 H new ATOM 0 HA ILE A 80 -6.330 -8.788 -1.620 1.00 0.00 H new ATOM 0 HB ILE A 80 -6.132 -5.928 -2.593 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -7.502 -6.414 -0.512 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -8.284 -5.545 -1.818 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -7.829 -6.539 -4.272 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -6.298 -7.415 -4.506 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -7.694 -8.243 -3.775 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -9.797 -7.212 -0.844 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -9.426 -7.624 -2.536 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -8.631 -8.506 -1.210 1.00 0.00 H new ATOM 1272 N THR A 81 -3.690 -7.360 -3.031 1.00 0.00 N ATOM 1273 CA THR A 81 -2.565 -7.615 -3.914 1.00 0.00 C ATOM 1274 C THR A 81 -1.686 -8.728 -3.334 1.00 0.00 C ATOM 1275 O THR A 81 -1.208 -9.570 -4.086 1.00 0.00 O ATOM 1276 CB THR A 81 -1.787 -6.324 -4.214 1.00 0.00 C ATOM 1277 OG1 THR A 81 -2.668 -5.284 -4.581 1.00 0.00 O ATOM 1278 CG2 THR A 81 -0.849 -6.535 -5.403 1.00 0.00 C ATOM 0 H THR A 81 -3.701 -6.424 -2.625 1.00 0.00 H new ATOM 0 HA THR A 81 -2.937 -7.967 -4.876 1.00 0.00 H new ATOM 0 HB THR A 81 -1.233 -6.066 -3.311 1.00 0.00 H new ATOM 0 HG1 THR A 81 -3.049 -4.878 -3.774 1.00 0.00 H new ATOM 0 HG21 THR A 81 -0.304 -5.613 -5.605 1.00 0.00 H new ATOM 0 HG22 THR A 81 -0.142 -7.331 -5.172 1.00 0.00 H new ATOM 0 HG23 THR A 81 -1.432 -6.812 -6.282 1.00 0.00 H new ATOM 1286 N THR A 82 -1.503 -8.778 -2.009 1.00 0.00 N ATOM 1287 CA THR A 82 -0.779 -9.878 -1.372 1.00 0.00 C ATOM 1288 C THR A 82 -1.455 -11.218 -1.695 1.00 0.00 C ATOM 1289 O THR A 82 -0.799 -12.147 -2.155 1.00 0.00 O ATOM 1290 CB THR A 82 -0.644 -9.663 0.145 1.00 0.00 C ATOM 1291 OG1 THR A 82 -0.127 -8.380 0.429 1.00 0.00 O ATOM 1292 CG2 THR A 82 0.326 -10.682 0.749 1.00 0.00 C ATOM 0 H THR A 82 -1.847 -8.070 -1.361 1.00 0.00 H new ATOM 0 HA THR A 82 0.232 -9.901 -1.778 1.00 0.00 H new ATOM 0 HB THR A 82 -1.641 -9.776 0.572 1.00 0.00 H new ATOM 0 HG1 THR A 82 -0.811 -7.703 0.242 1.00 0.00 H new ATOM 0 HG21 THR A 82 0.408 -10.514 1.823 1.00 0.00 H new ATOM 0 HG22 THR A 82 -0.046 -11.690 0.567 1.00 0.00 H new ATOM 0 HG23 THR A 82 1.307 -10.568 0.288 1.00 0.00 H new ATOM 1300 N ALA A 83 -2.771 -11.327 -1.488 1.00 0.00 N ATOM 1301 CA ALA A 83 -3.501 -12.555 -1.783 1.00 0.00 C ATOM 1302 C ALA A 83 -3.302 -12.959 -3.247 1.00 0.00 C ATOM 1303 O ALA A 83 -2.975 -14.105 -3.563 1.00 0.00 O ATOM 1304 CB ALA A 83 -4.990 -12.327 -1.495 1.00 0.00 C ATOM 0 H ALA A 83 -3.350 -10.575 -1.116 1.00 0.00 H new ATOM 0 HA ALA A 83 -3.123 -13.362 -1.155 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -5.546 -13.239 -1.712 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -5.121 -12.063 -0.446 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -5.362 -11.517 -2.122 1.00 0.00 H new ATOM 1310 N CYS A 84 -3.450 -11.989 -4.149 1.00 0.00 N ATOM 1311 CA CYS A 84 -3.293 -12.235 -5.576 1.00 0.00 C ATOM 1312 C CYS A 84 -1.850 -12.603 -5.929 1.00 0.00 C ATOM 1313 O CYS A 84 -1.626 -13.404 -6.832 1.00 0.00 O ATOM 1314 CB CYS A 84 -3.753 -11.014 -6.359 1.00 0.00 C ATOM 1315 SG CYS A 84 -3.719 -11.380 -8.134 1.00 0.00 S ATOM 0 H CYS A 84 -3.679 -11.024 -3.912 1.00 0.00 H new ATOM 0 HA CYS A 84 -3.915 -13.088 -5.850 1.00 0.00 H new ATOM 0 HB2 CYS A 84 -4.761 -10.733 -6.055 1.00 0.00 H new ATOM 0 HB3 CYS A 84 -3.106 -10.165 -6.140 1.00 0.00 H new ATOM 0 HG CYS A 84 -4.432 -10.500 -8.772 1.00 0.00 H new ATOM 1321 N HIS A 85 -0.871 -12.017 -5.241 1.00 0.00 N ATOM 1322 CA HIS A 85 0.540 -12.329 -5.402 1.00 0.00 C ATOM 1323 C HIS A 85 0.790 -13.780 -5.003 1.00 0.00 C ATOM 1324 O HIS A 85 1.340 -14.544 -5.796 1.00 0.00 O ATOM 1325 CB HIS A 85 1.368 -11.340 -4.570 1.00 0.00 C ATOM 1326 CG HIS A 85 2.835 -11.650 -4.451 1.00 0.00 C ATOM 1327 ND1 HIS A 85 3.671 -12.119 -5.438 1.00 0.00 N ATOM 1328 CD2 HIS A 85 3.591 -11.444 -3.333 1.00 0.00 C ATOM 1329 CE1 HIS A 85 4.909 -12.178 -4.921 1.00 0.00 C ATOM 1330 NE2 HIS A 85 4.912 -11.773 -3.641 1.00 0.00 N ATOM 0 H HIS A 85 -1.046 -11.296 -4.541 1.00 0.00 H new ATOM 0 HA HIS A 85 0.844 -12.224 -6.443 1.00 0.00 H new ATOM 0 HB2 HIS A 85 1.260 -10.348 -5.008 1.00 0.00 H new ATOM 0 HB3 HIS A 85 0.943 -11.294 -3.567 1.00 0.00 H new ATOM 0 HD1 HIS A 85 3.400 -12.375 -6.388 1.00 0.00 H new ATOM 0 HD2 HIS A 85 3.231 -11.089 -2.379 1.00 0.00 H new ATOM 0 HE1 HIS A 85 5.784 -12.507 -5.462 1.00 0.00 H new ATOM 1338 N GLU A 86 0.364 -14.162 -3.794 1.00 0.00 N ATOM 1339 CA GLU A 86 0.490 -15.529 -3.309 1.00 0.00 C ATOM 1340 C GLU A 86 -0.084 -16.507 -4.335 1.00 0.00 C ATOM 1341 O GLU A 86 0.579 -17.483 -4.692 1.00 0.00 O ATOM 1342 CB GLU A 86 -0.214 -15.685 -1.952 1.00 0.00 C ATOM 1343 CG GLU A 86 0.533 -14.951 -0.829 1.00 0.00 C ATOM 1344 CD GLU A 86 -0.147 -15.145 0.522 1.00 0.00 C ATOM 1345 OE1 GLU A 86 -0.321 -16.323 0.906 1.00 0.00 O ATOM 1346 OE2 GLU A 86 -0.494 -14.119 1.146 1.00 0.00 O ATOM 0 H GLU A 86 -0.077 -13.527 -3.129 1.00 0.00 H new ATOM 0 HA GLU A 86 1.547 -15.756 -3.170 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -1.231 -15.298 -2.024 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -0.292 -16.743 -1.704 1.00 0.00 H new ATOM 0 HG2 GLU A 86 1.559 -15.316 -0.776 1.00 0.00 H new ATOM 0 HG3 GLU A 86 0.584 -13.887 -1.061 1.00 0.00 H new ATOM 1353 N PHE A 87 -1.290 -16.211 -4.832 1.00 0.00 N ATOM 1354 CA PHE A 87 -1.922 -16.970 -5.906 1.00 0.00 C ATOM 1355 C PHE A 87 -1.007 -17.055 -7.127 1.00 0.00 C ATOM 1356 O PHE A 87 -0.560 -18.133 -7.506 1.00 0.00 O ATOM 1357 CB PHE A 87 -3.283 -16.339 -6.261 1.00 0.00 C ATOM 1358 CG PHE A 87 -3.745 -16.484 -7.703 1.00 0.00 C ATOM 1359 CD1 PHE A 87 -3.963 -17.759 -8.254 1.00 0.00 C ATOM 1360 CD2 PHE A 87 -3.902 -15.345 -8.517 1.00 0.00 C ATOM 1361 CE1 PHE A 87 -4.370 -17.895 -9.592 1.00 0.00 C ATOM 1362 CE2 PHE A 87 -4.326 -15.477 -9.850 1.00 0.00 C ATOM 1363 CZ PHE A 87 -4.561 -16.753 -10.389 1.00 0.00 C ATOM 0 H PHE A 87 -1.855 -15.432 -4.495 1.00 0.00 H new ATOM 0 HA PHE A 87 -2.096 -17.990 -5.564 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -4.042 -16.779 -5.614 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -3.238 -15.276 -6.023 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -3.817 -18.639 -7.645 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -3.695 -14.365 -8.114 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -4.536 -18.878 -10.008 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -4.471 -14.598 -10.460 1.00 0.00 H new ATOM 0 HZ PHE A 87 -4.888 -16.856 -11.413 1.00 0.00 H new ATOM 1373 N PHE A 88 -0.731 -15.909 -7.747 1.00 0.00 N ATOM 1374 CA PHE A 88 -0.072 -15.846 -9.041 1.00 0.00 C ATOM 1375 C PHE A 88 1.312 -16.494 -9.022 1.00 0.00 C ATOM 1376 O PHE A 88 1.690 -17.174 -9.972 1.00 0.00 O ATOM 1377 CB PHE A 88 -0.022 -14.379 -9.476 1.00 0.00 C ATOM 1378 CG PHE A 88 0.489 -14.157 -10.884 1.00 0.00 C ATOM 1379 CD1 PHE A 88 -0.303 -14.534 -11.985 1.00 0.00 C ATOM 1380 CD2 PHE A 88 1.766 -13.606 -11.100 1.00 0.00 C ATOM 1381 CE1 PHE A 88 0.183 -14.366 -13.294 1.00 0.00 C ATOM 1382 CE2 PHE A 88 2.258 -13.451 -12.408 1.00 0.00 C ATOM 1383 CZ PHE A 88 1.464 -13.828 -13.506 1.00 0.00 C ATOM 0 H PHE A 88 -0.962 -14.994 -7.359 1.00 0.00 H new ATOM 0 HA PHE A 88 -0.642 -16.423 -9.769 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -1.023 -13.955 -9.396 1.00 0.00 H new ATOM 0 HB3 PHE A 88 0.613 -13.829 -8.782 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -1.285 -14.953 -11.824 1.00 0.00 H new ATOM 0 HD2 PHE A 88 2.370 -13.301 -10.258 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -0.429 -14.651 -14.137 1.00 0.00 H new ATOM 0 HE2 PHE A 88 3.245 -13.043 -12.569 1.00 0.00 H new ATOM 0 HZ PHE A 88 1.838 -13.704 -14.511 1.00 0.00 H new ATOM 1442 N SER B 1 -9.255 -2.577 -15.766 1.00 0.00 N ATOM 1443 CA SER B 1 -9.146 -1.233 -15.168 1.00 0.00 C ATOM 1444 C SER B 1 -7.687 -0.808 -15.029 1.00 0.00 C ATOM 1445 O SER B 1 -6.809 -1.639 -14.798 1.00 0.00 O ATOM 1446 CB SER B 1 -9.851 -1.167 -13.806 1.00 0.00 C ATOM 1447 OG SER B 1 -9.470 -0.013 -13.070 1.00 0.00 O ATOM 0 H1 SER B 1 -9.660 -2.500 -16.721 1.00 0.00 H new ATOM 0 H2 SER B 1 -8.311 -3.009 -15.824 1.00 0.00 H new ATOM 0 H3 SER B 1 -9.871 -3.171 -15.175 1.00 0.00 H new ATOM 0 HA SER B 1 -9.645 -0.538 -15.843 1.00 0.00 H new ATOM 0 HB2 SER B 1 -10.931 -1.163 -13.955 1.00 0.00 H new ATOM 0 HB3 SER B 1 -9.613 -2.061 -13.230 1.00 0.00 H new ATOM 0 HG SER B 1 -10.270 0.426 -12.712 1.00 0.00 H new ATOM 1455 N GLU B 2 -7.459 0.505 -15.101 1.00 0.00 N ATOM 1456 CA GLU B 2 -6.188 1.135 -14.787 1.00 0.00 C ATOM 1457 C GLU B 2 -5.693 0.649 -13.421 1.00 0.00 C ATOM 1458 O GLU B 2 -4.505 0.397 -13.231 1.00 0.00 O ATOM 1459 CB GLU B 2 -6.330 2.669 -14.767 1.00 0.00 C ATOM 1460 CG GLU B 2 -7.116 3.262 -15.947 1.00 0.00 C ATOM 1461 CD GLU B 2 -8.606 3.400 -15.632 1.00 0.00 C ATOM 1462 OE1 GLU B 2 -9.330 2.408 -15.870 1.00 0.00 O ATOM 1463 OE2 GLU B 2 -8.984 4.481 -15.132 1.00 0.00 O ATOM 0 H GLU B 2 -8.176 1.171 -15.387 1.00 0.00 H new ATOM 0 HA GLU B 2 -5.467 0.861 -15.558 1.00 0.00 H new ATOM 0 HB2 GLU B 2 -6.821 2.962 -13.839 1.00 0.00 H new ATOM 0 HB3 GLU B 2 -5.334 3.111 -14.754 1.00 0.00 H new ATOM 0 HG2 GLU B 2 -6.707 4.240 -16.200 1.00 0.00 H new ATOM 0 HG3 GLU B 2 -6.988 2.627 -16.823 1.00 0.00 H new ATOM 1470 N LEU B 3 -6.614 0.521 -12.462 1.00 0.00 N ATOM 1471 CA LEU B 3 -6.257 0.129 -11.110 1.00 0.00 C ATOM 1472 C LEU B 3 -5.995 -1.369 -11.027 1.00 0.00 C ATOM 1473 O LEU B 3 -5.070 -1.792 -10.342 1.00 0.00 O ATOM 1474 CB LEU B 3 -7.324 0.570 -10.117 1.00 0.00 C ATOM 1475 CG LEU B 3 -7.571 2.081 -10.092 1.00 0.00 C ATOM 1476 CD1 LEU B 3 -8.210 2.387 -8.736 1.00 0.00 C ATOM 1477 CD2 LEU B 3 -6.285 2.892 -10.278 1.00 0.00 C ATOM 0 H LEU B 3 -7.611 0.685 -12.604 1.00 0.00 H new ATOM 0 HA LEU B 3 -5.330 0.636 -10.842 1.00 0.00 H new ATOM 0 HB2 LEU B 3 -8.259 0.064 -10.357 1.00 0.00 H new ATOM 0 HB3 LEU B 3 -7.032 0.244 -9.119 1.00 0.00 H new ATOM 0 HG LEU B 3 -8.218 2.366 -10.922 1.00 0.00 H new ATOM 0 HD11 LEU B 3 -8.410 3.456 -8.661 1.00 0.00 H new ATOM 0 HD12 LEU B 3 -9.145 1.836 -8.642 1.00 0.00 H new ATOM 0 HD13 LEU B 3 -7.531 2.088 -7.938 1.00 0.00 H new ATOM 0 HD21 LEU B 3 -6.519 3.956 -10.252 1.00 0.00 H new ATOM 0 HD22 LEU B 3 -5.586 2.654 -9.476 1.00 0.00 H new ATOM 0 HD23 LEU B 3 -5.834 2.643 -11.238 1.00 0.00 H new ATOM 1489 N GLU B 4 -6.774 -2.183 -11.739 1.00 0.00 N ATOM 1490 CA GLU B 4 -6.487 -3.610 -11.808 1.00 0.00 C ATOM 1491 C GLU B 4 -5.094 -3.823 -12.421 1.00 0.00 C ATOM 1492 O GLU B 4 -4.307 -4.641 -11.945 1.00 0.00 O ATOM 1493 CB GLU B 4 -7.596 -4.328 -12.590 1.00 0.00 C ATOM 1494 CG GLU B 4 -7.622 -5.828 -12.270 1.00 0.00 C ATOM 1495 CD GLU B 4 -8.904 -6.488 -12.773 1.00 0.00 C ATOM 1496 OE1 GLU B 4 -9.233 -6.255 -13.956 1.00 0.00 O ATOM 1497 OE2 GLU B 4 -9.528 -7.220 -11.973 1.00 0.00 O ATOM 0 H GLU B 4 -7.594 -1.883 -12.267 1.00 0.00 H new ATOM 0 HA GLU B 4 -6.472 -4.043 -10.808 1.00 0.00 H new ATOM 0 HB2 GLU B 4 -8.561 -3.885 -12.346 1.00 0.00 H new ATOM 0 HB3 GLU B 4 -7.441 -4.185 -13.659 1.00 0.00 H new ATOM 0 HG2 GLU B 4 -6.759 -6.313 -12.726 1.00 0.00 H new ATOM 0 HG3 GLU B 4 -7.536 -5.972 -11.193 1.00 0.00 H new ATOM 1504 N LYS B 5 -4.783 -3.039 -13.457 1.00 0.00 N ATOM 1505 CA LYS B 5 -3.496 -3.049 -14.132 1.00 0.00 C ATOM 1506 C LYS B 5 -2.402 -2.657 -13.139 1.00 0.00 C ATOM 1507 O LYS B 5 -1.407 -3.363 -13.006 1.00 0.00 O ATOM 1508 CB LYS B 5 -3.532 -2.143 -15.373 1.00 0.00 C ATOM 1509 CG LYS B 5 -2.187 -2.045 -16.109 1.00 0.00 C ATOM 1510 CD LYS B 5 -1.637 -3.415 -16.529 1.00 0.00 C ATOM 1511 CE LYS B 5 -0.386 -3.247 -17.397 1.00 0.00 C ATOM 1512 NZ LYS B 5 0.186 -4.551 -17.772 1.00 0.00 N ATOM 0 H LYS B 5 -5.439 -2.366 -13.854 1.00 0.00 H new ATOM 0 HA LYS B 5 -3.269 -4.052 -14.493 1.00 0.00 H new ATOM 0 HB2 LYS B 5 -4.287 -2.519 -16.064 1.00 0.00 H new ATOM 0 HB3 LYS B 5 -3.845 -1.143 -15.072 1.00 0.00 H new ATOM 0 HG2 LYS B 5 -2.307 -1.420 -16.994 1.00 0.00 H new ATOM 0 HG3 LYS B 5 -1.461 -1.549 -15.465 1.00 0.00 H new ATOM 0 HD2 LYS B 5 -1.396 -4.004 -15.644 1.00 0.00 H new ATOM 0 HD3 LYS B 5 -2.399 -3.966 -17.081 1.00 0.00 H new ATOM 0 HE2 LYS B 5 -0.638 -2.686 -18.297 1.00 0.00 H new ATOM 0 HE3 LYS B 5 0.359 -2.663 -16.856 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 1.032 -4.403 -18.359 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 0.448 -5.075 -16.913 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 -0.517 -5.097 -18.309 1.00 0.00 H new ATOM 1526 N ALA B 6 -2.593 -1.544 -12.428 1.00 0.00 N ATOM 1527 CA ALA B 6 -1.694 -1.094 -11.374 1.00 0.00 C ATOM 1528 C ALA B 6 -1.411 -2.230 -10.382 1.00 0.00 C ATOM 1529 O ALA B 6 -0.259 -2.591 -10.133 1.00 0.00 O ATOM 1530 CB ALA B 6 -2.341 0.109 -10.678 1.00 0.00 C ATOM 0 H ALA B 6 -3.390 -0.924 -12.574 1.00 0.00 H new ATOM 0 HA ALA B 6 -0.734 -0.797 -11.797 1.00 0.00 H new ATOM 0 HB1 ALA B 6 -1.686 0.465 -9.883 1.00 0.00 H new ATOM 0 HB2 ALA B 6 -2.499 0.907 -11.403 1.00 0.00 H new ATOM 0 HB3 ALA B 6 -3.299 -0.189 -10.252 1.00 0.00 H new ATOM 1536 N VAL B 7 -2.482 -2.813 -9.844 1.00 0.00 N ATOM 1537 CA VAL B 7 -2.433 -3.914 -8.899 1.00 0.00 C ATOM 1538 C VAL B 7 -1.574 -5.059 -9.453 1.00 0.00 C ATOM 1539 O VAL B 7 -0.605 -5.462 -8.809 1.00 0.00 O ATOM 1540 CB VAL B 7 -3.880 -4.315 -8.554 1.00 0.00 C ATOM 1541 CG1 VAL B 7 -4.011 -5.732 -7.998 1.00 0.00 C ATOM 1542 CG2 VAL B 7 -4.464 -3.328 -7.535 1.00 0.00 C ATOM 0 H VAL B 7 -3.433 -2.519 -10.064 1.00 0.00 H new ATOM 0 HA VAL B 7 -1.945 -3.621 -7.969 1.00 0.00 H new ATOM 0 HB VAL B 7 -4.432 -4.287 -9.493 1.00 0.00 H new ATOM 0 HG11 VAL B 7 -5.058 -5.942 -7.779 1.00 0.00 H new ATOM 0 HG12 VAL B 7 -3.644 -6.447 -8.734 1.00 0.00 H new ATOM 0 HG13 VAL B 7 -3.424 -5.820 -7.083 1.00 0.00 H new ATOM 0 HG21 VAL B 7 -5.487 -3.616 -7.295 1.00 0.00 H new ATOM 0 HG22 VAL B 7 -3.860 -3.342 -6.628 1.00 0.00 H new ATOM 0 HG23 VAL B 7 -4.460 -2.323 -7.958 1.00 0.00 H new ATOM 1552 N VAL B 8 -1.878 -5.579 -10.647 1.00 0.00 N ATOM 1553 CA VAL B 8 -1.071 -6.672 -11.181 1.00 0.00 C ATOM 1554 C VAL B 8 0.355 -6.216 -11.509 1.00 0.00 C ATOM 1555 O VAL B 8 1.282 -7.006 -11.366 1.00 0.00 O ATOM 1556 CB VAL B 8 -1.749 -7.427 -12.336 1.00 0.00 C ATOM 1557 CG1 VAL B 8 -3.100 -8.007 -11.894 1.00 0.00 C ATOM 1558 CG2 VAL B 8 -1.923 -6.577 -13.596 1.00 0.00 C ATOM 0 H VAL B 8 -2.649 -5.272 -11.241 1.00 0.00 H new ATOM 0 HA VAL B 8 -0.987 -7.410 -10.384 1.00 0.00 H new ATOM 0 HB VAL B 8 -1.075 -8.242 -12.599 1.00 0.00 H new ATOM 0 HG11 VAL B 8 -3.559 -8.536 -12.729 1.00 0.00 H new ATOM 0 HG12 VAL B 8 -2.945 -8.699 -11.066 1.00 0.00 H new ATOM 0 HG13 VAL B 8 -3.756 -7.198 -11.572 1.00 0.00 H new ATOM 0 HG21 VAL B 8 -2.407 -7.171 -14.371 1.00 0.00 H new ATOM 0 HG22 VAL B 8 -2.539 -5.708 -13.366 1.00 0.00 H new ATOM 0 HG23 VAL B 8 -0.946 -6.246 -13.949 1.00 0.00 H new ATOM 1568 N ALA B 9 0.568 -4.961 -11.919 1.00 0.00 N ATOM 1569 CA ALA B 9 1.908 -4.444 -12.185 1.00 0.00 C ATOM 1570 C ALA B 9 2.785 -4.538 -10.938 1.00 0.00 C ATOM 1571 O ALA B 9 3.944 -4.943 -11.027 1.00 0.00 O ATOM 1572 CB ALA B 9 1.871 -3.005 -12.700 1.00 0.00 C ATOM 0 H ALA B 9 -0.178 -4.283 -12.074 1.00 0.00 H new ATOM 0 HA ALA B 9 2.343 -5.066 -12.968 1.00 0.00 H new ATOM 0 HB1 ALA B 9 2.888 -2.659 -12.885 1.00 0.00 H new ATOM 0 HB2 ALA B 9 1.299 -2.965 -13.627 1.00 0.00 H new ATOM 0 HB3 ALA B 9 1.399 -2.364 -11.955 1.00 0.00 H new ATOM 1578 N LEU B 10 2.234 -4.196 -9.767 1.00 0.00 N ATOM 1579 CA LEU B 10 2.963 -4.350 -8.511 1.00 0.00 C ATOM 1580 C LEU B 10 3.445 -5.796 -8.348 1.00 0.00 C ATOM 1581 O LEU B 10 4.623 -6.021 -8.074 1.00 0.00 O ATOM 1582 CB LEU B 10 2.106 -3.917 -7.313 1.00 0.00 C ATOM 1583 CG LEU B 10 2.324 -2.451 -6.909 1.00 0.00 C ATOM 1584 CD1 LEU B 10 1.845 -1.456 -7.971 1.00 0.00 C ATOM 1585 CD2 LEU B 10 1.567 -2.188 -5.607 1.00 0.00 C ATOM 0 H LEU B 10 1.293 -3.814 -9.667 1.00 0.00 H new ATOM 0 HA LEU B 10 3.835 -3.697 -8.542 1.00 0.00 H new ATOM 0 HB2 LEU B 10 1.054 -4.068 -7.554 1.00 0.00 H new ATOM 0 HB3 LEU B 10 2.333 -4.559 -6.462 1.00 0.00 H new ATOM 0 HG LEU B 10 3.397 -2.301 -6.791 1.00 0.00 H new ATOM 0 HD11 LEU B 10 2.027 -0.439 -7.625 1.00 0.00 H new ATOM 0 HD12 LEU B 10 2.389 -1.626 -8.900 1.00 0.00 H new ATOM 0 HD13 LEU B 10 0.778 -1.595 -8.144 1.00 0.00 H new ATOM 0 HD21 LEU B 10 1.711 -1.151 -5.305 1.00 0.00 H new ATOM 0 HD22 LEU B 10 0.504 -2.377 -5.759 1.00 0.00 H new ATOM 0 HD23 LEU B 10 1.945 -2.848 -4.827 1.00 0.00 H new ATOM 1597 N ILE B 11 2.553 -6.774 -8.530 1.00 0.00 N ATOM 1598 CA ILE B 11 2.918 -8.192 -8.488 1.00 0.00 C ATOM 1599 C ILE B 11 4.009 -8.488 -9.525 1.00 0.00 C ATOM 1600 O ILE B 11 5.025 -9.118 -9.216 1.00 0.00 O ATOM 1601 CB ILE B 11 1.684 -9.090 -8.716 1.00 0.00 C ATOM 1602 CG1 ILE B 11 0.569 -8.748 -7.715 1.00 0.00 C ATOM 1603 CG2 ILE B 11 2.081 -10.570 -8.596 1.00 0.00 C ATOM 1604 CD1 ILE B 11 -0.705 -9.567 -7.928 1.00 0.00 C ATOM 0 H ILE B 11 1.563 -6.606 -8.710 1.00 0.00 H new ATOM 0 HA ILE B 11 3.311 -8.417 -7.496 1.00 0.00 H new ATOM 0 HB ILE B 11 1.303 -8.908 -9.721 1.00 0.00 H new ATOM 0 HG12 ILE B 11 0.935 -8.915 -6.702 1.00 0.00 H new ATOM 0 HG13 ILE B 11 0.329 -7.688 -7.796 1.00 0.00 H new ATOM 0 HG21 ILE B 11 1.204 -11.196 -8.758 1.00 0.00 H new ATOM 0 HG22 ILE B 11 2.838 -10.805 -9.344 1.00 0.00 H new ATOM 0 HG23 ILE B 11 2.483 -10.759 -7.601 1.00 0.00 H new ATOM 0 HD11 ILE B 11 -1.452 -9.277 -7.189 1.00 0.00 H new ATOM 0 HD12 ILE B 11 -1.094 -9.381 -8.929 1.00 0.00 H new ATOM 0 HD13 ILE B 11 -0.478 -10.627 -7.818 1.00 0.00 H new ATOM 1616 N ASP B 12 3.778 -8.060 -10.770 1.00 0.00 N ATOM 1617 CA ASP B 12 4.641 -8.335 -11.907 1.00 0.00 C ATOM 1618 C ASP B 12 6.070 -7.894 -11.603 1.00 0.00 C ATOM 1619 O ASP B 12 7.008 -8.680 -11.720 1.00 0.00 O ATOM 1620 CB ASP B 12 4.112 -7.638 -13.165 1.00 0.00 C ATOM 1621 CG ASP B 12 4.978 -7.962 -14.378 1.00 0.00 C ATOM 1622 OD1 ASP B 12 5.948 -7.206 -14.600 1.00 0.00 O ATOM 1623 OD2 ASP B 12 4.660 -8.966 -15.049 1.00 0.00 O ATOM 0 H ASP B 12 2.962 -7.498 -11.014 1.00 0.00 H new ATOM 0 HA ASP B 12 4.644 -9.409 -12.092 1.00 0.00 H new ATOM 0 HB2 ASP B 12 3.085 -7.951 -13.353 1.00 0.00 H new ATOM 0 HB3 ASP B 12 4.092 -6.560 -13.006 1.00 0.00 H new ATOM 1628 N VAL B 13 6.226 -6.646 -11.173 1.00 0.00 N ATOM 1629 CA VAL B 13 7.510 -6.105 -10.772 1.00 0.00 C ATOM 1630 C VAL B 13 8.037 -6.883 -9.566 1.00 0.00 C ATOM 1631 O VAL B 13 9.145 -7.418 -9.601 1.00 0.00 O ATOM 1632 CB VAL B 13 7.348 -4.603 -10.485 1.00 0.00 C ATOM 1633 CG1 VAL B 13 8.567 -4.015 -9.763 1.00 0.00 C ATOM 1634 CG2 VAL B 13 7.157 -3.849 -11.802 1.00 0.00 C ATOM 0 H VAL B 13 5.457 -5.981 -11.094 1.00 0.00 H new ATOM 0 HA VAL B 13 8.246 -6.213 -11.568 1.00 0.00 H new ATOM 0 HB VAL B 13 6.478 -4.490 -9.838 1.00 0.00 H new ATOM 0 HG11 VAL B 13 8.405 -2.952 -9.582 1.00 0.00 H new ATOM 0 HG12 VAL B 13 8.708 -4.527 -8.811 1.00 0.00 H new ATOM 0 HG13 VAL B 13 9.455 -4.147 -10.382 1.00 0.00 H new ATOM 0 HG21 VAL B 13 7.042 -2.784 -11.598 1.00 0.00 H new ATOM 0 HG22 VAL B 13 8.027 -4.005 -12.440 1.00 0.00 H new ATOM 0 HG23 VAL B 13 6.265 -4.220 -12.308 1.00 0.00 H new ATOM 1644 N PHE B 14 7.253 -6.931 -8.486 1.00 0.00 N ATOM 1645 CA PHE B 14 7.736 -7.453 -7.221 1.00 0.00 C ATOM 1646 C PHE B 14 8.310 -8.860 -7.371 1.00 0.00 C ATOM 1647 O PHE B 14 9.438 -9.099 -6.943 1.00 0.00 O ATOM 1648 CB PHE B 14 6.633 -7.429 -6.161 1.00 0.00 C ATOM 1649 CG PHE B 14 7.119 -7.932 -4.817 1.00 0.00 C ATOM 1650 CD1 PHE B 14 7.146 -9.312 -4.549 1.00 0.00 C ATOM 1651 CD2 PHE B 14 7.619 -7.028 -3.864 1.00 0.00 C ATOM 1652 CE1 PHE B 14 7.630 -9.783 -3.321 1.00 0.00 C ATOM 1653 CE2 PHE B 14 8.090 -7.501 -2.627 1.00 0.00 C ATOM 1654 CZ PHE B 14 8.087 -8.877 -2.350 1.00 0.00 C ATOM 0 H PHE B 14 6.284 -6.613 -8.470 1.00 0.00 H new ATOM 0 HA PHE B 14 8.545 -6.801 -6.890 1.00 0.00 H new ATOM 0 HB2 PHE B 14 6.258 -6.411 -6.052 1.00 0.00 H new ATOM 0 HB3 PHE B 14 5.797 -8.043 -6.496 1.00 0.00 H new ATOM 0 HD1 PHE B 14 6.793 -10.011 -5.292 1.00 0.00 H new ATOM 0 HD2 PHE B 14 7.641 -5.970 -4.082 1.00 0.00 H new ATOM 0 HE1 PHE B 14 7.652 -10.844 -3.121 1.00 0.00 H new ATOM 0 HE2 PHE B 14 8.455 -6.804 -1.888 1.00 0.00 H new ATOM 0 HZ PHE B 14 8.435 -9.238 -1.393 1.00 0.00 H new ATOM 1664 N HIS B 15 7.554 -9.798 -7.954 1.00 0.00 N ATOM 1665 CA HIS B 15 7.988 -11.192 -7.968 1.00 0.00 C ATOM 1666 C HIS B 15 9.326 -11.334 -8.704 1.00 0.00 C ATOM 1667 O HIS B 15 10.241 -11.998 -8.217 1.00 0.00 O ATOM 1668 CB HIS B 15 6.894 -12.130 -8.489 1.00 0.00 C ATOM 1669 CG HIS B 15 6.747 -12.184 -9.985 1.00 0.00 C ATOM 1670 ND1 HIS B 15 6.090 -11.265 -10.765 1.00 0.00 N ATOM 1671 CD2 HIS B 15 7.212 -13.175 -10.808 1.00 0.00 C ATOM 1672 CE1 HIS B 15 6.167 -11.694 -12.038 1.00 0.00 C ATOM 1673 NE2 HIS B 15 6.845 -12.850 -12.115 1.00 0.00 N ATOM 0 H HIS B 15 6.660 -9.620 -8.411 1.00 0.00 H new ATOM 0 HA HIS B 15 8.164 -11.509 -6.940 1.00 0.00 H new ATOM 0 HB2 HIS B 15 7.099 -13.137 -8.125 1.00 0.00 H new ATOM 0 HB3 HIS B 15 5.941 -11.823 -8.058 1.00 0.00 H new ATOM 0 HD1 HIS B 15 5.629 -10.415 -10.440 1.00 0.00 H new ATOM 0 HD2 HIS B 15 7.764 -14.051 -10.501 1.00 0.00 H new ATOM 0 HE1 HIS B 15 5.740 -11.177 -12.885 1.00 0.00 H new ATOM 1681 N GLN B 16 9.448 -10.662 -9.857 1.00 0.00 N ATOM 1682 CA GLN B 16 10.669 -10.667 -10.650 1.00 0.00 C ATOM 1683 C GLN B 16 11.879 -10.252 -9.814 1.00 0.00 C ATOM 1684 O GLN B 16 12.944 -10.841 -9.970 1.00 0.00 O ATOM 1685 CB GLN B 16 10.531 -9.746 -11.871 1.00 0.00 C ATOM 1686 CG GLN B 16 9.654 -10.372 -12.958 1.00 0.00 C ATOM 1687 CD GLN B 16 9.500 -9.430 -14.148 1.00 0.00 C ATOM 1688 OE1 GLN B 16 10.203 -9.551 -15.145 1.00 0.00 O ATOM 1689 NE2 GLN B 16 8.577 -8.483 -14.044 1.00 0.00 N ATOM 0 H GLN B 16 8.698 -10.101 -10.260 1.00 0.00 H new ATOM 0 HA GLN B 16 10.829 -11.688 -10.996 1.00 0.00 H new ATOM 0 HB2 GLN B 16 10.101 -8.793 -11.561 1.00 0.00 H new ATOM 0 HB3 GLN B 16 11.519 -9.533 -12.279 1.00 0.00 H new ATOM 0 HG2 GLN B 16 10.095 -11.312 -13.289 1.00 0.00 H new ATOM 0 HG3 GLN B 16 8.672 -10.608 -12.547 1.00 0.00 H new ATOM 0 HE21 GLN B 16 8.011 -8.413 -13.198 1.00 0.00 H new ATOM 0 HE22 GLN B 16 8.433 -7.824 -14.810 1.00 0.00 H new ATOM 1698 N TYR B 17 11.743 -9.206 -8.993 1.00 0.00 N ATOM 1699 CA TYR B 17 12.822 -8.715 -8.136 1.00 0.00 C ATOM 1700 C TYR B 17 13.055 -9.631 -6.927 1.00 0.00 C ATOM 1701 O TYR B 17 14.163 -10.116 -6.698 1.00 0.00 O ATOM 1702 CB TYR B 17 12.539 -7.264 -7.730 1.00 0.00 C ATOM 1703 CG TYR B 17 12.807 -6.224 -8.810 1.00 0.00 C ATOM 1704 CD1 TYR B 17 12.089 -6.239 -10.023 1.00 0.00 C ATOM 1705 CD2 TYR B 17 13.716 -5.180 -8.564 1.00 0.00 C ATOM 1706 CE1 TYR B 17 12.195 -5.171 -10.927 1.00 0.00 C ATOM 1707 CE2 TYR B 17 13.815 -4.108 -9.466 1.00 0.00 C ATOM 1708 CZ TYR B 17 13.026 -4.082 -10.624 1.00 0.00 C ATOM 1709 OH TYR B 17 13.068 -2.992 -11.442 1.00 0.00 O ATOM 0 H TYR B 17 10.877 -8.675 -8.905 1.00 0.00 H new ATOM 0 HA TYR B 17 13.754 -8.732 -8.701 1.00 0.00 H new ATOM 0 HB2 TYR B 17 11.496 -7.186 -7.424 1.00 0.00 H new ATOM 0 HB3 TYR B 17 13.146 -7.023 -6.857 1.00 0.00 H new ATOM 0 HD1 TYR B 17 11.452 -7.079 -10.258 1.00 0.00 H new ATOM 0 HD2 TYR B 17 14.338 -5.202 -7.681 1.00 0.00 H new ATOM 0 HE1 TYR B 17 11.639 -5.187 -11.853 1.00 0.00 H new ATOM 0 HE2 TYR B 17 14.503 -3.300 -9.266 1.00 0.00 H new ATOM 0 HH TYR B 17 12.793 -2.196 -10.941 1.00 0.00 H new ATOM 1719 N SER B 18 12.010 -9.867 -6.138 1.00 0.00 N ATOM 1720 CA SER B 18 12.082 -10.638 -4.902 1.00 0.00 C ATOM 1721 C SER B 18 12.630 -12.047 -5.142 1.00 0.00 C ATOM 1722 O SER B 18 13.402 -12.562 -4.333 1.00 0.00 O ATOM 1723 CB SER B 18 10.702 -10.636 -4.245 1.00 0.00 C ATOM 1724 OG SER B 18 9.749 -11.164 -5.133 1.00 0.00 O ATOM 0 H SER B 18 11.073 -9.521 -6.344 1.00 0.00 H new ATOM 0 HA SER B 18 12.791 -10.172 -4.217 1.00 0.00 H new ATOM 0 HB2 SER B 18 10.725 -11.226 -3.329 1.00 0.00 H new ATOM 0 HB3 SER B 18 10.425 -9.620 -3.963 1.00 0.00 H new ATOM 0 HG SER B 18 8.868 -10.787 -4.929 1.00 0.00 H new ATOM 1730 N GLY B 19 12.297 -12.648 -6.289 1.00 0.00 N ATOM 1731 CA GLY B 19 12.795 -13.961 -6.653 1.00 0.00 C ATOM 1732 C GLY B 19 14.322 -14.003 -6.726 1.00 0.00 C ATOM 1733 O GLY B 19 14.904 -15.071 -6.550 1.00 0.00 O ATOM 0 H GLY B 19 11.676 -12.232 -6.983 1.00 0.00 H new ATOM 0 HA2 GLY B 19 12.448 -14.694 -5.924 1.00 0.00 H new ATOM 0 HA3 GLY B 19 12.379 -14.250 -7.618 1.00 0.00 H new ATOM 1737 N ARG B 20 14.978 -12.872 -7.016 1.00 0.00 N ATOM 1738 CA ARG B 20 16.409 -12.867 -7.279 1.00 0.00 C ATOM 1739 C ARG B 20 17.202 -13.024 -5.983 1.00 0.00 C ATOM 1740 O ARG B 20 18.050 -13.908 -5.886 1.00 0.00 O ATOM 1741 CB ARG B 20 16.818 -11.603 -8.047 1.00 0.00 C ATOM 1742 CG ARG B 20 15.877 -11.365 -9.236 1.00 0.00 C ATOM 1743 CD ARG B 20 16.551 -10.632 -10.402 1.00 0.00 C ATOM 1744 NE ARG B 20 16.592 -9.176 -10.185 1.00 0.00 N ATOM 1745 CZ ARG B 20 15.648 -8.316 -10.601 1.00 0.00 C ATOM 1746 NH1 ARG B 20 14.494 -8.763 -11.109 1.00 0.00 N ATOM 1747 NH2 ARG B 20 15.849 -6.999 -10.492 1.00 0.00 N ATOM 0 H ARG B 20 14.535 -11.955 -7.073 1.00 0.00 H new ATOM 0 HA ARG B 20 16.645 -13.724 -7.910 1.00 0.00 H new ATOM 0 HB2 ARG B 20 16.794 -10.742 -7.379 1.00 0.00 H new ATOM 0 HB3 ARG B 20 17.844 -11.703 -8.402 1.00 0.00 H new ATOM 0 HG2 ARG B 20 15.498 -12.324 -9.589 1.00 0.00 H new ATOM 0 HG3 ARG B 20 15.017 -10.786 -8.900 1.00 0.00 H new ATOM 0 HD2 ARG B 20 17.566 -11.009 -10.530 1.00 0.00 H new ATOM 0 HD3 ARG B 20 16.013 -10.846 -11.325 1.00 0.00 H new ATOM 0 HE ARG B 20 17.394 -8.794 -9.683 1.00 0.00 H new ATOM 0 HH11 ARG B 20 14.324 -9.766 -11.183 1.00 0.00 H new ATOM 0 HH12 ARG B 20 13.784 -8.101 -11.422 1.00 0.00 H new ATOM 0 HH21 ARG B 20 16.719 -6.647 -10.093 1.00 0.00 H new ATOM 0 HH22 ARG B 20 15.132 -6.346 -10.808 1.00 0.00 H new ATOM 1761 N GLU B 21 16.940 -12.162 -4.996 1.00 0.00 N ATOM 1762 CA GLU B 21 17.588 -12.196 -3.695 1.00 0.00 C ATOM 1763 C GLU B 21 16.562 -11.845 -2.615 1.00 0.00 C ATOM 1764 O GLU B 21 15.971 -10.764 -2.636 1.00 0.00 O ATOM 1765 CB GLU B 21 18.783 -11.235 -3.676 1.00 0.00 C ATOM 1766 CG GLU B 21 19.954 -11.680 -4.562 1.00 0.00 C ATOM 1767 CD GLU B 21 20.643 -12.951 -4.066 1.00 0.00 C ATOM 1768 OE1 GLU B 21 20.542 -13.229 -2.849 1.00 0.00 O ATOM 1769 OE2 GLU B 21 21.289 -13.609 -4.910 1.00 0.00 O ATOM 0 H GLU B 21 16.258 -11.409 -5.087 1.00 0.00 H new ATOM 0 HA GLU B 21 17.971 -13.196 -3.494 1.00 0.00 H new ATOM 0 HB2 GLU B 21 18.449 -10.249 -4.000 1.00 0.00 H new ATOM 0 HB3 GLU B 21 19.136 -11.130 -2.650 1.00 0.00 H new ATOM 0 HG2 GLU B 21 19.590 -11.845 -5.576 1.00 0.00 H new ATOM 0 HG3 GLU B 21 20.687 -10.875 -4.614 1.00 0.00 H new ATOM 1776 N GLY B 22 16.378 -12.762 -1.665 1.00 0.00 N ATOM 1777 CA GLY B 22 15.320 -12.746 -0.674 1.00 0.00 C ATOM 1778 C GLY B 22 14.564 -14.043 -0.912 1.00 0.00 C ATOM 1779 O GLY B 22 15.132 -15.109 -0.684 1.00 0.00 O ATOM 0 H GLY B 22 16.994 -13.569 -1.567 1.00 0.00 H new ATOM 0 HA2 GLY B 22 15.723 -12.700 0.338 1.00 0.00 H new ATOM 0 HA3 GLY B 22 14.671 -11.879 -0.798 1.00 0.00 H new ATOM 1783 N ASP B 23 13.340 -13.975 -1.436 1.00 0.00 N ATOM 1784 CA ASP B 23 12.607 -15.141 -1.917 1.00 0.00 C ATOM 1785 C ASP B 23 11.404 -14.640 -2.706 1.00 0.00 C ATOM 1786 O ASP B 23 11.135 -13.445 -2.697 1.00 0.00 O ATOM 1787 CB ASP B 23 12.189 -16.087 -0.775 1.00 0.00 C ATOM 1788 CG ASP B 23 11.177 -15.463 0.178 1.00 0.00 C ATOM 1789 OD1 ASP B 23 10.001 -15.352 -0.234 1.00 0.00 O ATOM 1790 OD2 ASP B 23 11.589 -15.122 1.306 1.00 0.00 O ATOM 0 H ASP B 23 12.827 -13.100 -1.538 1.00 0.00 H new ATOM 0 HA ASP B 23 13.255 -15.738 -2.559 1.00 0.00 H new ATOM 0 HB2 ASP B 23 11.765 -16.996 -1.201 1.00 0.00 H new ATOM 0 HB3 ASP B 23 13.075 -16.382 -0.213 1.00 0.00 H new ATOM 1795 N LYS B 24 10.648 -15.548 -3.332 1.00 0.00 N ATOM 1796 CA LYS B 24 9.469 -15.237 -4.142 1.00 0.00 C ATOM 1797 C LYS B 24 8.548 -14.170 -3.526 1.00 0.00 C ATOM 1798 O LYS B 24 7.875 -13.457 -4.265 1.00 0.00 O ATOM 1799 CB LYS B 24 8.670 -16.527 -4.390 1.00 0.00 C ATOM 1800 CG LYS B 24 9.395 -17.502 -5.331 1.00 0.00 C ATOM 1801 CD LYS B 24 8.768 -18.906 -5.304 1.00 0.00 C ATOM 1802 CE LYS B 24 7.290 -18.954 -5.717 1.00 0.00 C ATOM 1803 NZ LYS B 24 7.077 -18.506 -7.104 1.00 0.00 N ATOM 0 H LYS B 24 10.846 -16.547 -3.287 1.00 0.00 H new ATOM 0 HA LYS B 24 9.838 -14.815 -5.077 1.00 0.00 H new ATOM 0 HB2 LYS B 24 8.481 -17.021 -3.437 1.00 0.00 H new ATOM 0 HB3 LYS B 24 7.699 -16.272 -4.815 1.00 0.00 H new ATOM 0 HG2 LYS B 24 9.366 -17.112 -6.348 1.00 0.00 H new ATOM 0 HG3 LYS B 24 10.445 -17.569 -5.045 1.00 0.00 H new ATOM 0 HD2 LYS B 24 9.338 -19.557 -5.967 1.00 0.00 H new ATOM 0 HD3 LYS B 24 8.864 -19.313 -4.297 1.00 0.00 H new ATOM 0 HE2 LYS B 24 6.918 -19.973 -5.606 1.00 0.00 H new ATOM 0 HE3 LYS B 24 6.707 -18.327 -5.042 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 6.064 -18.557 -7.334 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 7.406 -17.525 -7.206 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 7.610 -19.119 -7.753 1.00 0.00 H new ATOM 1817 N HIS B 25 8.472 -14.095 -2.192 1.00 0.00 N ATOM 1818 CA HIS B 25 7.557 -13.228 -1.466 1.00 0.00 C ATOM 1819 C HIS B 25 8.277 -12.104 -0.693 1.00 0.00 C ATOM 1820 O HIS B 25 7.596 -11.334 -0.008 1.00 0.00 O ATOM 1821 CB HIS B 25 6.707 -14.117 -0.544 1.00 0.00 C ATOM 1822 CG HIS B 25 5.329 -13.571 -0.266 1.00 0.00 C ATOM 1823 ND1 HIS B 25 4.934 -12.916 0.873 1.00 0.00 N ATOM 1824 CD2 HIS B 25 4.233 -13.680 -1.079 1.00 0.00 C ATOM 1825 CE1 HIS B 25 3.630 -12.618 0.745 1.00 0.00 C ATOM 1826 NE2 HIS B 25 3.159 -13.060 -0.431 1.00 0.00 N ATOM 0 H HIS B 25 9.064 -14.654 -1.578 1.00 0.00 H new ATOM 0 HA HIS B 25 6.917 -12.703 -2.175 1.00 0.00 H new ATOM 0 HB2 HIS B 25 6.611 -15.104 -0.996 1.00 0.00 H new ATOM 0 HB3 HIS B 25 7.232 -14.249 0.402 1.00 0.00 H new ATOM 0 HD1 HIS B 25 5.525 -12.695 1.674 1.00 0.00 H new ATOM 0 HD2 HIS B 25 4.203 -14.159 -2.047 1.00 0.00 H new ATOM 0 HE1 HIS B 25 3.043 -12.095 1.486 1.00 0.00 H new ATOM 1834 N LYS B 26 9.619 -12.003 -0.763 1.00 0.00 N ATOM 1835 CA LYS B 26 10.409 -11.049 0.023 1.00 0.00 C ATOM 1836 C LYS B 26 11.605 -10.475 -0.758 1.00 0.00 C ATOM 1837 O LYS B 26 12.336 -11.230 -1.397 1.00 0.00 O ATOM 1838 CB LYS B 26 10.913 -11.689 1.327 1.00 0.00 C ATOM 1839 CG LYS B 26 9.858 -12.486 2.109 1.00 0.00 C ATOM 1840 CD LYS B 26 10.403 -12.836 3.499 1.00 0.00 C ATOM 1841 CE LYS B 26 9.393 -13.652 4.313 1.00 0.00 C ATOM 1842 NZ LYS B 26 9.130 -14.966 3.700 1.00 0.00 N ATOM 0 H LYS B 26 10.186 -12.590 -1.375 1.00 0.00 H new ATOM 0 HA LYS B 26 9.736 -10.224 0.255 1.00 0.00 H new ATOM 0 HB2 LYS B 26 11.746 -12.352 1.091 1.00 0.00 H new ATOM 0 HB3 LYS B 26 11.305 -10.903 1.972 1.00 0.00 H new ATOM 0 HG2 LYS B 26 8.942 -11.902 2.203 1.00 0.00 H new ATOM 0 HG3 LYS B 26 9.601 -13.397 1.568 1.00 0.00 H new ATOM 0 HD2 LYS B 26 11.329 -13.402 3.395 1.00 0.00 H new ATOM 0 HD3 LYS B 26 10.648 -11.919 4.036 1.00 0.00 H new ATOM 0 HE2 LYS B 26 9.771 -13.792 5.326 1.00 0.00 H new ATOM 0 HE3 LYS B 26 8.459 -13.096 4.396 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 8.579 -15.552 4.359 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 8.592 -14.837 2.819 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 10.033 -15.437 3.489 1.00 0.00 H new ATOM 1856 N LEU B 27 11.832 -9.157 -0.679 1.00 0.00 N ATOM 1857 CA LEU B 27 12.958 -8.449 -1.300 1.00 0.00 C ATOM 1858 C LEU B 27 14.117 -8.301 -0.312 1.00 0.00 C ATOM 1859 O LEU B 27 13.926 -7.677 0.733 1.00 0.00 O ATOM 1860 CB LEU B 27 12.536 -7.014 -1.674 1.00 0.00 C ATOM 1861 CG LEU B 27 11.543 -6.889 -2.833 1.00 0.00 C ATOM 1862 CD1 LEU B 27 10.907 -5.495 -2.792 1.00 0.00 C ATOM 1863 CD2 LEU B 27 12.229 -7.042 -4.192 1.00 0.00 C ATOM 0 H LEU B 27 11.213 -8.532 -0.162 1.00 0.00 H new ATOM 0 HA LEU B 27 13.258 -9.026 -2.175 1.00 0.00 H new ATOM 0 HB2 LEU B 27 12.098 -6.544 -0.794 1.00 0.00 H new ATOM 0 HB3 LEU B 27 13.432 -6.447 -1.926 1.00 0.00 H new ATOM 0 HG LEU B 27 10.802 -7.680 -2.719 1.00 0.00 H new ATOM 0 HD11 LEU B 27 10.198 -5.394 -3.613 1.00 0.00 H new ATOM 0 HD12 LEU B 27 10.386 -5.360 -1.844 1.00 0.00 H new ATOM 0 HD13 LEU B 27 11.685 -4.737 -2.889 1.00 0.00 H new ATOM 0 HD21 LEU B 27 11.489 -6.947 -4.986 1.00 0.00 H new ATOM 0 HD22 LEU B 27 12.986 -6.266 -4.307 1.00 0.00 H new ATOM 0 HD23 LEU B 27 12.702 -8.022 -4.253 1.00 0.00 H new ATOM 1875 N LYS B 28 15.316 -8.807 -0.636 1.00 0.00 N ATOM 1876 CA LYS B 28 16.522 -8.513 0.138 1.00 0.00 C ATOM 1877 C LYS B 28 17.046 -7.113 -0.231 1.00 0.00 C ATOM 1878 O LYS B 28 16.618 -6.534 -1.229 1.00 0.00 O ATOM 1879 CB LYS B 28 17.548 -9.640 -0.049 1.00 0.00 C ATOM 1880 CG LYS B 28 18.762 -9.504 0.881 1.00 0.00 C ATOM 1881 CD LYS B 28 19.427 -10.850 1.206 1.00 0.00 C ATOM 1882 CE LYS B 28 19.807 -11.625 -0.056 1.00 0.00 C ATOM 1883 NZ LYS B 28 20.581 -12.838 0.251 1.00 0.00 N ATOM 0 H LYS B 28 15.472 -9.424 -1.433 1.00 0.00 H new ATOM 0 HA LYS B 28 16.301 -8.482 1.205 1.00 0.00 H new ATOM 0 HB2 LYS B 28 17.063 -10.599 0.133 1.00 0.00 H new ATOM 0 HB3 LYS B 28 17.889 -9.646 -1.084 1.00 0.00 H new ATOM 0 HG2 LYS B 28 19.496 -8.846 0.416 1.00 0.00 H new ATOM 0 HG3 LYS B 28 18.449 -9.027 1.810 1.00 0.00 H new ATOM 0 HD2 LYS B 28 20.320 -10.677 1.807 1.00 0.00 H new ATOM 0 HD3 LYS B 28 18.748 -11.452 1.810 1.00 0.00 H new ATOM 0 HE2 LYS B 28 18.902 -11.900 -0.598 1.00 0.00 H new ATOM 0 HE3 LYS B 28 20.390 -10.981 -0.715 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 20.817 -13.332 -0.633 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 21.457 -12.575 0.745 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 20.016 -13.466 0.858 1.00 0.00 H new ATOM 1897 N LYS B 29 17.969 -6.561 0.571 1.00 0.00 N ATOM 1898 CA LYS B 29 18.411 -5.169 0.497 1.00 0.00 C ATOM 1899 C LYS B 29 18.866 -4.753 -0.901 1.00 0.00 C ATOM 1900 O LYS B 29 18.543 -3.653 -1.343 1.00 0.00 O ATOM 1901 CB LYS B 29 19.475 -4.891 1.582 1.00 0.00 C ATOM 1902 CG LYS B 29 20.774 -5.695 1.423 1.00 0.00 C ATOM 1903 CD LYS B 29 21.714 -5.384 2.595 1.00 0.00 C ATOM 1904 CE LYS B 29 23.020 -6.175 2.465 1.00 0.00 C ATOM 1905 NZ LYS B 29 23.934 -5.886 3.585 1.00 0.00 N ATOM 0 H LYS B 29 18.438 -7.089 1.307 1.00 0.00 H new ATOM 0 HA LYS B 29 17.546 -4.538 0.702 1.00 0.00 H new ATOM 0 HB2 LYS B 29 19.717 -3.828 1.571 1.00 0.00 H new ATOM 0 HB3 LYS B 29 19.045 -5.110 2.559 1.00 0.00 H new ATOM 0 HG2 LYS B 29 20.553 -6.762 1.393 1.00 0.00 H new ATOM 0 HG3 LYS B 29 21.257 -5.443 0.479 1.00 0.00 H new ATOM 0 HD2 LYS B 29 21.931 -4.316 2.621 1.00 0.00 H new ATOM 0 HD3 LYS B 29 21.224 -5.633 3.537 1.00 0.00 H new ATOM 0 HE2 LYS B 29 22.800 -7.242 2.438 1.00 0.00 H new ATOM 0 HE3 LYS B 29 23.506 -5.926 1.522 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 24.809 -6.436 3.470 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 24.161 -4.871 3.595 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 23.477 -6.147 4.482 1.00 0.00 H new ATOM 1919 N SER B 30 19.574 -5.625 -1.620 1.00 0.00 N ATOM 1920 CA SER B 30 19.996 -5.352 -2.983 1.00 0.00 C ATOM 1921 C SER B 30 18.777 -5.104 -3.880 1.00 0.00 C ATOM 1922 O SER B 30 18.747 -4.161 -4.674 1.00 0.00 O ATOM 1923 CB SER B 30 20.809 -6.555 -3.474 1.00 0.00 C ATOM 1924 OG SER B 30 20.130 -7.757 -3.151 1.00 0.00 O ATOM 0 H SER B 30 19.868 -6.537 -1.270 1.00 0.00 H new ATOM 0 HA SER B 30 20.611 -4.453 -3.020 1.00 0.00 H new ATOM 0 HB2 SER B 30 20.958 -6.489 -4.552 1.00 0.00 H new ATOM 0 HB3 SER B 30 21.797 -6.550 -3.014 1.00 0.00 H new ATOM 0 HG SER B 30 19.638 -8.076 -3.936 1.00 0.00 H new ATOM 1930 N GLU B 31 17.760 -5.960 -3.751 1.00 0.00 N ATOM 1931 CA GLU B 31 16.584 -5.898 -4.601 1.00 0.00 C ATOM 1932 C GLU B 31 15.738 -4.703 -4.200 1.00 0.00 C ATOM 1933 O GLU B 31 15.287 -3.963 -5.063 1.00 0.00 O ATOM 1934 CB GLU B 31 15.777 -7.201 -4.537 1.00 0.00 C ATOM 1935 CG GLU B 31 16.674 -8.432 -4.680 1.00 0.00 C ATOM 1936 CD GLU B 31 17.661 -8.300 -5.839 1.00 0.00 C ATOM 1937 OE1 GLU B 31 17.183 -8.189 -6.987 1.00 0.00 O ATOM 1938 OE2 GLU B 31 18.878 -8.277 -5.543 1.00 0.00 O ATOM 0 H GLU B 31 17.735 -6.708 -3.058 1.00 0.00 H new ATOM 0 HA GLU B 31 16.902 -5.776 -5.636 1.00 0.00 H new ATOM 0 HB2 GLU B 31 15.241 -7.250 -3.589 1.00 0.00 H new ATOM 0 HB3 GLU B 31 15.027 -7.204 -5.328 1.00 0.00 H new ATOM 0 HG2 GLU B 31 17.225 -8.587 -3.752 1.00 0.00 H new ATOM 0 HG3 GLU B 31 16.053 -9.315 -4.833 1.00 0.00 H new ATOM 1945 N LEU B 32 15.539 -4.512 -2.895 1.00 0.00 N ATOM 1946 CA LEU B 32 14.804 -3.378 -2.354 1.00 0.00 C ATOM 1947 C LEU B 32 15.433 -2.071 -2.851 1.00 0.00 C ATOM 1948 O LEU B 32 14.741 -1.212 -3.395 1.00 0.00 O ATOM 1949 CB LEU B 32 14.766 -3.506 -0.824 1.00 0.00 C ATOM 1950 CG LEU B 32 13.922 -2.468 -0.062 1.00 0.00 C ATOM 1951 CD1 LEU B 32 14.674 -1.152 0.170 1.00 0.00 C ATOM 1952 CD2 LEU B 32 12.553 -2.216 -0.705 1.00 0.00 C ATOM 0 H LEU B 32 15.889 -5.150 -2.180 1.00 0.00 H new ATOM 0 HA LEU B 32 13.771 -3.366 -2.702 1.00 0.00 H new ATOM 0 HB2 LEU B 32 14.390 -4.498 -0.575 1.00 0.00 H new ATOM 0 HB3 LEU B 32 15.789 -3.451 -0.453 1.00 0.00 H new ATOM 0 HG LEU B 32 13.735 -2.914 0.915 1.00 0.00 H new ATOM 0 HD11 LEU B 32 14.032 -0.457 0.711 1.00 0.00 H new ATOM 0 HD12 LEU B 32 15.574 -1.345 0.754 1.00 0.00 H new ATOM 0 HD13 LEU B 32 14.951 -0.717 -0.790 1.00 0.00 H new ATOM 0 HD21 LEU B 32 12.007 -1.475 -0.121 1.00 0.00 H new ATOM 0 HD22 LEU B 32 12.691 -1.847 -1.721 1.00 0.00 H new ATOM 0 HD23 LEU B 32 11.986 -3.147 -0.731 1.00 0.00 H new ATOM 1964 N LYS B 33 16.756 -1.945 -2.734 1.00 0.00 N ATOM 1965 CA LYS B 33 17.490 -0.804 -3.257 1.00 0.00 C ATOM 1966 C LYS B 33 17.181 -0.637 -4.743 1.00 0.00 C ATOM 1967 O LYS B 33 16.731 0.428 -5.169 1.00 0.00 O ATOM 1968 CB LYS B 33 18.989 -1.074 -3.049 1.00 0.00 C ATOM 1969 CG LYS B 33 19.914 -0.056 -3.736 1.00 0.00 C ATOM 1970 CD LYS B 33 21.367 -0.547 -3.720 1.00 0.00 C ATOM 1971 CE LYS B 33 22.323 0.518 -4.276 1.00 0.00 C ATOM 1972 NZ LYS B 33 21.989 0.901 -5.660 1.00 0.00 N ATOM 0 H LYS B 33 17.346 -2.637 -2.271 1.00 0.00 H new ATOM 0 HA LYS B 33 17.201 0.112 -2.742 1.00 0.00 H new ATOM 0 HB2 LYS B 33 19.201 -1.077 -1.980 1.00 0.00 H new ATOM 0 HB3 LYS B 33 19.223 -2.071 -3.423 1.00 0.00 H new ATOM 0 HG2 LYS B 33 19.589 0.102 -4.765 1.00 0.00 H new ATOM 0 HG3 LYS B 33 19.844 0.906 -3.229 1.00 0.00 H new ATOM 0 HD2 LYS B 33 21.656 -0.801 -2.700 1.00 0.00 H new ATOM 0 HD3 LYS B 33 21.451 -1.459 -4.312 1.00 0.00 H new ATOM 0 HE2 LYS B 33 22.290 1.402 -3.639 1.00 0.00 H new ATOM 0 HE3 LYS B 33 23.345 0.139 -4.242 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 22.727 1.531 -6.034 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 21.930 0.048 -6.252 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 21.074 1.395 -5.672 1.00 0.00 H new ATOM 1986 N GLU B 34 17.474 -1.660 -5.547 1.00 0.00 N ATOM 1987 CA GLU B 34 17.369 -1.570 -6.995 1.00 0.00 C ATOM 1988 C GLU B 34 15.952 -1.161 -7.391 1.00 0.00 C ATOM 1989 O GLU B 34 15.762 -0.213 -8.145 1.00 0.00 O ATOM 1990 CB GLU B 34 17.786 -2.915 -7.599 1.00 0.00 C ATOM 1991 CG GLU B 34 17.643 -2.942 -9.121 1.00 0.00 C ATOM 1992 CD GLU B 34 18.245 -4.215 -9.709 1.00 0.00 C ATOM 1993 OE1 GLU B 34 17.713 -5.298 -9.380 1.00 0.00 O ATOM 1994 OE2 GLU B 34 19.227 -4.085 -10.470 1.00 0.00 O ATOM 0 H GLU B 34 17.789 -2.569 -5.209 1.00 0.00 H new ATOM 0 HA GLU B 34 18.036 -0.802 -7.386 1.00 0.00 H new ATOM 0 HB2 GLU B 34 18.821 -3.125 -7.331 1.00 0.00 H new ATOM 0 HB3 GLU B 34 17.177 -3.709 -7.166 1.00 0.00 H new ATOM 0 HG2 GLU B 34 16.589 -2.877 -9.391 1.00 0.00 H new ATOM 0 HG3 GLU B 34 18.137 -2.071 -9.551 1.00 0.00 H new ATOM 2001 N LEU B 35 14.968 -1.866 -6.842 1.00 0.00 N ATOM 2002 CA LEU B 35 13.551 -1.590 -6.973 1.00 0.00 C ATOM 2003 C LEU B 35 13.279 -0.115 -6.692 1.00 0.00 C ATOM 2004 O LEU B 35 12.722 0.561 -7.552 1.00 0.00 O ATOM 2005 CB LEU B 35 12.835 -2.553 -6.016 1.00 0.00 C ATOM 2006 CG LEU B 35 11.303 -2.500 -5.891 1.00 0.00 C ATOM 2007 CD1 LEU B 35 10.781 -1.183 -5.302 1.00 0.00 C ATOM 2008 CD2 LEU B 35 10.606 -2.832 -7.212 1.00 0.00 C ATOM 0 H LEU B 35 15.152 -2.687 -6.265 1.00 0.00 H new ATOM 0 HA LEU B 35 13.177 -1.757 -7.983 1.00 0.00 H new ATOM 0 HB2 LEU B 35 13.103 -3.567 -6.313 1.00 0.00 H new ATOM 0 HB3 LEU B 35 13.249 -2.392 -5.021 1.00 0.00 H new ATOM 0 HG LEU B 35 11.046 -3.278 -5.172 1.00 0.00 H new ATOM 0 HD11 LEU B 35 9.693 -1.217 -5.243 1.00 0.00 H new ATOM 0 HD12 LEU B 35 11.194 -1.042 -4.303 1.00 0.00 H new ATOM 0 HD13 LEU B 35 11.084 -0.353 -5.941 1.00 0.00 H new ATOM 0 HD21 LEU B 35 9.526 -2.782 -7.076 1.00 0.00 H new ATOM 0 HD22 LEU B 35 10.909 -2.114 -7.974 1.00 0.00 H new ATOM 0 HD23 LEU B 35 10.886 -3.837 -7.529 1.00 0.00 H new ATOM 2020 N ILE B 36 13.696 0.413 -5.536 1.00 0.00 N ATOM 2021 CA ILE B 36 13.415 1.808 -5.220 1.00 0.00 C ATOM 2022 C ILE B 36 14.084 2.739 -6.237 1.00 0.00 C ATOM 2023 O ILE B 36 13.397 3.550 -6.850 1.00 0.00 O ATOM 2024 CB ILE B 36 13.751 2.146 -3.754 1.00 0.00 C ATOM 2025 CG1 ILE B 36 12.788 1.391 -2.818 1.00 0.00 C ATOM 2026 CG2 ILE B 36 13.599 3.654 -3.505 1.00 0.00 C ATOM 2027 CD1 ILE B 36 13.059 1.647 -1.332 1.00 0.00 C ATOM 0 H ILE B 36 14.217 -0.095 -4.821 1.00 0.00 H new ATOM 0 HA ILE B 36 12.341 1.973 -5.309 1.00 0.00 H new ATOM 0 HB ILE B 36 14.781 1.848 -3.556 1.00 0.00 H new ATOM 0 HG12 ILE B 36 11.764 1.684 -3.049 1.00 0.00 H new ATOM 0 HG13 ILE B 36 12.865 0.322 -3.015 1.00 0.00 H new ATOM 0 HG21 ILE B 36 13.840 3.877 -2.466 1.00 0.00 H new ATOM 0 HG22 ILE B 36 14.277 4.201 -4.160 1.00 0.00 H new ATOM 0 HG23 ILE B 36 12.572 3.955 -3.713 1.00 0.00 H new ATOM 0 HD11 ILE B 36 12.345 1.085 -0.730 1.00 0.00 H new ATOM 0 HD12 ILE B 36 14.072 1.327 -1.086 1.00 0.00 H new ATOM 0 HD13 ILE B 36 12.953 2.711 -1.121 1.00 0.00 H new ATOM 2039 N ASN B 37 15.406 2.643 -6.427 1.00 0.00 N ATOM 2040 CA ASN B 37 16.113 3.556 -7.332 1.00 0.00 C ATOM 2041 C ASN B 37 15.493 3.510 -8.730 1.00 0.00 C ATOM 2042 O ASN B 37 15.249 4.543 -9.348 1.00 0.00 O ATOM 2043 CB ASN B 37 17.607 3.220 -7.463 1.00 0.00 C ATOM 2044 CG ASN B 37 18.418 3.495 -6.203 1.00 0.00 C ATOM 2045 OD1 ASN B 37 18.992 4.566 -6.017 1.00 0.00 O ATOM 2046 ND2 ASN B 37 18.512 2.504 -5.330 1.00 0.00 N ATOM 0 H ASN B 37 16.001 1.951 -5.972 1.00 0.00 H new ATOM 0 HA ASN B 37 16.016 4.550 -6.896 1.00 0.00 H new ATOM 0 HB2 ASN B 37 17.710 2.167 -7.726 1.00 0.00 H new ATOM 0 HB3 ASN B 37 18.028 3.797 -8.286 1.00 0.00 H new ATOM 0 HD21 ASN B 37 19.069 2.621 -4.484 1.00 0.00 H new ATOM 0 HD22 ASN B 37 18.027 1.623 -5.504 1.00 0.00 H new ATOM 2053 N ASN B 38 15.289 2.297 -9.243 1.00 0.00 N ATOM 2054 CA ASN B 38 14.845 2.085 -10.606 1.00 0.00 C ATOM 2055 C ASN B 38 13.399 2.546 -10.764 1.00 0.00 C ATOM 2056 O ASN B 38 13.097 3.374 -11.624 1.00 0.00 O ATOM 2057 CB ASN B 38 14.988 0.597 -10.954 1.00 0.00 C ATOM 2058 CG ASN B 38 14.686 0.311 -12.421 1.00 0.00 C ATOM 2059 OD1 ASN B 38 14.773 1.187 -13.274 1.00 0.00 O ATOM 2060 ND2 ASN B 38 14.343 -0.931 -12.735 1.00 0.00 N ATOM 0 H ASN B 38 15.430 1.435 -8.716 1.00 0.00 H new ATOM 0 HA ASN B 38 15.460 2.669 -11.291 1.00 0.00 H new ATOM 0 HB2 ASN B 38 16.002 0.269 -10.724 1.00 0.00 H new ATOM 0 HB3 ASN B 38 14.314 0.014 -10.327 1.00 0.00 H new ATOM 0 HD21 ASN B 38 14.145 -1.175 -13.705 1.00 0.00 H new ATOM 0 HD22 ASN B 38 14.278 -1.642 -12.006 1.00 0.00 H new ATOM 2067 N GLU B 39 12.496 2.029 -9.925 1.00 0.00 N ATOM 2068 CA GLU B 39 11.079 2.280 -10.110 1.00 0.00 C ATOM 2069 C GLU B 39 10.664 3.622 -9.523 1.00 0.00 C ATOM 2070 O GLU B 39 9.987 4.379 -10.211 1.00 0.00 O ATOM 2071 CB GLU B 39 10.236 1.140 -9.529 1.00 0.00 C ATOM 2072 CG GLU B 39 10.376 -0.152 -10.345 1.00 0.00 C ATOM 2073 CD GLU B 39 9.791 0.013 -11.745 1.00 0.00 C ATOM 2074 OE1 GLU B 39 8.572 0.290 -11.825 1.00 0.00 O ATOM 2075 OE2 GLU B 39 10.579 -0.079 -12.711 1.00 0.00 O ATOM 0 H GLU B 39 12.725 1.442 -9.123 1.00 0.00 H new ATOM 0 HA GLU B 39 10.894 2.323 -11.183 1.00 0.00 H new ATOM 0 HB2 GLU B 39 10.540 0.953 -8.499 1.00 0.00 H new ATOM 0 HB3 GLU B 39 9.189 1.441 -9.503 1.00 0.00 H new ATOM 0 HG2 GLU B 39 11.428 -0.427 -10.418 1.00 0.00 H new ATOM 0 HG3 GLU B 39 9.868 -0.967 -9.830 1.00 0.00 H new ATOM 2082 N LEU B 40 11.103 3.982 -8.312 1.00 0.00 N ATOM 2083 CA LEU B 40 10.782 5.289 -7.741 1.00 0.00 C ATOM 2084 C LEU B 40 11.846 6.295 -8.184 1.00 0.00 C ATOM 2085 O LEU B 40 12.302 7.110 -7.386 1.00 0.00 O ATOM 2086 CB LEU B 40 10.660 5.240 -6.206 1.00 0.00 C ATOM 2087 CG LEU B 40 9.366 4.623 -5.658 1.00 0.00 C ATOM 2088 CD1 LEU B 40 9.312 3.099 -5.800 1.00 0.00 C ATOM 2089 CD2 LEU B 40 9.260 4.970 -4.169 1.00 0.00 C ATOM 0 H LEU B 40 11.678 3.389 -7.714 1.00 0.00 H new ATOM 0 HA LEU B 40 9.806 5.602 -8.110 1.00 0.00 H new ATOM 0 HB2 LEU B 40 11.505 4.676 -5.811 1.00 0.00 H new ATOM 0 HB3 LEU B 40 10.747 6.256 -5.821 1.00 0.00 H new ATOM 0 HG LEU B 40 8.541 5.032 -6.241 1.00 0.00 H new ATOM 0 HD11 LEU B 40 8.371 2.729 -5.393 1.00 0.00 H new ATOM 0 HD12 LEU B 40 9.383 2.829 -6.854 1.00 0.00 H new ATOM 0 HD13 LEU B 40 10.144 2.653 -5.255 1.00 0.00 H new ATOM 0 HD21 LEU B 40 8.346 4.540 -3.759 1.00 0.00 H new ATOM 0 HD22 LEU B 40 10.121 4.564 -3.639 1.00 0.00 H new ATOM 0 HD23 LEU B 40 9.237 6.053 -4.049 1.00 0.00 H new ATOM 2101 N SER B 41 12.220 6.266 -9.463 1.00 0.00 N ATOM 2102 CA SER B 41 13.269 7.101 -10.021 1.00 0.00 C ATOM 2103 C SER B 41 12.907 8.586 -9.944 1.00 0.00 C ATOM 2104 O SER B 41 13.793 9.434 -9.873 1.00 0.00 O ATOM 2105 CB SER B 41 13.531 6.649 -11.465 1.00 0.00 C ATOM 2106 OG SER B 41 12.376 6.032 -12.014 1.00 0.00 O ATOM 0 H SER B 41 11.790 5.646 -10.150 1.00 0.00 H new ATOM 0 HA SER B 41 14.181 6.984 -9.436 1.00 0.00 H new ATOM 0 HB2 SER B 41 13.816 7.507 -12.074 1.00 0.00 H new ATOM 0 HB3 SER B 41 14.368 5.951 -11.487 1.00 0.00 H new ATOM 0 HG SER B 41 12.460 5.058 -11.942 1.00 0.00 H new ATOM 2112 N HIS B 42 11.609 8.894 -9.997 1.00 0.00 N ATOM 2113 CA HIS B 42 11.077 10.242 -9.854 1.00 0.00 C ATOM 2114 C HIS B 42 10.482 10.425 -8.457 1.00 0.00 C ATOM 2115 O HIS B 42 10.667 11.460 -7.823 1.00 0.00 O ATOM 2116 CB HIS B 42 10.040 10.492 -10.958 1.00 0.00 C ATOM 2117 CG HIS B 42 10.573 10.160 -12.330 1.00 0.00 C ATOM 2118 ND1 HIS B 42 10.476 8.939 -12.962 1.00 0.00 N ATOM 2119 CD2 HIS B 42 11.387 10.955 -13.092 1.00 0.00 C ATOM 2120 CE1 HIS B 42 11.204 9.009 -14.089 1.00 0.00 C ATOM 2121 NE2 HIS B 42 11.775 10.218 -14.215 1.00 0.00 N ATOM 0 H HIS B 42 10.884 8.192 -10.144 1.00 0.00 H new ATOM 0 HA HIS B 42 11.875 10.976 -9.964 1.00 0.00 H new ATOM 0 HB2 HIS B 42 9.151 9.893 -10.761 1.00 0.00 H new ATOM 0 HB3 HIS B 42 9.731 11.537 -10.934 1.00 0.00 H new ATOM 0 HD1 HIS B 42 9.948 8.130 -12.634 1.00 0.00 H new ATOM 0 HD2 HIS B 42 11.677 11.970 -12.866 1.00 0.00 H new ATOM 0 HE1 HIS B 42 11.315 8.202 -14.798 1.00 0.00 H new ATOM 2129 N PHE B 43 9.731 9.421 -7.991 1.00 0.00 N ATOM 2130 CA PHE B 43 9.005 9.476 -6.728 1.00 0.00 C ATOM 2131 C PHE B 43 9.927 9.535 -5.509 1.00 0.00 C ATOM 2132 O PHE B 43 9.497 10.047 -4.473 1.00 0.00 O ATOM 2133 CB PHE B 43 8.022 8.301 -6.621 1.00 0.00 C ATOM 2134 CG PHE B 43 6.617 8.643 -7.075 1.00 0.00 C ATOM 2135 CD1 PHE B 43 6.371 9.038 -8.405 1.00 0.00 C ATOM 2136 CD2 PHE B 43 5.567 8.670 -6.138 1.00 0.00 C ATOM 2137 CE1 PHE B 43 5.075 9.413 -8.802 1.00 0.00 C ATOM 2138 CE2 PHE B 43 4.277 9.055 -6.530 1.00 0.00 C ATOM 2139 CZ PHE B 43 4.029 9.426 -7.862 1.00 0.00 C ATOM 0 H PHE B 43 9.612 8.539 -8.490 1.00 0.00 H new ATOM 0 HA PHE B 43 8.442 10.410 -6.728 1.00 0.00 H new ATOM 0 HB2 PHE B 43 8.396 7.470 -7.219 1.00 0.00 H new ATOM 0 HB3 PHE B 43 7.988 7.960 -5.586 1.00 0.00 H new ATOM 0 HD1 PHE B 43 7.179 9.053 -9.121 1.00 0.00 H new ATOM 0 HD2 PHE B 43 5.756 8.393 -5.111 1.00 0.00 H new ATOM 0 HE1 PHE B 43 4.883 9.691 -9.828 1.00 0.00 H new ATOM 0 HE2 PHE B 43 3.474 9.066 -5.808 1.00 0.00 H new ATOM 0 HZ PHE B 43 3.035 9.721 -8.164 1.00 0.00 H new ATOM 2149 N LEU B 44 11.148 8.992 -5.608 1.00 0.00 N ATOM 2150 CA LEU B 44 12.185 9.113 -4.598 1.00 0.00 C ATOM 2151 C LEU B 44 13.513 9.518 -5.243 1.00 0.00 C ATOM 2152 O LEU B 44 13.646 9.533 -6.464 1.00 0.00 O ATOM 2153 CB LEU B 44 12.342 7.805 -3.801 1.00 0.00 C ATOM 2154 CG LEU B 44 12.441 8.103 -2.298 1.00 0.00 C ATOM 2155 CD1 LEU B 44 11.061 7.943 -1.659 1.00 0.00 C ATOM 2156 CD2 LEU B 44 13.442 7.177 -1.606 1.00 0.00 C ATOM 0 H LEU B 44 11.440 8.444 -6.417 1.00 0.00 H new ATOM 0 HA LEU B 44 11.886 9.894 -3.898 1.00 0.00 H new ATOM 0 HB2 LEU B 44 11.492 7.150 -3.993 1.00 0.00 H new ATOM 0 HB3 LEU B 44 13.235 7.274 -4.133 1.00 0.00 H new ATOM 0 HG LEU B 44 12.795 9.127 -2.175 1.00 0.00 H new ATOM 0 HD11 LEU B 44 11.128 8.154 -0.592 1.00 0.00 H new ATOM 0 HD12 LEU B 44 10.362 8.639 -2.123 1.00 0.00 H new ATOM 0 HD13 LEU B 44 10.708 6.922 -1.806 1.00 0.00 H new ATOM 0 HD21 LEU B 44 13.486 7.417 -0.544 1.00 0.00 H new ATOM 0 HD22 LEU B 44 13.126 6.141 -1.731 1.00 0.00 H new ATOM 0 HD23 LEU B 44 14.429 7.312 -2.049 1.00 0.00 H new ATOM 2168 N GLU B 45 14.487 9.870 -4.402 1.00 0.00 N ATOM 2169 CA GLU B 45 15.839 10.202 -4.819 1.00 0.00 C ATOM 2170 C GLU B 45 16.683 8.923 -4.916 1.00 0.00 C ATOM 2171 O GLU B 45 16.295 7.878 -4.395 1.00 0.00 O ATOM 2172 CB GLU B 45 16.459 11.176 -3.804 1.00 0.00 C ATOM 2173 CG GLU B 45 15.513 12.305 -3.363 1.00 0.00 C ATOM 2174 CD GLU B 45 14.885 13.042 -4.542 1.00 0.00 C ATOM 2175 OE1 GLU B 45 15.667 13.568 -5.364 1.00 0.00 O ATOM 2176 OE2 GLU B 45 13.635 13.067 -4.594 1.00 0.00 O ATOM 0 H GLU B 45 14.349 9.932 -3.393 1.00 0.00 H new ATOM 0 HA GLU B 45 15.814 10.677 -5.800 1.00 0.00 H new ATOM 0 HB2 GLU B 45 16.774 10.616 -2.924 1.00 0.00 H new ATOM 0 HB3 GLU B 45 17.356 11.617 -4.240 1.00 0.00 H new ATOM 0 HG2 GLU B 45 14.723 11.888 -2.738 1.00 0.00 H new ATOM 0 HG3 GLU B 45 16.065 13.016 -2.748 1.00 0.00 H new ATOM 2183 N GLU B 46 17.861 9.023 -5.541 1.00 0.00 N ATOM 2184 CA GLU B 46 18.867 7.972 -5.534 1.00 0.00 C ATOM 2185 C GLU B 46 19.208 7.618 -4.085 1.00 0.00 C ATOM 2186 O GLU B 46 19.420 8.517 -3.274 1.00 0.00 O ATOM 2187 CB GLU B 46 20.116 8.459 -6.286 1.00 0.00 C ATOM 2188 CG GLU B 46 21.276 7.458 -6.188 1.00 0.00 C ATOM 2189 CD GLU B 46 22.489 7.916 -6.992 1.00 0.00 C ATOM 2190 OE1 GLU B 46 22.537 7.571 -8.192 1.00 0.00 O ATOM 2191 OE2 GLU B 46 23.342 8.604 -6.391 1.00 0.00 O ATOM 0 H GLU B 46 18.140 9.849 -6.071 1.00 0.00 H new ATOM 0 HA GLU B 46 18.488 7.081 -6.034 1.00 0.00 H new ATOM 0 HB2 GLU B 46 19.867 8.623 -7.334 1.00 0.00 H new ATOM 0 HB3 GLU B 46 20.432 9.420 -5.880 1.00 0.00 H new ATOM 0 HG2 GLU B 46 21.559 7.331 -5.143 1.00 0.00 H new ATOM 0 HG3 GLU B 46 20.947 6.484 -6.550 1.00 0.00 H new ATOM 2198 N ILE B 47 19.281 6.323 -3.780 1.00 0.00 N ATOM 2199 CA ILE B 47 19.562 5.821 -2.437 1.00 0.00 C ATOM 2200 C ILE B 47 21.076 5.654 -2.249 1.00 0.00 C ATOM 2201 O ILE B 47 21.664 6.203 -1.319 1.00 0.00 O ATOM 2202 CB ILE B 47 18.822 4.491 -2.177 1.00 0.00 C ATOM 2203 CG1 ILE B 47 17.397 4.417 -2.753 1.00 0.00 C ATOM 2204 CG2 ILE B 47 18.778 4.241 -0.664 1.00 0.00 C ATOM 2205 CD1 ILE B 47 16.420 5.343 -2.036 1.00 0.00 C ATOM 0 H ILE B 47 19.145 5.583 -4.469 1.00 0.00 H new ATOM 0 HA ILE B 47 19.197 6.546 -1.710 1.00 0.00 H new ATOM 0 HB ILE B 47 19.386 3.720 -2.703 1.00 0.00 H new ATOM 0 HG12 ILE B 47 17.424 4.675 -3.812 1.00 0.00 H new ATOM 0 HG13 ILE B 47 17.035 3.391 -2.684 1.00 0.00 H new ATOM 0 HG21 ILE B 47 18.258 3.304 -0.465 1.00 0.00 H new ATOM 0 HG22 ILE B 47 19.795 4.181 -0.275 1.00 0.00 H new ATOM 0 HG23 ILE B 47 18.250 5.060 -0.175 1.00 0.00 H new ATOM 0 HD11 ILE B 47 15.432 5.248 -2.486 1.00 0.00 H new ATOM 0 HD12 ILE B 47 16.367 5.070 -0.982 1.00 0.00 H new ATOM 0 HD13 ILE B 47 16.762 6.374 -2.127 1.00 0.00 H new ATOM 2217 N LYS B 48 21.692 4.870 -3.143 1.00 0.00 N ATOM 2218 CA LYS B 48 23.121 4.576 -3.214 1.00 0.00 C ATOM 2219 C LYS B 48 23.667 3.799 -2.006 1.00 0.00 C ATOM 2220 O LYS B 48 24.123 2.668 -2.166 1.00 0.00 O ATOM 2221 CB LYS B 48 23.923 5.852 -3.511 1.00 0.00 C ATOM 2222 CG LYS B 48 25.402 5.546 -3.781 1.00 0.00 C ATOM 2223 CD LYS B 48 26.135 6.744 -4.394 1.00 0.00 C ATOM 2224 CE LYS B 48 26.068 7.992 -3.505 1.00 0.00 C ATOM 2225 NZ LYS B 48 26.893 9.081 -4.054 1.00 0.00 N ATOM 0 H LYS B 48 21.169 4.397 -3.880 1.00 0.00 H new ATOM 0 HA LYS B 48 23.253 3.890 -4.050 1.00 0.00 H new ATOM 0 HB2 LYS B 48 23.493 6.359 -4.375 1.00 0.00 H new ATOM 0 HB3 LYS B 48 23.842 6.537 -2.667 1.00 0.00 H new ATOM 0 HG2 LYS B 48 25.889 5.262 -2.848 1.00 0.00 H new ATOM 0 HG3 LYS B 48 25.478 4.692 -4.454 1.00 0.00 H new ATOM 0 HD2 LYS B 48 27.178 6.479 -4.564 1.00 0.00 H new ATOM 0 HD3 LYS B 48 25.701 6.972 -5.368 1.00 0.00 H new ATOM 0 HE2 LYS B 48 25.034 8.324 -3.417 1.00 0.00 H new ATOM 0 HE3 LYS B 48 26.409 7.745 -2.500 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 26.829 9.912 -3.432 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 27.883 8.770 -4.114 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 26.550 9.331 -5.003 1.00 0.00 H new ATOM 2239 N GLU B 49 23.669 4.409 -0.819 1.00 0.00 N ATOM 2240 CA GLU B 49 24.344 3.886 0.362 1.00 0.00 C ATOM 2241 C GLU B 49 23.582 2.694 0.958 1.00 0.00 C ATOM 2242 O GLU B 49 22.440 2.842 1.391 1.00 0.00 O ATOM 2243 CB GLU B 49 24.495 5.003 1.404 1.00 0.00 C ATOM 2244 CG GLU B 49 25.314 6.202 0.900 1.00 0.00 C ATOM 2245 CD GLU B 49 26.750 5.820 0.554 1.00 0.00 C ATOM 2246 OE1 GLU B 49 27.466 5.403 1.490 1.00 0.00 O ATOM 2247 OE2 GLU B 49 27.104 5.951 -0.637 1.00 0.00 O ATOM 0 H GLU B 49 23.192 5.295 -0.653 1.00 0.00 H new ATOM 0 HA GLU B 49 25.331 3.530 0.068 1.00 0.00 H new ATOM 0 HB2 GLU B 49 23.505 5.348 1.702 1.00 0.00 H new ATOM 0 HB3 GLU B 49 24.972 4.596 2.296 1.00 0.00 H new ATOM 0 HG2 GLU B 49 24.831 6.624 0.019 1.00 0.00 H new ATOM 0 HG3 GLU B 49 25.322 6.980 1.663 1.00 0.00 H new ATOM 2254 N GLN B 50 24.230 1.526 1.025 1.00 0.00 N ATOM 2255 CA GLN B 50 23.651 0.265 1.500 1.00 0.00 C ATOM 2256 C GLN B 50 22.990 0.446 2.870 1.00 0.00 C ATOM 2257 O GLN B 50 21.920 -0.100 3.130 1.00 0.00 O ATOM 2258 CB GLN B 50 24.709 -0.854 1.515 1.00 0.00 C ATOM 2259 CG GLN B 50 25.030 -1.379 0.102 1.00 0.00 C ATOM 2260 CD GLN B 50 25.467 -0.244 -0.816 1.00 0.00 C ATOM 2261 OE1 GLN B 50 26.387 0.499 -0.489 1.00 0.00 O ATOM 2262 NE2 GLN B 50 24.728 -0.003 -1.893 1.00 0.00 N ATOM 0 H GLN B 50 25.205 1.429 0.740 1.00 0.00 H new ATOM 0 HA GLN B 50 22.870 -0.037 0.803 1.00 0.00 H new ATOM 0 HB2 GLN B 50 25.623 -0.480 1.977 1.00 0.00 H new ATOM 0 HB3 GLN B 50 24.353 -1.678 2.134 1.00 0.00 H new ATOM 0 HG2 GLN B 50 25.819 -2.129 0.159 1.00 0.00 H new ATOM 0 HG3 GLN B 50 24.152 -1.871 -0.315 1.00 0.00 H new ATOM 0 HE21 GLN B 50 23.969 -0.637 -2.143 1.00 0.00 H new ATOM 0 HE22 GLN B 50 24.920 0.816 -2.470 1.00 0.00 H new ATOM 2271 N GLU B 51 23.606 1.260 3.729 1.00 0.00 N ATOM 2272 CA GLU B 51 23.098 1.563 5.058 1.00 0.00 C ATOM 2273 C GLU B 51 21.685 2.149 4.971 1.00 0.00 C ATOM 2274 O GLU B 51 20.818 1.812 5.774 1.00 0.00 O ATOM 2275 CB GLU B 51 24.025 2.556 5.781 1.00 0.00 C ATOM 2276 CG GLU B 51 25.521 2.208 5.703 1.00 0.00 C ATOM 2277 CD GLU B 51 26.201 2.866 4.503 1.00 0.00 C ATOM 2278 OE1 GLU B 51 26.679 4.008 4.674 1.00 0.00 O ATOM 2279 OE2 GLU B 51 26.189 2.231 3.424 1.00 0.00 O ATOM 0 H GLU B 51 24.484 1.732 3.513 1.00 0.00 H new ATOM 0 HA GLU B 51 23.065 0.633 5.626 1.00 0.00 H new ATOM 0 HB2 GLU B 51 23.874 3.549 5.357 1.00 0.00 H new ATOM 0 HB3 GLU B 51 23.732 2.609 6.830 1.00 0.00 H new ATOM 0 HG2 GLU B 51 26.016 2.528 6.620 1.00 0.00 H new ATOM 0 HG3 GLU B 51 25.639 1.126 5.638 1.00 0.00 H new ATOM 2286 N VAL B 52 21.448 3.026 3.994 1.00 0.00 N ATOM 2287 CA VAL B 52 20.163 3.685 3.832 1.00 0.00 C ATOM 2288 C VAL B 52 19.132 2.663 3.378 1.00 0.00 C ATOM 2289 O VAL B 52 18.060 2.574 3.969 1.00 0.00 O ATOM 2290 CB VAL B 52 20.277 4.847 2.837 1.00 0.00 C ATOM 2291 CG1 VAL B 52 18.918 5.520 2.602 1.00 0.00 C ATOM 2292 CG2 VAL B 52 21.276 5.892 3.341 1.00 0.00 C ATOM 0 H VAL B 52 22.143 3.295 3.298 1.00 0.00 H new ATOM 0 HA VAL B 52 19.843 4.105 4.786 1.00 0.00 H new ATOM 0 HB VAL B 52 20.629 4.431 1.893 1.00 0.00 H new ATOM 0 HG11 VAL B 52 19.035 6.339 1.892 1.00 0.00 H new ATOM 0 HG12 VAL B 52 18.215 4.790 2.201 1.00 0.00 H new ATOM 0 HG13 VAL B 52 18.537 5.910 3.546 1.00 0.00 H new ATOM 0 HG21 VAL B 52 21.343 6.708 2.622 1.00 0.00 H new ATOM 0 HG22 VAL B 52 20.941 6.282 4.302 1.00 0.00 H new ATOM 0 HG23 VAL B 52 22.257 5.431 3.459 1.00 0.00 H new ATOM 2302 N VAL B 53 19.454 1.897 2.329 1.00 0.00 N ATOM 2303 CA VAL B 53 18.552 0.869 1.820 1.00 0.00 C ATOM 2304 C VAL B 53 18.150 -0.054 2.980 1.00 0.00 C ATOM 2305 O VAL B 53 16.968 -0.307 3.217 1.00 0.00 O ATOM 2306 CB VAL B 53 19.115 0.124 0.583 1.00 0.00 C ATOM 2307 CG1 VAL B 53 20.232 0.880 -0.146 1.00 0.00 C ATOM 2308 CG2 VAL B 53 19.586 -1.309 0.856 1.00 0.00 C ATOM 0 H VAL B 53 20.334 1.973 1.819 1.00 0.00 H new ATOM 0 HA VAL B 53 17.648 1.343 1.436 1.00 0.00 H new ATOM 0 HB VAL B 53 18.242 0.073 -0.067 1.00 0.00 H new ATOM 0 HG11 VAL B 53 20.572 0.293 -0.999 1.00 0.00 H new ATOM 0 HG12 VAL B 53 19.854 1.841 -0.495 1.00 0.00 H new ATOM 0 HG13 VAL B 53 21.066 1.044 0.537 1.00 0.00 H new ATOM 0 HG21 VAL B 53 19.963 -1.750 -0.067 1.00 0.00 H new ATOM 0 HG22 VAL B 53 20.380 -1.295 1.603 1.00 0.00 H new ATOM 0 HG23 VAL B 53 18.750 -1.902 1.226 1.00 0.00 H new ATOM 2318 N ASP B 54 19.159 -0.506 3.731 1.00 0.00 N ATOM 2319 CA ASP B 54 18.969 -1.346 4.895 1.00 0.00 C ATOM 2320 C ASP B 54 18.062 -0.652 5.915 1.00 0.00 C ATOM 2321 O ASP B 54 17.127 -1.269 6.410 1.00 0.00 O ATOM 2322 CB ASP B 54 20.321 -1.710 5.513 1.00 0.00 C ATOM 2323 CG ASP B 54 20.130 -2.642 6.704 1.00 0.00 C ATOM 2324 OD1 ASP B 54 19.905 -3.844 6.449 1.00 0.00 O ATOM 2325 OD2 ASP B 54 20.203 -2.132 7.843 1.00 0.00 O ATOM 0 H ASP B 54 20.137 -0.291 3.537 1.00 0.00 H new ATOM 0 HA ASP B 54 18.479 -2.269 4.586 1.00 0.00 H new ATOM 0 HB2 ASP B 54 20.952 -2.191 4.765 1.00 0.00 H new ATOM 0 HB3 ASP B 54 20.838 -0.805 5.831 1.00 0.00 H new ATOM 2330 N LYS B 55 18.307 0.623 6.232 1.00 0.00 N ATOM 2331 CA LYS B 55 17.487 1.337 7.203 1.00 0.00 C ATOM 2332 C LYS B 55 16.033 1.402 6.743 1.00 0.00 C ATOM 2333 O LYS B 55 15.132 1.090 7.523 1.00 0.00 O ATOM 2334 CB LYS B 55 18.049 2.744 7.461 1.00 0.00 C ATOM 2335 CG LYS B 55 17.251 3.518 8.529 1.00 0.00 C ATOM 2336 CD LYS B 55 16.126 4.395 7.945 1.00 0.00 C ATOM 2337 CE LYS B 55 15.405 5.202 9.033 1.00 0.00 C ATOM 2338 NZ LYS B 55 16.287 6.196 9.674 1.00 0.00 N ATOM 0 H LYS B 55 19.064 1.176 5.830 1.00 0.00 H new ATOM 0 HA LYS B 55 17.516 0.786 8.143 1.00 0.00 H new ATOM 0 HB2 LYS B 55 19.089 2.663 7.778 1.00 0.00 H new ATOM 0 HB3 LYS B 55 18.044 3.309 6.529 1.00 0.00 H new ATOM 0 HG2 LYS B 55 16.818 2.807 9.233 1.00 0.00 H new ATOM 0 HG3 LYS B 55 17.936 4.150 9.095 1.00 0.00 H new ATOM 0 HD2 LYS B 55 16.545 5.077 7.205 1.00 0.00 H new ATOM 0 HD3 LYS B 55 15.406 3.763 7.425 1.00 0.00 H new ATOM 0 HE2 LYS B 55 14.546 5.711 8.595 1.00 0.00 H new ATOM 0 HE3 LYS B 55 15.019 4.521 9.791 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 15.720 6.826 10.276 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 16.996 5.707 10.256 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 16.768 6.757 8.942 1.00 0.00 H new ATOM 2352 N VAL B 56 15.780 1.831 5.503 1.00 0.00 N ATOM 2353 CA VAL B 56 14.404 2.009 5.055 1.00 0.00 C ATOM 2354 C VAL B 56 13.689 0.657 5.012 1.00 0.00 C ATOM 2355 O VAL B 56 12.545 0.563 5.450 1.00 0.00 O ATOM 2356 CB VAL B 56 14.281 2.832 3.757 1.00 0.00 C ATOM 2357 CG1 VAL B 56 14.906 4.225 3.922 1.00 0.00 C ATOM 2358 CG2 VAL B 56 14.879 2.146 2.530 1.00 0.00 C ATOM 0 H VAL B 56 16.493 2.056 4.809 1.00 0.00 H new ATOM 0 HA VAL B 56 13.886 2.625 5.790 1.00 0.00 H new ATOM 0 HB VAL B 56 13.210 2.924 3.579 1.00 0.00 H new ATOM 0 HG11 VAL B 56 14.804 4.782 2.991 1.00 0.00 H new ATOM 0 HG12 VAL B 56 14.396 4.760 4.723 1.00 0.00 H new ATOM 0 HG13 VAL B 56 15.962 4.123 4.170 1.00 0.00 H new ATOM 0 HG21 VAL B 56 14.753 2.787 1.657 1.00 0.00 H new ATOM 0 HG22 VAL B 56 15.941 1.963 2.696 1.00 0.00 H new ATOM 0 HG23 VAL B 56 14.370 1.197 2.359 1.00 0.00 H new ATOM 2368 N MET B 57 14.361 -0.406 4.556 1.00 0.00 N ATOM 2369 CA MET B 57 13.753 -1.728 4.610 1.00 0.00 C ATOM 2370 C MET B 57 13.480 -2.116 6.070 1.00 0.00 C ATOM 2371 O MET B 57 12.353 -2.451 6.422 1.00 0.00 O ATOM 2372 CB MET B 57 14.564 -2.754 3.799 1.00 0.00 C ATOM 2373 CG MET B 57 15.466 -3.692 4.612 1.00 0.00 C ATOM 2374 SD MET B 57 16.509 -4.802 3.645 1.00 0.00 S ATOM 2375 CE MET B 57 15.279 -5.521 2.540 1.00 0.00 C ATOM 0 H MET B 57 15.299 -0.375 4.157 1.00 0.00 H new ATOM 0 HA MET B 57 12.780 -1.713 4.119 1.00 0.00 H new ATOM 0 HB2 MET B 57 13.868 -3.362 3.221 1.00 0.00 H new ATOM 0 HB3 MET B 57 15.185 -2.214 3.085 1.00 0.00 H new ATOM 0 HG2 MET B 57 16.107 -3.086 5.252 1.00 0.00 H new ATOM 0 HG3 MET B 57 14.837 -4.293 5.268 1.00 0.00 H new ATOM 0 HE1 MET B 57 15.653 -6.466 2.145 1.00 0.00 H new ATOM 0 HE2 MET B 57 14.355 -5.698 3.090 1.00 0.00 H new ATOM 0 HE3 MET B 57 15.085 -4.835 1.716 1.00 0.00 H new ATOM 2385 N GLU B 58 14.493 -2.002 6.936 1.00 0.00 N ATOM 2386 CA GLU B 58 14.423 -2.365 8.347 1.00 0.00 C ATOM 2387 C GLU B 58 13.231 -1.679 9.008 1.00 0.00 C ATOM 2388 O GLU B 58 12.458 -2.314 9.719 1.00 0.00 O ATOM 2389 CB GLU B 58 15.742 -1.991 9.037 1.00 0.00 C ATOM 2390 CG GLU B 58 15.713 -2.305 10.535 1.00 0.00 C ATOM 2391 CD GLU B 58 17.087 -2.098 11.163 1.00 0.00 C ATOM 2392 OE1 GLU B 58 17.463 -0.916 11.319 1.00 0.00 O ATOM 2393 OE2 GLU B 58 17.735 -3.122 11.473 1.00 0.00 O ATOM 0 H GLU B 58 15.408 -1.644 6.662 1.00 0.00 H new ATOM 0 HA GLU B 58 14.279 -3.441 8.444 1.00 0.00 H new ATOM 0 HB2 GLU B 58 16.563 -2.534 8.568 1.00 0.00 H new ATOM 0 HB3 GLU B 58 15.938 -0.929 8.893 1.00 0.00 H new ATOM 0 HG2 GLU B 58 14.983 -1.665 11.030 1.00 0.00 H new ATOM 0 HG3 GLU B 58 15.390 -3.335 10.688 1.00 0.00 H new ATOM 2400 N THR B 59 13.045 -0.398 8.700 1.00 0.00 N ATOM 2401 CA THR B 59 11.955 0.416 9.214 1.00 0.00 C ATOM 2402 C THR B 59 10.590 -0.226 8.920 1.00 0.00 C ATOM 2403 O THR B 59 9.673 -0.074 9.724 1.00 0.00 O ATOM 2404 CB THR B 59 12.082 1.832 8.620 1.00 0.00 C ATOM 2405 OG1 THR B 59 13.283 2.423 9.076 1.00 0.00 O ATOM 2406 CG2 THR B 59 10.917 2.761 8.974 1.00 0.00 C ATOM 0 H THR B 59 13.665 0.112 8.071 1.00 0.00 H new ATOM 0 HA THR B 59 12.021 0.484 10.300 1.00 0.00 H new ATOM 0 HB THR B 59 12.075 1.710 7.537 1.00 0.00 H new ATOM 0 HG1 THR B 59 14.043 2.031 8.597 1.00 0.00 H new ATOM 0 HG21 THR B 59 11.080 3.738 8.519 1.00 0.00 H new ATOM 0 HG22 THR B 59 9.986 2.336 8.598 1.00 0.00 H new ATOM 0 HG23 THR B 59 10.855 2.870 10.057 1.00 0.00 H new ATOM 2414 N LEU B 60 10.438 -0.941 7.797 1.00 0.00 N ATOM 2415 CA LEU B 60 9.214 -1.672 7.473 1.00 0.00 C ATOM 2416 C LEU B 60 9.352 -3.186 7.693 1.00 0.00 C ATOM 2417 O LEU B 60 8.400 -3.916 7.431 1.00 0.00 O ATOM 2418 CB LEU B 60 8.785 -1.388 6.022 1.00 0.00 C ATOM 2419 CG LEU B 60 8.281 0.032 5.702 1.00 0.00 C ATOM 2420 CD1 LEU B 60 7.306 0.557 6.761 1.00 0.00 C ATOM 2421 CD2 LEU B 60 9.407 1.040 5.458 1.00 0.00 C ATOM 0 H LEU B 60 11.166 -1.026 7.088 1.00 0.00 H new ATOM 0 HA LEU B 60 8.445 -1.315 8.158 1.00 0.00 H new ATOM 0 HB2 LEU B 60 9.633 -1.600 5.371 1.00 0.00 H new ATOM 0 HB3 LEU B 60 7.997 -2.094 5.758 1.00 0.00 H new ATOM 0 HG LEU B 60 7.739 -0.069 4.762 1.00 0.00 H new ATOM 0 HD11 LEU B 60 6.980 1.561 6.490 1.00 0.00 H new ATOM 0 HD12 LEU B 60 6.440 -0.103 6.817 1.00 0.00 H new ATOM 0 HD13 LEU B 60 7.803 0.587 7.731 1.00 0.00 H new ATOM 0 HD21 LEU B 60 8.979 2.018 5.239 1.00 0.00 H new ATOM 0 HD22 LEU B 60 10.032 1.109 6.348 1.00 0.00 H new ATOM 0 HD23 LEU B 60 10.013 0.711 4.613 1.00 0.00 H new ATOM 2433 N ASP B 61 10.500 -3.695 8.146 1.00 0.00 N ATOM 2434 CA ASP B 61 10.776 -5.129 8.171 1.00 0.00 C ATOM 2435 C ASP B 61 10.025 -5.850 9.296 1.00 0.00 C ATOM 2436 O ASP B 61 10.635 -6.327 10.252 1.00 0.00 O ATOM 2437 CB ASP B 61 12.292 -5.363 8.248 1.00 0.00 C ATOM 2438 CG ASP B 61 12.683 -6.841 8.220 1.00 0.00 C ATOM 2439 OD1 ASP B 61 11.880 -7.652 7.710 1.00 0.00 O ATOM 2440 OD2 ASP B 61 13.785 -7.147 8.724 1.00 0.00 O ATOM 0 H ASP B 61 11.264 -3.122 8.506 1.00 0.00 H new ATOM 0 HA ASP B 61 10.403 -5.563 7.243 1.00 0.00 H new ATOM 0 HB2 ASP B 61 12.773 -4.852 7.414 1.00 0.00 H new ATOM 0 HB3 ASP B 61 12.675 -4.911 9.163 1.00 0.00 H new ATOM 2445 N SER B 62 8.706 -5.994 9.144 1.00 0.00 N ATOM 2446 CA SER B 62 7.846 -6.783 10.020 1.00 0.00 C ATOM 2447 C SER B 62 8.426 -8.177 10.267 1.00 0.00 C ATOM 2448 O SER B 62 8.319 -8.716 11.366 1.00 0.00 O ATOM 2449 CB SER B 62 6.457 -6.899 9.386 1.00 0.00 C ATOM 2450 OG SER B 62 6.547 -7.605 8.164 1.00 0.00 O ATOM 0 H SER B 62 8.194 -5.549 8.382 1.00 0.00 H new ATOM 0 HA SER B 62 7.777 -6.279 10.984 1.00 0.00 H new ATOM 0 HB2 SER B 62 5.779 -7.415 10.066 1.00 0.00 H new ATOM 0 HB3 SER B 62 6.042 -5.906 9.213 1.00 0.00 H new ATOM 0 HG SER B 62 5.664 -7.956 7.923 1.00 0.00 H new ATOM 2456 N ASP B 63 9.050 -8.754 9.235 1.00 0.00 N ATOM 2457 CA ASP B 63 9.574 -10.109 9.271 1.00 0.00 C ATOM 2458 C ASP B 63 10.818 -10.201 10.157 1.00 0.00 C ATOM 2459 O ASP B 63 11.221 -11.305 10.514 1.00 0.00 O ATOM 2460 CB ASP B 63 9.966 -10.550 7.849 1.00 0.00 C ATOM 2461 CG ASP B 63 8.860 -10.341 6.822 1.00 0.00 C ATOM 2462 OD1 ASP B 63 8.802 -9.219 6.268 1.00 0.00 O ATOM 2463 OD2 ASP B 63 8.098 -11.308 6.606 1.00 0.00 O ATOM 0 H ASP B 63 9.203 -8.282 8.344 1.00 0.00 H new ATOM 0 HA ASP B 63 8.795 -10.754 9.678 1.00 0.00 H new ATOM 0 HB2 ASP B 63 10.851 -9.996 7.536 1.00 0.00 H new ATOM 0 HB3 ASP B 63 10.240 -11.605 7.867 1.00 0.00 H new ATOM 2468 N GLY B 64 11.444 -9.064 10.491 1.00 0.00 N ATOM 2469 CA GLY B 64 12.708 -9.015 11.212 1.00 0.00 C ATOM 2470 C GLY B 64 13.764 -9.930 10.586 1.00 0.00 C ATOM 2471 O GLY B 64 14.598 -10.479 11.300 1.00 0.00 O ATOM 0 H GLY B 64 11.074 -8.142 10.261 1.00 0.00 H new ATOM 0 HA2 GLY B 64 13.078 -7.990 11.224 1.00 0.00 H new ATOM 0 HA3 GLY B 64 12.545 -9.307 12.249 1.00 0.00 H new ATOM 2475 N ASP B 65 13.715 -10.114 9.260 1.00 0.00 N ATOM 2476 CA ASP B 65 14.529 -11.079 8.533 1.00 0.00 C ATOM 2477 C ASP B 65 15.431 -10.353 7.534 1.00 0.00 C ATOM 2478 O ASP B 65 15.980 -10.966 6.624 1.00 0.00 O ATOM 2479 CB ASP B 65 13.575 -12.059 7.831 1.00 0.00 C ATOM 2480 CG ASP B 65 14.281 -13.251 7.188 1.00 0.00 C ATOM 2481 OD1 ASP B 65 15.247 -13.753 7.805 1.00 0.00 O ATOM 2482 OD2 ASP B 65 13.811 -13.664 6.106 1.00 0.00 O ATOM 0 H ASP B 65 13.091 -9.580 8.655 1.00 0.00 H new ATOM 0 HA ASP B 65 15.181 -11.632 9.209 1.00 0.00 H new ATOM 0 HB2 ASP B 65 12.848 -12.426 8.556 1.00 0.00 H new ATOM 0 HB3 ASP B 65 13.017 -11.522 7.064 1.00 0.00 H new ATOM 2487 N GLY B 66 15.547 -9.028 7.661 1.00 0.00 N ATOM 2488 CA GLY B 66 16.186 -8.196 6.662 1.00 0.00 C ATOM 2489 C GLY B 66 15.262 -8.091 5.456 1.00 0.00 C ATOM 2490 O GLY B 66 14.617 -7.064 5.249 1.00 0.00 O ATOM 0 H GLY B 66 15.196 -8.509 8.466 1.00 0.00 H new ATOM 0 HA2 GLY B 66 16.391 -7.206 7.069 1.00 0.00 H new ATOM 0 HA3 GLY B 66 17.144 -8.625 6.369 1.00 0.00 H new ATOM 2494 N GLU B 67 15.186 -9.172 4.678 1.00 0.00 N ATOM 2495 CA GLU B 67 14.365 -9.231 3.482 1.00 0.00 C ATOM 2496 C GLU B 67 12.908 -8.898 3.813 1.00 0.00 C ATOM 2497 O GLU B 67 12.310 -9.491 4.711 1.00 0.00 O ATOM 2498 CB GLU B 67 14.517 -10.548 2.699 1.00 0.00 C ATOM 2499 CG GLU B 67 14.610 -11.809 3.569 1.00 0.00 C ATOM 2500 CD GLU B 67 16.053 -12.223 3.868 1.00 0.00 C ATOM 2501 OE1 GLU B 67 16.919 -11.319 3.891 1.00 0.00 O ATOM 2502 OE2 GLU B 67 16.273 -13.441 4.034 1.00 0.00 O ATOM 0 H GLU B 67 15.698 -10.033 4.867 1.00 0.00 H new ATOM 0 HA GLU B 67 14.734 -8.465 2.800 1.00 0.00 H new ATOM 0 HB2 GLU B 67 13.668 -10.652 2.023 1.00 0.00 H new ATOM 0 HB3 GLU B 67 15.412 -10.485 2.080 1.00 0.00 H new ATOM 0 HG2 GLU B 67 14.085 -11.635 4.509 1.00 0.00 H new ATOM 0 HG3 GLU B 67 14.099 -12.630 3.066 1.00 0.00 H new ATOM 2509 N CYS B 68 12.362 -7.918 3.093 1.00 0.00 N ATOM 2510 CA CYS B 68 11.074 -7.307 3.384 1.00 0.00 C ATOM 2511 C CYS B 68 9.997 -7.954 2.532 1.00 0.00 C ATOM 2512 O CYS B 68 10.158 -8.083 1.319 1.00 0.00 O ATOM 2513 CB CYS B 68 11.146 -5.802 3.113 1.00 0.00 C ATOM 2514 SG CYS B 68 11.803 -5.002 4.590 1.00 0.00 S ATOM 0 H CYS B 68 12.818 -7.520 2.272 1.00 0.00 H new ATOM 0 HA CYS B 68 10.825 -7.460 4.434 1.00 0.00 H new ATOM 0 HB2 CYS B 68 11.785 -5.599 2.253 1.00 0.00 H new ATOM 0 HB3 CYS B 68 10.157 -5.410 2.875 1.00 0.00 H new ATOM 0 HG CYS B 68 12.877 -5.623 4.979 1.00 0.00 H new ATOM 2520 N ASP B 69 8.902 -8.370 3.171 1.00 0.00 N ATOM 2521 CA ASP B 69 7.831 -9.089 2.514 1.00 0.00 C ATOM 2522 C ASP B 69 7.096 -8.182 1.531 1.00 0.00 C ATOM 2523 O ASP B 69 7.130 -6.956 1.671 1.00 0.00 O ATOM 2524 CB ASP B 69 6.901 -9.660 3.592 1.00 0.00 C ATOM 2525 CG ASP B 69 5.877 -10.631 3.031 1.00 0.00 C ATOM 2526 OD1 ASP B 69 4.827 -10.145 2.558 1.00 0.00 O ATOM 2527 OD2 ASP B 69 6.171 -11.846 3.072 1.00 0.00 O ATOM 0 H ASP B 69 8.741 -8.212 4.166 1.00 0.00 H new ATOM 0 HA ASP B 69 8.231 -9.915 1.925 1.00 0.00 H new ATOM 0 HB2 ASP B 69 7.499 -10.167 4.350 1.00 0.00 H new ATOM 0 HB3 ASP B 69 6.383 -8.840 4.090 1.00 0.00 H new ATOM 2532 N PHE B 70 6.366 -8.787 0.588 1.00 0.00 N ATOM 2533 CA PHE B 70 5.464 -8.057 -0.294 1.00 0.00 C ATOM 2534 C PHE B 70 4.605 -7.088 0.517 1.00 0.00 C ATOM 2535 O PHE B 70 4.491 -5.922 0.154 1.00 0.00 O ATOM 2536 CB PHE B 70 4.590 -9.031 -1.098 1.00 0.00 C ATOM 2537 CG PHE B 70 3.614 -8.328 -2.031 1.00 0.00 C ATOM 2538 CD1 PHE B 70 2.430 -7.753 -1.531 1.00 0.00 C ATOM 2539 CD2 PHE B 70 3.955 -8.130 -3.379 1.00 0.00 C ATOM 2540 CE1 PHE B 70 1.671 -6.887 -2.335 1.00 0.00 C ATOM 2541 CE2 PHE B 70 3.202 -7.264 -4.187 1.00 0.00 C ATOM 2542 CZ PHE B 70 2.085 -6.604 -3.650 1.00 0.00 C ATOM 0 H PHE B 70 6.387 -9.793 0.419 1.00 0.00 H new ATOM 0 HA PHE B 70 6.057 -7.478 -1.002 1.00 0.00 H new ATOM 0 HB2 PHE B 70 5.233 -9.688 -1.683 1.00 0.00 H new ATOM 0 HB3 PHE B 70 4.032 -9.663 -0.408 1.00 0.00 H new ATOM 0 HD1 PHE B 70 2.105 -7.979 -0.526 1.00 0.00 H new ATOM 0 HD2 PHE B 70 4.805 -8.649 -3.798 1.00 0.00 H new ATOM 0 HE1 PHE B 70 0.770 -6.438 -1.944 1.00 0.00 H new ATOM 0 HE2 PHE B 70 3.481 -7.106 -5.218 1.00 0.00 H new ATOM 0 HZ PHE B 70 1.545 -5.881 -4.244 1.00 0.00 H new ATOM 2552 N GLN B 71 4.047 -7.541 1.643 1.00 0.00 N ATOM 2553 CA GLN B 71 3.247 -6.691 2.517 1.00 0.00 C ATOM 2554 C GLN B 71 3.994 -5.406 2.899 1.00 0.00 C ATOM 2555 O GLN B 71 3.414 -4.323 2.899 1.00 0.00 O ATOM 2556 CB GLN B 71 2.837 -7.474 3.770 1.00 0.00 C ATOM 2557 CG GLN B 71 1.935 -8.660 3.409 1.00 0.00 C ATOM 2558 CD GLN B 71 1.476 -9.414 4.651 1.00 0.00 C ATOM 2559 OE1 GLN B 71 2.007 -10.470 4.980 1.00 0.00 O ATOM 2560 NE2 GLN B 71 0.480 -8.882 5.353 1.00 0.00 N ATOM 0 H GLN B 71 4.139 -8.503 1.970 1.00 0.00 H new ATOM 0 HA GLN B 71 2.351 -6.392 1.973 1.00 0.00 H new ATOM 0 HB2 GLN B 71 3.728 -7.834 4.285 1.00 0.00 H new ATOM 0 HB3 GLN B 71 2.314 -6.813 4.461 1.00 0.00 H new ATOM 0 HG2 GLN B 71 1.065 -8.302 2.858 1.00 0.00 H new ATOM 0 HG3 GLN B 71 2.473 -9.340 2.748 1.00 0.00 H new ATOM 0 HE21 GLN B 71 0.058 -8.002 5.054 1.00 0.00 H new ATOM 0 HE22 GLN B 71 0.137 -9.353 6.190 1.00 0.00 H new ATOM 2569 N GLU B 72 5.283 -5.517 3.224 1.00 0.00 N ATOM 2570 CA GLU B 72 6.076 -4.393 3.701 1.00 0.00 C ATOM 2571 C GLU B 72 6.455 -3.475 2.542 1.00 0.00 C ATOM 2572 O GLU B 72 6.396 -2.251 2.659 1.00 0.00 O ATOM 2573 CB GLU B 72 7.293 -4.924 4.464 1.00 0.00 C ATOM 2574 CG GLU B 72 6.893 -5.919 5.564 1.00 0.00 C ATOM 2575 CD GLU B 72 5.658 -5.496 6.361 1.00 0.00 C ATOM 2576 OE1 GLU B 72 5.621 -4.335 6.821 1.00 0.00 O ATOM 2577 OE2 GLU B 72 4.765 -6.361 6.507 1.00 0.00 O ATOM 0 H GLU B 72 5.803 -6.392 3.162 1.00 0.00 H new ATOM 0 HA GLU B 72 5.491 -3.786 4.392 1.00 0.00 H new ATOM 0 HB2 GLU B 72 7.975 -5.410 3.766 1.00 0.00 H new ATOM 0 HB3 GLU B 72 7.834 -4.089 4.909 1.00 0.00 H new ATOM 0 HG2 GLU B 72 6.705 -6.892 5.110 1.00 0.00 H new ATOM 0 HG3 GLU B 72 7.731 -6.044 6.250 1.00 0.00 H new ATOM 2584 N PHE B 73 6.796 -4.074 1.400 1.00 0.00 N ATOM 2585 CA PHE B 73 6.963 -3.339 0.153 1.00 0.00 C ATOM 2586 C PHE B 73 5.707 -2.494 -0.088 1.00 0.00 C ATOM 2587 O PHE B 73 5.787 -1.283 -0.287 1.00 0.00 O ATOM 2588 CB PHE B 73 7.232 -4.344 -0.980 1.00 0.00 C ATOM 2589 CG PHE B 73 6.752 -3.946 -2.367 1.00 0.00 C ATOM 2590 CD1 PHE B 73 7.577 -3.169 -3.202 1.00 0.00 C ATOM 2591 CD2 PHE B 73 5.524 -4.434 -2.863 1.00 0.00 C ATOM 2592 CE1 PHE B 73 7.203 -2.933 -4.537 1.00 0.00 C ATOM 2593 CE2 PHE B 73 5.137 -4.163 -4.187 1.00 0.00 C ATOM 2594 CZ PHE B 73 5.996 -3.445 -5.037 1.00 0.00 C ATOM 0 H PHE B 73 6.963 -5.077 1.317 1.00 0.00 H new ATOM 0 HA PHE B 73 7.814 -2.659 0.196 1.00 0.00 H new ATOM 0 HB2 PHE B 73 8.306 -4.524 -1.029 1.00 0.00 H new ATOM 0 HB3 PHE B 73 6.762 -5.291 -0.715 1.00 0.00 H new ATOM 0 HD1 PHE B 73 8.497 -2.754 -2.817 1.00 0.00 H new ATOM 0 HD2 PHE B 73 4.879 -5.018 -2.223 1.00 0.00 H new ATOM 0 HE1 PHE B 73 7.849 -2.354 -5.181 1.00 0.00 H new ATOM 0 HE2 PHE B 73 4.180 -4.506 -4.551 1.00 0.00 H new ATOM 0 HZ PHE B 73 5.728 -3.288 -6.071 1.00 0.00 H new ATOM 2604 N MET B 74 4.537 -3.129 -0.013 1.00 0.00 N ATOM 2605 CA MET B 74 3.273 -2.468 -0.264 1.00 0.00 C ATOM 2606 C MET B 74 2.984 -1.402 0.797 1.00 0.00 C ATOM 2607 O MET B 74 2.487 -0.330 0.476 1.00 0.00 O ATOM 2608 CB MET B 74 2.153 -3.502 -0.433 1.00 0.00 C ATOM 2609 CG MET B 74 1.200 -3.092 -1.561 1.00 0.00 C ATOM 2610 SD MET B 74 0.161 -1.642 -1.250 1.00 0.00 S ATOM 2611 CE MET B 74 -0.759 -1.610 -2.798 1.00 0.00 C ATOM 0 H MET B 74 4.448 -4.117 0.224 1.00 0.00 H new ATOM 0 HA MET B 74 3.331 -1.925 -1.208 1.00 0.00 H new ATOM 0 HB2 MET B 74 2.584 -4.479 -0.652 1.00 0.00 H new ATOM 0 HB3 MET B 74 1.598 -3.600 0.500 1.00 0.00 H new ATOM 0 HG2 MET B 74 1.792 -2.902 -2.456 1.00 0.00 H new ATOM 0 HG3 MET B 74 0.549 -3.938 -1.782 1.00 0.00 H new ATOM 0 HE1 MET B 74 -1.681 -1.045 -2.662 1.00 0.00 H new ATOM 0 HE2 MET B 74 -0.154 -1.136 -3.571 1.00 0.00 H new ATOM 0 HE3 MET B 74 -1.000 -2.629 -3.099 1.00 0.00 H new ATOM 2621 N ALA B 75 3.333 -1.657 2.057 1.00 0.00 N ATOM 2622 CA ALA B 75 3.242 -0.649 3.111 1.00 0.00 C ATOM 2623 C ALA B 75 4.092 0.582 2.771 1.00 0.00 C ATOM 2624 O ALA B 75 3.649 1.720 2.939 1.00 0.00 O ATOM 2625 CB ALA B 75 3.649 -1.249 4.461 1.00 0.00 C ATOM 0 H ALA B 75 3.684 -2.561 2.374 1.00 0.00 H new ATOM 0 HA ALA B 75 2.205 -0.321 3.184 1.00 0.00 H new ATOM 0 HB1 ALA B 75 3.576 -0.485 5.235 1.00 0.00 H new ATOM 0 HB2 ALA B 75 2.985 -2.078 4.705 1.00 0.00 H new ATOM 0 HB3 ALA B 75 4.676 -1.610 4.404 1.00 0.00 H new ATOM 2631 N PHE B 76 5.313 0.368 2.271 1.00 0.00 N ATOM 2632 CA PHE B 76 6.175 1.467 1.852 1.00 0.00 C ATOM 2633 C PHE B 76 5.510 2.217 0.693 1.00 0.00 C ATOM 2634 O PHE B 76 5.333 3.435 0.738 1.00 0.00 O ATOM 2635 CB PHE B 76 7.575 0.950 1.508 1.00 0.00 C ATOM 2636 CG PHE B 76 8.494 1.994 0.909 1.00 0.00 C ATOM 2637 CD1 PHE B 76 9.091 2.979 1.722 1.00 0.00 C ATOM 2638 CD2 PHE B 76 8.758 1.965 -0.473 1.00 0.00 C ATOM 2639 CE1 PHE B 76 9.964 3.920 1.144 1.00 0.00 C ATOM 2640 CE2 PHE B 76 9.636 2.899 -1.042 1.00 0.00 C ATOM 2641 CZ PHE B 76 10.239 3.878 -0.236 1.00 0.00 C ATOM 0 H PHE B 76 5.723 -0.558 2.148 1.00 0.00 H new ATOM 0 HA PHE B 76 6.306 2.176 2.669 1.00 0.00 H new ATOM 0 HB2 PHE B 76 8.036 0.553 2.413 1.00 0.00 H new ATOM 0 HB3 PHE B 76 7.481 0.120 0.808 1.00 0.00 H new ATOM 0 HD1 PHE B 76 8.880 3.011 2.781 1.00 0.00 H new ATOM 0 HD2 PHE B 76 8.283 1.222 -1.097 1.00 0.00 H new ATOM 0 HE1 PHE B 76 10.424 4.677 1.762 1.00 0.00 H new ATOM 0 HE2 PHE B 76 9.848 2.865 -2.100 1.00 0.00 H new ATOM 0 HZ PHE B 76 10.913 4.598 -0.675 1.00 0.00 H new ATOM 2651 N VAL B 77 5.071 1.483 -0.330 1.00 0.00 N ATOM 2652 CA VAL B 77 4.302 2.060 -1.423 1.00 0.00 C ATOM 2653 C VAL B 77 3.106 2.864 -0.886 1.00 0.00 C ATOM 2654 O VAL B 77 2.837 3.956 -1.382 1.00 0.00 O ATOM 2655 CB VAL B 77 3.888 0.956 -2.408 1.00 0.00 C ATOM 2656 CG1 VAL B 77 2.873 1.459 -3.443 1.00 0.00 C ATOM 2657 CG2 VAL B 77 5.112 0.411 -3.156 1.00 0.00 C ATOM 0 H VAL B 77 5.239 0.481 -0.421 1.00 0.00 H new ATOM 0 HA VAL B 77 4.923 2.768 -1.972 1.00 0.00 H new ATOM 0 HB VAL B 77 3.425 0.168 -1.814 1.00 0.00 H new ATOM 0 HG11 VAL B 77 2.609 0.645 -4.119 1.00 0.00 H new ATOM 0 HG12 VAL B 77 1.977 1.812 -2.932 1.00 0.00 H new ATOM 0 HG13 VAL B 77 3.311 2.277 -4.014 1.00 0.00 H new ATOM 0 HG21 VAL B 77 4.797 -0.370 -3.849 1.00 0.00 H new ATOM 0 HG22 VAL B 77 5.588 1.219 -3.712 1.00 0.00 H new ATOM 0 HG23 VAL B 77 5.821 -0.004 -2.440 1.00 0.00 H new ATOM 2667 N ALA B 78 2.391 2.363 0.126 1.00 0.00 N ATOM 2668 CA ALA B 78 1.237 3.047 0.693 1.00 0.00 C ATOM 2669 C ALA B 78 1.623 4.432 1.203 1.00 0.00 C ATOM 2670 O ALA B 78 1.002 5.416 0.798 1.00 0.00 O ATOM 2671 CB ALA B 78 0.575 2.211 1.795 1.00 0.00 C ATOM 0 H ALA B 78 2.601 1.470 0.572 1.00 0.00 H new ATOM 0 HA ALA B 78 0.502 3.175 -0.102 1.00 0.00 H new ATOM 0 HB1 ALA B 78 -0.282 2.751 2.196 1.00 0.00 H new ATOM 0 HB2 ALA B 78 0.243 1.260 1.380 1.00 0.00 H new ATOM 0 HB3 ALA B 78 1.294 2.027 2.594 1.00 0.00 H new ATOM 2677 N MET B 79 2.650 4.535 2.058 1.00 0.00 N ATOM 2678 CA MET B 79 3.084 5.844 2.550 1.00 0.00 C ATOM 2679 C MET B 79 3.493 6.754 1.386 1.00 0.00 C ATOM 2680 O MET B 79 3.070 7.907 1.322 1.00 0.00 O ATOM 2681 CB MET B 79 4.167 5.752 3.643 1.00 0.00 C ATOM 2682 CG MET B 79 5.409 4.951 3.244 1.00 0.00 C ATOM 2683 SD MET B 79 6.836 4.978 4.357 1.00 0.00 S ATOM 2684 CE MET B 79 6.116 4.218 5.823 1.00 0.00 C ATOM 0 H MET B 79 3.185 3.743 2.416 1.00 0.00 H new ATOM 0 HA MET B 79 2.226 6.303 3.042 1.00 0.00 H new ATOM 0 HB2 MET B 79 4.474 6.761 3.917 1.00 0.00 H new ATOM 0 HB3 MET B 79 3.729 5.299 4.533 1.00 0.00 H new ATOM 0 HG2 MET B 79 5.108 3.912 3.114 1.00 0.00 H new ATOM 0 HG3 MET B 79 5.739 5.312 2.270 1.00 0.00 H new ATOM 0 HE1 MET B 79 6.893 4.062 6.571 1.00 0.00 H new ATOM 0 HE2 MET B 79 5.346 4.873 6.231 1.00 0.00 H new ATOM 0 HE3 MET B 79 5.672 3.259 5.555 1.00 0.00 H new ATOM 2694 N ILE B 80 4.291 6.230 0.451 1.00 0.00 N ATOM 2695 CA ILE B 80 4.798 6.987 -0.689 1.00 0.00 C ATOM 2696 C ILE B 80 3.634 7.583 -1.490 1.00 0.00 C ATOM 2697 O ILE B 80 3.607 8.784 -1.781 1.00 0.00 O ATOM 2698 CB ILE B 80 5.677 6.045 -1.538 1.00 0.00 C ATOM 2699 CG1 ILE B 80 6.970 5.648 -0.798 1.00 0.00 C ATOM 2700 CG2 ILE B 80 5.986 6.594 -2.935 1.00 0.00 C ATOM 2701 CD1 ILE B 80 8.033 6.743 -0.726 1.00 0.00 C ATOM 0 H ILE B 80 4.604 5.259 0.468 1.00 0.00 H new ATOM 0 HA ILE B 80 5.407 7.828 -0.358 1.00 0.00 H new ATOM 0 HB ILE B 80 5.081 5.145 -1.688 1.00 0.00 H new ATOM 0 HG12 ILE B 80 6.712 5.345 0.217 1.00 0.00 H new ATOM 0 HG13 ILE B 80 7.400 4.776 -1.291 1.00 0.00 H new ATOM 0 HG21 ILE B 80 6.608 5.881 -3.477 1.00 0.00 H new ATOM 0 HG22 ILE B 80 5.054 6.750 -3.479 1.00 0.00 H new ATOM 0 HG23 ILE B 80 6.516 7.542 -2.844 1.00 0.00 H new ATOM 0 HD11 ILE B 80 8.904 6.370 -0.187 1.00 0.00 H new ATOM 0 HD12 ILE B 80 8.327 7.032 -1.735 1.00 0.00 H new ATOM 0 HD13 ILE B 80 7.628 7.610 -0.204 1.00 0.00 H new ATOM 2713 N THR B 81 2.677 6.724 -1.845 1.00 0.00 N ATOM 2714 CA THR B 81 1.499 7.092 -2.613 1.00 0.00 C ATOM 2715 C THR B 81 0.675 8.109 -1.826 1.00 0.00 C ATOM 2716 O THR B 81 0.303 9.147 -2.366 1.00 0.00 O ATOM 2717 CB THR B 81 0.666 5.837 -2.926 1.00 0.00 C ATOM 2718 OG1 THR B 81 1.466 4.859 -3.553 1.00 0.00 O ATOM 2719 CG2 THR B 81 -0.493 6.150 -3.872 1.00 0.00 C ATOM 0 H THR B 81 2.705 5.735 -1.599 1.00 0.00 H new ATOM 0 HA THR B 81 1.803 7.545 -3.557 1.00 0.00 H new ATOM 0 HB THR B 81 0.278 5.475 -1.974 1.00 0.00 H new ATOM 0 HG1 THR B 81 1.919 4.321 -2.871 1.00 0.00 H new ATOM 0 HG21 THR B 81 -1.058 5.239 -4.069 1.00 0.00 H new ATOM 0 HG22 THR B 81 -1.148 6.891 -3.413 1.00 0.00 H new ATOM 0 HG23 THR B 81 -0.101 6.544 -4.810 1.00 0.00 H new ATOM 2727 N THR B 82 0.380 7.822 -0.554 1.00 0.00 N ATOM 2728 CA THR B 82 -0.433 8.703 0.273 1.00 0.00 C ATOM 2729 C THR B 82 0.207 10.092 0.354 1.00 0.00 C ATOM 2730 O THR B 82 -0.488 11.094 0.191 1.00 0.00 O ATOM 2731 CB THR B 82 -0.673 8.077 1.655 1.00 0.00 C ATOM 2732 OG1 THR B 82 -1.257 6.799 1.496 1.00 0.00 O ATOM 2733 CG2 THR B 82 -1.639 8.915 2.497 1.00 0.00 C ATOM 0 H THR B 82 0.698 6.978 -0.077 1.00 0.00 H new ATOM 0 HA THR B 82 -1.413 8.829 -0.187 1.00 0.00 H new ATOM 0 HB THR B 82 0.293 8.021 2.158 1.00 0.00 H new ATOM 0 HG1 THR B 82 -0.580 6.168 1.173 1.00 0.00 H new ATOM 0 HG21 THR B 82 -1.783 8.439 3.467 1.00 0.00 H new ATOM 0 HG22 THR B 82 -1.225 9.913 2.640 1.00 0.00 H new ATOM 0 HG23 THR B 82 -2.598 8.990 1.984 1.00 0.00 H new ATOM 2741 N ALA B 83 1.523 10.159 0.572 1.00 0.00 N ATOM 2742 CA ALA B 83 2.252 11.418 0.618 1.00 0.00 C ATOM 2743 C ALA B 83 2.121 12.165 -0.714 1.00 0.00 C ATOM 2744 O ALA B 83 1.837 13.362 -0.743 1.00 0.00 O ATOM 2745 CB ALA B 83 3.718 11.133 0.955 1.00 0.00 C ATOM 0 H ALA B 83 2.109 9.338 0.721 1.00 0.00 H new ATOM 0 HA ALA B 83 1.830 12.059 1.392 1.00 0.00 H new ATOM 0 HB1 ALA B 83 4.272 12.071 0.992 1.00 0.00 H new ATOM 0 HB2 ALA B 83 3.779 10.638 1.924 1.00 0.00 H new ATOM 0 HB3 ALA B 83 4.148 10.487 0.190 1.00 0.00 H new ATOM 2751 N CYS B 84 2.292 11.455 -1.832 1.00 0.00 N ATOM 2752 CA CYS B 84 2.099 12.060 -3.146 1.00 0.00 C ATOM 2753 C CYS B 84 0.662 12.572 -3.318 1.00 0.00 C ATOM 2754 O CYS B 84 0.461 13.689 -3.792 1.00 0.00 O ATOM 2755 CB CYS B 84 2.502 11.081 -4.245 1.00 0.00 C ATOM 2756 SG CYS B 84 2.168 11.842 -5.851 1.00 0.00 S ATOM 0 H CYS B 84 2.561 10.471 -1.852 1.00 0.00 H new ATOM 0 HA CYS B 84 2.749 12.931 -3.228 1.00 0.00 H new ATOM 0 HB2 CYS B 84 3.559 10.830 -4.158 1.00 0.00 H new ATOM 0 HB3 CYS B 84 1.944 10.150 -4.145 1.00 0.00 H new ATOM 0 HG CYS B 84 2.745 11.149 -6.788 1.00 0.00 H new ATOM 2762 N HIS B 85 -0.341 11.801 -2.884 1.00 0.00 N ATOM 2763 CA HIS B 85 -1.727 12.213 -2.876 1.00 0.00 C ATOM 2764 C HIS B 85 -1.862 13.528 -2.105 1.00 0.00 C ATOM 2765 O HIS B 85 -2.351 14.503 -2.666 1.00 0.00 O ATOM 2766 CB HIS B 85 -2.601 11.058 -2.350 1.00 0.00 C ATOM 2767 CG HIS B 85 -3.498 11.396 -1.191 1.00 0.00 C ATOM 2768 ND1 HIS B 85 -3.239 11.204 0.143 1.00 0.00 N ATOM 2769 CD2 HIS B 85 -4.690 12.042 -1.291 1.00 0.00 C ATOM 2770 CE1 HIS B 85 -4.275 11.713 0.832 1.00 0.00 C ATOM 2771 NE2 HIS B 85 -5.189 12.242 0.000 1.00 0.00 N ATOM 0 H HIS B 85 -0.197 10.858 -2.524 1.00 0.00 H new ATOM 0 HA HIS B 85 -2.090 12.423 -3.882 1.00 0.00 H new ATOM 0 HB2 HIS B 85 -3.219 10.692 -3.170 1.00 0.00 H new ATOM 0 HB3 HIS B 85 -1.947 10.238 -2.053 1.00 0.00 H new ATOM 0 HD1 HIS B 85 -2.412 10.757 0.539 1.00 0.00 H new ATOM 0 HD2 HIS B 85 -5.169 12.348 -2.209 1.00 0.00 H new ATOM 0 HE1 HIS B 85 -4.361 11.699 1.908 1.00 0.00 H new ATOM 2779 N GLU B 86 -1.386 13.584 -0.856 1.00 0.00 N ATOM 2780 CA GLU B 86 -1.433 14.804 -0.054 1.00 0.00 C ATOM 2781 C GLU B 86 -0.833 15.980 -0.828 1.00 0.00 C ATOM 2782 O GLU B 86 -1.423 17.059 -0.875 1.00 0.00 O ATOM 2783 CB GLU B 86 -0.702 14.609 1.282 1.00 0.00 C ATOM 2784 CG GLU B 86 -1.447 13.648 2.215 1.00 0.00 C ATOM 2785 CD GLU B 86 -0.625 13.331 3.460 1.00 0.00 C ATOM 2786 OE1 GLU B 86 -0.633 14.179 4.378 1.00 0.00 O ATOM 2787 OE2 GLU B 86 0.005 12.251 3.462 1.00 0.00 O ATOM 0 H GLU B 86 -0.961 12.789 -0.379 1.00 0.00 H new ATOM 0 HA GLU B 86 -2.478 15.029 0.160 1.00 0.00 H new ATOM 0 HB2 GLU B 86 0.300 14.225 1.093 1.00 0.00 H new ATOM 0 HB3 GLU B 86 -0.586 15.574 1.775 1.00 0.00 H new ATOM 0 HG2 GLU B 86 -2.399 14.089 2.509 1.00 0.00 H new ATOM 0 HG3 GLU B 86 -1.674 12.725 1.682 1.00 0.00 H new ATOM 2794 N PHE B 87 0.329 15.759 -1.452 1.00 0.00 N ATOM 2795 CA PHE B 87 1.001 16.798 -2.221 1.00 0.00 C ATOM 2796 C PHE B 87 0.096 17.287 -3.354 1.00 0.00 C ATOM 2797 O PHE B 87 -0.160 18.479 -3.497 1.00 0.00 O ATOM 2798 CB PHE B 87 2.329 16.257 -2.765 1.00 0.00 C ATOM 2799 CG PHE B 87 3.179 17.282 -3.490 1.00 0.00 C ATOM 2800 CD1 PHE B 87 4.023 18.140 -2.762 1.00 0.00 C ATOM 2801 CD2 PHE B 87 3.128 17.379 -4.893 1.00 0.00 C ATOM 2802 CE1 PHE B 87 4.885 19.019 -3.438 1.00 0.00 C ATOM 2803 CE2 PHE B 87 3.974 18.275 -5.568 1.00 0.00 C ATOM 2804 CZ PHE B 87 4.869 19.080 -4.842 1.00 0.00 C ATOM 0 H PHE B 87 0.820 14.865 -1.436 1.00 0.00 H new ATOM 0 HA PHE B 87 1.214 17.649 -1.574 1.00 0.00 H new ATOM 0 HB2 PHE B 87 2.906 15.847 -1.936 1.00 0.00 H new ATOM 0 HB3 PHE B 87 2.119 15.432 -3.446 1.00 0.00 H new ATOM 0 HD1 PHE B 87 4.008 18.123 -1.682 1.00 0.00 H new ATOM 0 HD2 PHE B 87 2.438 16.764 -5.451 1.00 0.00 H new ATOM 0 HE1 PHE B 87 5.561 19.649 -2.878 1.00 0.00 H new ATOM 0 HE2 PHE B 87 3.937 18.345 -6.645 1.00 0.00 H new ATOM 0 HZ PHE B 87 5.543 19.744 -5.362 1.00 0.00 H new ATOM 2814 N PHE B 88 -0.381 16.348 -4.173 1.00 0.00 N ATOM 2815 CA PHE B 88 -1.136 16.639 -5.380 1.00 0.00 C ATOM 2816 C PHE B 88 -2.499 17.256 -5.058 1.00 0.00 C ATOM 2817 O PHE B 88 -2.960 18.122 -5.793 1.00 0.00 O ATOM 2818 CB PHE B 88 -1.263 15.350 -6.207 1.00 0.00 C ATOM 2819 CG PHE B 88 -2.057 15.439 -7.502 1.00 0.00 C ATOM 2820 CD1 PHE B 88 -2.033 16.597 -8.306 1.00 0.00 C ATOM 2821 CD2 PHE B 88 -2.784 14.316 -7.938 1.00 0.00 C ATOM 2822 CE1 PHE B 88 -2.778 16.647 -9.497 1.00 0.00 C ATOM 2823 CE2 PHE B 88 -3.524 14.361 -9.131 1.00 0.00 C ATOM 2824 CZ PHE B 88 -3.528 15.532 -9.907 1.00 0.00 C ATOM 0 H PHE B 88 -0.248 15.350 -4.008 1.00 0.00 H new ATOM 0 HA PHE B 88 -0.604 17.385 -5.970 1.00 0.00 H new ATOM 0 HB2 PHE B 88 -0.259 15.001 -6.448 1.00 0.00 H new ATOM 0 HB3 PHE B 88 -1.723 14.588 -5.579 1.00 0.00 H new ATOM 0 HD1 PHE B 88 -1.440 17.448 -8.006 1.00 0.00 H new ATOM 0 HD2 PHE B 88 -2.773 13.410 -7.350 1.00 0.00 H new ATOM 0 HE1 PHE B 88 -2.774 17.544 -10.098 1.00 0.00 H new ATOM 0 HE2 PHE B 88 -4.088 13.498 -9.451 1.00 0.00 H new ATOM 0 HZ PHE B 88 -4.107 15.575 -10.818 1.00 0.00 H new ATOM 3136 N PHE C 76 -16.845 -12.943 -0.758 1.00 0.00 N ATOM 3137 CA PHE C 76 -15.804 -11.992 -1.154 1.00 0.00 C ATOM 3138 C PHE C 76 -14.481 -12.258 -0.434 1.00 0.00 C ATOM 3139 O PHE C 76 -13.401 -12.016 -0.968 1.00 0.00 O ATOM 3140 CB PHE C 76 -16.270 -10.569 -0.835 1.00 0.00 C ATOM 3141 CG PHE C 76 -17.619 -10.241 -1.430 1.00 0.00 C ATOM 3142 CD1 PHE C 76 -17.718 -9.802 -2.759 1.00 0.00 C ATOM 3143 CD2 PHE C 76 -18.787 -10.524 -0.703 1.00 0.00 C ATOM 3144 CE1 PHE C 76 -18.984 -9.607 -3.332 1.00 0.00 C ATOM 3145 CE2 PHE C 76 -20.045 -10.409 -1.306 1.00 0.00 C ATOM 3146 CZ PHE C 76 -20.150 -9.910 -2.611 1.00 0.00 C ATOM 0 HA PHE C 76 -15.635 -12.112 -2.224 1.00 0.00 H new ATOM 0 HB2 PHE C 76 -16.316 -10.442 0.247 1.00 0.00 H new ATOM 0 HB3 PHE C 76 -15.532 -9.859 -1.209 1.00 0.00 H new ATOM 0 HD1 PHE C 76 -16.825 -9.615 -3.337 1.00 0.00 H new ATOM 0 HD2 PHE C 76 -18.714 -10.833 0.329 1.00 0.00 H new ATOM 0 HE1 PHE C 76 -19.062 -9.220 -4.337 1.00 0.00 H new ATOM 0 HE2 PHE C 76 -20.933 -10.704 -0.766 1.00 0.00 H new ATOM 0 HZ PHE C 76 -21.121 -9.759 -3.059 1.00 0.00 H new ATOM 3156 N LEU C 77 -14.584 -12.719 0.808 1.00 0.00 N ATOM 3157 CA LEU C 77 -13.473 -12.917 1.709 1.00 0.00 C ATOM 3158 C LEU C 77 -12.928 -14.341 1.534 1.00 0.00 C ATOM 3159 O LEU C 77 -11.715 -14.547 1.516 1.00 0.00 O ATOM 3160 CB LEU C 77 -13.961 -12.592 3.129 1.00 0.00 C ATOM 3161 CG LEU C 77 -14.674 -11.222 3.221 1.00 0.00 C ATOM 3162 CD1 LEU C 77 -15.124 -10.973 4.664 1.00 0.00 C ATOM 3163 CD2 LEU C 77 -13.793 -10.055 2.758 1.00 0.00 C ATOM 0 H LEU C 77 -15.481 -12.972 1.223 1.00 0.00 H new ATOM 0 HA LEU C 77 -12.635 -12.254 1.496 1.00 0.00 H new ATOM 0 HB2 LEU C 77 -14.643 -13.374 3.461 1.00 0.00 H new ATOM 0 HB3 LEU C 77 -13.111 -12.600 3.811 1.00 0.00 H new ATOM 0 HG LEU C 77 -15.532 -11.266 2.550 1.00 0.00 H new ATOM 0 HD11 LEU C 77 -15.626 -10.008 4.727 1.00 0.00 H new ATOM 0 HD12 LEU C 77 -15.812 -11.761 4.972 1.00 0.00 H new ATOM 0 HD13 LEU C 77 -14.255 -10.973 5.321 1.00 0.00 H new ATOM 0 HD21 LEU C 77 -14.349 -9.122 2.846 1.00 0.00 H new ATOM 0 HD22 LEU C 77 -12.899 -10.005 3.380 1.00 0.00 H new ATOM 0 HD23 LEU C 77 -13.504 -10.208 1.718 1.00 0.00 H new ATOM 3588 N THR D 74 18.070 11.336 6.167 1.00 0.00 N ATOM 3589 CA THR D 74 17.283 12.529 5.929 1.00 0.00 C ATOM 3590 C THR D 74 17.538 13.137 4.546 1.00 0.00 C ATOM 3591 O THR D 74 16.617 13.756 4.021 1.00 0.00 O ATOM 3592 CB THR D 74 17.494 13.530 7.075 1.00 0.00 C ATOM 3593 OG1 THR D 74 18.760 13.324 7.669 1.00 0.00 O ATOM 3594 CG2 THR D 74 16.445 13.322 8.170 1.00 0.00 C ATOM 0 HA THR D 74 16.230 12.249 5.920 1.00 0.00 H new ATOM 0 HB THR D 74 17.416 14.533 6.656 1.00 0.00 H new ATOM 0 HG1 THR D 74 19.046 12.399 7.517 1.00 0.00 H new ATOM 0 HG21 THR D 74 16.610 14.040 8.973 1.00 0.00 H new ATOM 0 HG22 THR D 74 15.449 13.468 7.752 1.00 0.00 H new ATOM 0 HG23 THR D 74 16.528 12.310 8.565 1.00 0.00 H new ATOM 3602 N GLU D 75 18.716 12.944 3.930 1.00 0.00 N ATOM 3603 CA GLU D 75 18.981 13.431 2.573 1.00 0.00 C ATOM 3604 C GLU D 75 17.841 13.047 1.628 1.00 0.00 C ATOM 3605 O GLU D 75 17.407 13.851 0.809 1.00 0.00 O ATOM 3606 CB GLU D 75 20.294 12.848 2.026 1.00 0.00 C ATOM 3607 CG GLU D 75 21.527 13.382 2.771 1.00 0.00 C ATOM 3608 CD GLU D 75 22.812 12.640 2.402 1.00 0.00 C ATOM 3609 OE1 GLU D 75 22.772 11.826 1.452 1.00 0.00 O ATOM 3610 OE2 GLU D 75 23.825 12.896 3.088 1.00 0.00 O ATOM 0 H GLU D 75 19.501 12.451 4.356 1.00 0.00 H new ATOM 0 HA GLU D 75 19.062 14.517 2.627 1.00 0.00 H new ATOM 0 HB2 GLU D 75 20.267 11.761 2.106 1.00 0.00 H new ATOM 0 HB3 GLU D 75 20.381 13.088 0.966 1.00 0.00 H new ATOM 0 HG2 GLU D 75 21.649 14.442 2.549 1.00 0.00 H new ATOM 0 HG3 GLU D 75 21.361 13.299 3.845 1.00 0.00 H new ATOM 3617 N PHE D 76 17.367 11.807 1.756 1.00 0.00 N ATOM 3618 CA PHE D 76 16.286 11.272 0.946 1.00 0.00 C ATOM 3619 C PHE D 76 14.968 11.546 1.665 1.00 0.00 C ATOM 3620 O PHE D 76 14.074 12.196 1.123 1.00 0.00 O ATOM 3621 CB PHE D 76 16.504 9.768 0.691 1.00 0.00 C ATOM 3622 CG PHE D 76 17.963 9.349 0.672 1.00 0.00 C ATOM 3623 CD1 PHE D 76 18.764 9.602 -0.455 1.00 0.00 C ATOM 3624 CD2 PHE D 76 18.567 8.917 1.866 1.00 0.00 C ATOM 3625 CE1 PHE D 76 20.152 9.391 -0.396 1.00 0.00 C ATOM 3626 CE2 PHE D 76 19.964 8.817 1.955 1.00 0.00 C ATOM 3627 CZ PHE D 76 20.754 9.002 0.812 1.00 0.00 C ATOM 0 H PHE D 76 17.732 11.141 2.437 1.00 0.00 H new ATOM 0 HA PHE D 76 16.261 11.756 -0.030 1.00 0.00 H new ATOM 0 HB2 PHE D 76 15.984 9.200 1.462 1.00 0.00 H new ATOM 0 HB3 PHE D 76 16.048 9.502 -0.263 1.00 0.00 H new ATOM 0 HD1 PHE D 76 18.312 9.959 -1.368 1.00 0.00 H new ATOM 0 HD2 PHE D 76 17.954 8.661 2.717 1.00 0.00 H new ATOM 0 HE1 PHE D 76 20.757 9.528 -1.280 1.00 0.00 H new ATOM 0 HE2 PHE D 76 20.430 8.598 2.904 1.00 0.00 H new ATOM 0 HZ PHE D 76 21.822 8.846 0.860 1.00 0.00 H new ATOM 3637 N LEU D 77 14.851 11.049 2.902 1.00 0.00 N ATOM 3638 CA LEU D 77 13.586 11.036 3.626 1.00 0.00 C ATOM 3639 C LEU D 77 12.985 12.434 3.798 1.00 0.00 C ATOM 3640 O LEU D 77 11.763 12.554 3.902 1.00 0.00 O ATOM 3641 CB LEU D 77 13.728 10.314 4.973 1.00 0.00 C ATOM 3642 CG LEU D 77 14.151 8.838 4.854 1.00 0.00 C ATOM 3643 CD1 LEU D 77 14.326 8.255 6.260 1.00 0.00 C ATOM 3644 CD2 LEU D 77 13.125 7.996 4.085 1.00 0.00 C ATOM 0 H LEU D 77 15.631 10.647 3.423 1.00 0.00 H new ATOM 0 HA LEU D 77 12.880 10.475 3.013 1.00 0.00 H new ATOM 0 HB2 LEU D 77 14.462 10.843 5.581 1.00 0.00 H new ATOM 0 HB3 LEU D 77 12.777 10.367 5.503 1.00 0.00 H new ATOM 0 HG LEU D 77 15.087 8.805 4.297 1.00 0.00 H new ATOM 0 HD11 LEU D 77 14.626 7.210 6.186 1.00 0.00 H new ATOM 0 HD12 LEU D 77 15.094 8.816 6.793 1.00 0.00 H new ATOM 0 HD13 LEU D 77 13.383 8.325 6.803 1.00 0.00 H new ATOM 0 HD21 LEU D 77 13.470 6.964 4.029 1.00 0.00 H new ATOM 0 HD22 LEU D 77 12.166 8.030 4.601 1.00 0.00 H new ATOM 0 HD23 LEU D 77 13.009 8.395 3.077 1.00 0.00 H new ATOM 3656 N ARG D 78 13.803 13.496 3.778 1.00 0.00 N ATOM 3657 CA ARG D 78 13.290 14.856 3.850 1.00 0.00 C ATOM 3658 C ARG D 78 12.229 15.146 2.787 1.00 0.00 C ATOM 3659 O ARG D 78 11.385 16.011 3.009 1.00 0.00 O ATOM 3660 CB ARG D 78 14.415 15.900 3.881 1.00 0.00 C ATOM 3661 CG ARG D 78 15.233 16.075 2.587 1.00 0.00 C ATOM 3662 CD ARG D 78 14.545 16.856 1.457 1.00 0.00 C ATOM 3663 NE ARG D 78 13.813 18.024 1.968 1.00 0.00 N ATOM 3664 CZ ARG D 78 12.675 18.505 1.451 1.00 0.00 C ATOM 3665 NH1 ARG D 78 12.237 18.117 0.252 1.00 0.00 N ATOM 3666 NH2 ARG D 78 11.947 19.390 2.136 1.00 0.00 N ATOM 0 H ARG D 78 14.819 13.431 3.713 1.00 0.00 H new ATOM 0 HA ARG D 78 12.773 14.942 4.806 1.00 0.00 H new ATOM 0 HB2 ARG D 78 13.977 16.864 4.140 1.00 0.00 H new ATOM 0 HB3 ARG D 78 15.102 15.636 4.685 1.00 0.00 H new ATOM 0 HG2 ARG D 78 16.166 16.581 2.836 1.00 0.00 H new ATOM 0 HG3 ARG D 78 15.497 15.087 2.211 1.00 0.00 H new ATOM 0 HD2 ARG D 78 15.292 17.183 0.734 1.00 0.00 H new ATOM 0 HD3 ARG D 78 13.856 16.198 0.928 1.00 0.00 H new ATOM 0 HE ARG D 78 14.202 18.505 2.779 1.00 0.00 H new ATOM 0 HH11 ARG D 78 12.772 17.440 -0.292 1.00 0.00 H new ATOM 0 HH12 ARG D 78 11.367 18.497 -0.121 1.00 0.00 H new ATOM 0 HH21 ARG D 78 12.257 19.702 3.056 1.00 0.00 H new ATOM 0 HH22 ARG D 78 11.081 19.754 1.739 1.00 0.00 H new