USER MOD reduce.3.24.130724 H: found=0, std=0, add=1164, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 1155 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: B 32 LYS NZ :NH3+ -175:sc= -1.28! (180deg=-1.36!) USER MOD Set 1.2: C 50 HIS : no HE2:sc= -1.18! C(o=-2.5!,f=-13!) USER MOD Set 2.1: C 48 GLN : amide:sc= 0.183 K(o=0.27,f=-2.3!) USER MOD Set 2.2: C 53 LYS NZ :NH3+ -149:sc= 0.0862 (180deg=-0.394) USER MOD Set 3.1: C 12 CYS SG : rot 138:sc= -4.96! USER MOD Set 3.2: C 15 CYS SG : rot 108:sc= 0.779 USER MOD Set 3.3: C 26 CYS SG : rot 157:sc= 0.385 USER MOD Set 3.4: C 29 CYS SG : rot -49:sc= 1.17! USER MOD Set 4.1: B 48 GLN : amide:sc= 0.18 K(o=0.22,f=-2.6!) USER MOD Set 4.2: B 53 LYS NZ :NH3+ -140:sc= 0.0382 (180deg=-0.75) USER MOD Set 5.1: B 12 CYS SG : rot 152:sc= -3.66! USER MOD Set 5.2: B 15 CYS SG : rot 117:sc= 0.0281! USER MOD Set 5.3: B 26 CYS SG : rot 168:sc= -1.36 USER MOD Set 5.4: B 29 CYS SG : rot -44:sc= -0.628! USER MOD Set 6.1: A 48 GLN : amide:sc= 0.179 K(o=0.36,f=-2.2!) USER MOD Set 6.2: A 53 LYS NZ :NH3+ -148:sc= 0.18 (180deg=-0.353) USER MOD Set 7.1: A 50 HIS : no HE2:sc= -1.53! C(o=-2.9!,f=-13!) USER MOD Set 7.2: C 32 LYS NZ :NH3+ -176:sc= -1.38! (180deg=-1.57!) USER MOD Set 8.1: A 32 LYS NZ :NH3+ 178:sc= -1.26! (180deg=-1.35!) USER MOD Set 8.2: B 50 HIS : no HE2:sc= -1.76! C(o=-3!,f=-14!) USER MOD Set 9.1: A 12 CYS SG : rot 154:sc= -4.27! USER MOD Set 9.2: A 15 CYS SG : rot 105:sc= -1.14! USER MOD Set 9.3: A 26 CYS SG : rot -179:sc= -1.71! USER MOD Set 9.4: A 29 CYS SG : rot -35:sc= -1.84! USER MOD Single : A 5 THR OG1 : rot 180:sc=-0.00172 USER MOD Single : A 14 LYS NZ :NH3+ -159:sc= -0.106 (180deg=-0.461) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot -165:sc= 1.64 USER MOD Single : A 39 GLN : amide:sc= -0.12 K(o=-0.12,f=-0.66) USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 72:sc= 0.908 USER MOD Single : A 49 LYS NZ :NH3+ -168:sc= -0.061 (180deg=-0.273) USER MOD Single : A 52 ASN : amide:sc= -2.6! C(o=-2.6!,f=-5.1!) USER MOD Single : B 5 THR OG1 : rot 180:sc= -0.0197 USER MOD Single : B 14 LYS NZ :NH3+ -160:sc= -0.0565 (180deg=-0.34) USER MOD Single : B 24 THR OG1 : rot 180:sc= 0 USER MOD Single : B 30 SER OG : rot 180:sc= 0 USER MOD Single : B 37 THR OG1 : rot -159:sc= 1.64 USER MOD Single : B 39 GLN : amide:sc= -0.171 K(o=-0.17,f=-0.67) USER MOD Single : B 41 TYR OH : rot 180:sc= 0 USER MOD Single : B 42 THR OG1 : rot 73:sc= 0.902 USER MOD Single : B 49 LYS NZ :NH3+ -172:sc= -0.038 (180deg=-0.192) USER MOD Single : B 52 ASN : amide:sc= -2.93! C(o=-2.9!,f=-5.7!) USER MOD Single : C 5 THR OG1 : rot 180:sc= -0.0283 USER MOD Single : C 14 LYS NZ :NH3+ -163:sc= -0.0368 (180deg=-0.262) USER MOD Single : C 24 THR OG1 : rot 180:sc= 0 USER MOD Single : C 30 SER OG : rot 180:sc= 0 USER MOD Single : C 37 THR OG1 : rot -167:sc= 1.62 USER MOD Single : C 39 GLN : amide:sc= -0.105 X(o=-0.1,f=-0.57) USER MOD Single : C 41 TYR OH : rot 180:sc= 0 USER MOD Single : C 42 THR OG1 : rot 72:sc= 0.843 USER MOD Single : C 49 LYS NZ :NH3+ -170:sc= -0.0486 (180deg=-0.234) USER MOD Single : C 52 ASN : amide:sc= -2.75! C(o=-2.8!,f=-5!) USER MOD ----------------------------------------------------------------- ATOM 21 N VAL A 2 -0.053 -8.552 13.908 1.00 0.00 N ATOM 22 CA VAL A 2 -0.902 -7.768 14.790 1.00 0.00 C ATOM 23 C VAL A 2 -2.033 -7.127 13.989 1.00 0.00 C ATOM 24 O VAL A 2 -2.925 -6.483 14.539 1.00 0.00 O ATOM 25 CB VAL A 2 -0.079 -6.677 15.518 1.00 0.00 C ATOM 26 CG1 VAL A 2 0.430 -5.634 14.534 1.00 0.00 C ATOM 27 CG2 VAL A 2 -0.882 -6.024 16.636 1.00 0.00 C ATOM 0 HA VAL A 2 -1.328 -8.433 15.541 1.00 0.00 H new ATOM 0 HB VAL A 2 0.783 -7.164 15.974 1.00 0.00 H new ATOM 0 HG11 VAL A 2 1.005 -4.879 15.070 1.00 0.00 H new ATOM 0 HG12 VAL A 2 1.066 -6.115 13.791 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -0.416 -5.160 14.036 1.00 0.00 H new ATOM 0 HG21 VAL A 2 -0.273 -5.264 17.125 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -1.776 -5.560 16.219 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -1.172 -6.780 17.365 1.00 0.00 H new ATOM 37 N ILE A 3 -2.006 -7.342 12.685 1.00 0.00 N ATOM 38 CA ILE A 3 -2.995 -6.761 11.801 1.00 0.00 C ATOM 39 C ILE A 3 -3.608 -7.839 10.913 1.00 0.00 C ATOM 40 O ILE A 3 -2.907 -8.718 10.411 1.00 0.00 O ATOM 41 CB ILE A 3 -2.377 -5.637 10.931 1.00 0.00 C ATOM 42 CG1 ILE A 3 -3.475 -4.852 10.208 1.00 0.00 C ATOM 43 CG2 ILE A 3 -1.379 -6.213 9.930 1.00 0.00 C ATOM 44 CD1 ILE A 3 -2.966 -3.620 9.491 1.00 0.00 C ATOM 0 H ILE A 3 -1.306 -7.917 12.216 1.00 0.00 H new ATOM 0 HA ILE A 3 -3.779 -6.319 12.416 1.00 0.00 H new ATOM 0 HB ILE A 3 -1.841 -4.953 11.588 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -3.963 -5.507 9.486 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -4.234 -4.554 10.932 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -0.958 -5.406 9.330 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -0.578 -6.722 10.466 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -1.887 -6.923 9.277 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -3.798 -3.114 9.002 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -2.504 -2.945 10.211 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -2.229 -3.913 8.743 1.00 0.00 H new ATOM 56 N ALA A 4 -4.920 -7.802 10.777 1.00 0.00 N ATOM 57 CA ALA A 4 -5.615 -8.702 9.876 1.00 0.00 C ATOM 58 C ALA A 4 -6.448 -7.908 8.882 1.00 0.00 C ATOM 59 O ALA A 4 -6.835 -6.769 9.149 1.00 0.00 O ATOM 60 CB ALA A 4 -6.494 -9.662 10.664 1.00 0.00 C ATOM 0 H ALA A 4 -5.528 -7.156 11.281 1.00 0.00 H new ATOM 0 HA ALA A 4 -4.878 -9.285 9.323 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -7.010 -10.332 9.976 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -5.875 -10.247 11.344 1.00 0.00 H new ATOM 0 HB3 ALA A 4 -7.228 -9.096 11.238 1.00 0.00 H new ATOM 66 N THR A 5 -6.721 -8.521 7.737 1.00 0.00 N ATOM 67 CA THR A 5 -7.502 -7.890 6.680 1.00 0.00 C ATOM 68 C THR A 5 -8.941 -7.647 7.136 1.00 0.00 C ATOM 69 O THR A 5 -9.703 -6.939 6.485 1.00 0.00 O ATOM 70 CB THR A 5 -7.503 -8.772 5.416 1.00 0.00 C ATOM 71 OG1 THR A 5 -6.199 -9.336 5.223 1.00 0.00 O ATOM 72 CG2 THR A 5 -7.892 -7.967 4.183 1.00 0.00 C ATOM 0 H THR A 5 -6.409 -9.466 7.515 1.00 0.00 H new ATOM 0 HA THR A 5 -7.041 -6.930 6.449 1.00 0.00 H new ATOM 0 HB THR A 5 -8.237 -9.565 5.555 1.00 0.00 H new ATOM 0 HG1 THR A 5 -6.201 -9.898 4.420 1.00 0.00 H new ATOM 0 HG21 THR A 5 -7.884 -8.616 3.307 1.00 0.00 H new ATOM 0 HG22 THR A 5 -8.891 -7.553 4.319 1.00 0.00 H new ATOM 0 HG23 THR A 5 -7.180 -7.155 4.039 1.00 0.00 H new ATOM 80 N ASP A 6 -9.284 -8.198 8.293 1.00 0.00 N ATOM 81 CA ASP A 6 -10.628 -8.089 8.836 1.00 0.00 C ATOM 82 C ASP A 6 -10.819 -6.739 9.516 1.00 0.00 C ATOM 83 O ASP A 6 -11.940 -6.338 9.821 1.00 0.00 O ATOM 84 CB ASP A 6 -10.890 -9.206 9.853 1.00 0.00 C ATOM 85 CG ASP A 6 -10.765 -10.596 9.260 1.00 0.00 C ATOM 86 OD1 ASP A 6 -9.630 -11.115 9.176 1.00 0.00 O ATOM 87 OD2 ASP A 6 -11.799 -11.192 8.903 1.00 0.00 O ATOM 0 H ASP A 6 -8.640 -8.731 8.878 1.00 0.00 H new ATOM 0 HA ASP A 6 -11.333 -8.182 8.010 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -10.188 -9.107 10.681 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -11.891 -9.084 10.268 1.00 0.00 H new ATOM 92 N ASP A 7 -9.720 -6.035 9.749 1.00 0.00 N ATOM 93 CA ASP A 7 -9.790 -4.703 10.339 1.00 0.00 C ATOM 94 C ASP A 7 -9.530 -3.644 9.278 1.00 0.00 C ATOM 95 O ASP A 7 -9.482 -2.450 9.568 1.00 0.00 O ATOM 96 CB ASP A 7 -8.765 -4.554 11.467 1.00 0.00 C ATOM 97 CG ASP A 7 -8.939 -5.585 12.562 1.00 0.00 C ATOM 98 OD1 ASP A 7 -9.895 -5.468 13.357 1.00 0.00 O ATOM 99 OD2 ASP A 7 -8.108 -6.514 12.640 1.00 0.00 O ATOM 0 H ASP A 7 -8.776 -6.360 9.541 1.00 0.00 H new ATOM 0 HA ASP A 7 -10.790 -4.568 10.750 1.00 0.00 H new ATOM 0 HB2 ASP A 7 -7.761 -4.638 11.052 1.00 0.00 H new ATOM 0 HB3 ASP A 7 -8.849 -3.556 11.898 1.00 0.00 H new ATOM 104 N LEU A 8 -9.370 -4.090 8.043 1.00 0.00 N ATOM 105 CA LEU A 8 -9.086 -3.188 6.934 1.00 0.00 C ATOM 106 C LEU A 8 -10.175 -3.261 5.882 1.00 0.00 C ATOM 107 O LEU A 8 -10.456 -2.275 5.199 1.00 0.00 O ATOM 108 CB LEU A 8 -7.736 -3.529 6.317 1.00 0.00 C ATOM 109 CG LEU A 8 -6.557 -3.325 7.255 1.00 0.00 C ATOM 110 CD1 LEU A 8 -5.304 -3.963 6.680 1.00 0.00 C ATOM 111 CD2 LEU A 8 -6.333 -1.841 7.504 1.00 0.00 C ATOM 0 H LEU A 8 -9.432 -5.074 7.781 1.00 0.00 H new ATOM 0 HA LEU A 8 -9.055 -2.169 7.321 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -7.750 -4.568 5.989 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -7.590 -2.916 5.428 1.00 0.00 H new ATOM 0 HG LEU A 8 -6.782 -3.807 8.206 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -4.470 -3.808 7.364 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -5.469 -5.032 6.546 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -5.073 -3.508 5.717 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -5.486 -1.709 8.177 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -6.126 -1.340 6.558 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -7.226 -1.409 7.955 1.00 0.00 H new ATOM 123 N GLU A 9 -10.796 -4.425 5.777 1.00 0.00 N ATOM 124 CA GLU A 9 -11.889 -4.627 4.846 1.00 0.00 C ATOM 125 C GLU A 9 -12.937 -5.544 5.466 1.00 0.00 C ATOM 126 O GLU A 9 -12.622 -6.446 6.245 1.00 0.00 O ATOM 127 CB GLU A 9 -11.405 -5.183 3.493 1.00 0.00 C ATOM 128 CG GLU A 9 -10.526 -4.210 2.711 1.00 0.00 C ATOM 129 CD GLU A 9 -10.603 -4.389 1.203 1.00 0.00 C ATOM 130 OE1 GLU A 9 -9.943 -5.293 0.661 1.00 0.00 O ATOM 131 OE2 GLU A 9 -11.299 -3.588 0.535 1.00 0.00 O ATOM 0 H GLU A 9 -10.558 -5.248 6.330 1.00 0.00 H new ATOM 0 HA GLU A 9 -12.338 -3.655 4.644 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -10.848 -6.104 3.666 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -12.272 -5.444 2.886 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -10.817 -3.190 2.962 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -9.491 -4.333 3.030 1.00 0.00 H new ATOM 138 N VAL A 10 -14.182 -5.281 5.132 1.00 0.00 N ATOM 139 CA VAL A 10 -15.317 -6.014 5.656 1.00 0.00 C ATOM 140 C VAL A 10 -16.243 -6.370 4.502 1.00 0.00 C ATOM 141 O VAL A 10 -16.342 -5.623 3.531 1.00 0.00 O ATOM 142 CB VAL A 10 -16.068 -5.175 6.723 1.00 0.00 C ATOM 143 CG1 VAL A 10 -16.529 -3.841 6.151 1.00 0.00 C ATOM 144 CG2 VAL A 10 -17.248 -5.945 7.300 1.00 0.00 C ATOM 0 H VAL A 10 -14.439 -4.541 4.479 1.00 0.00 H new ATOM 0 HA VAL A 10 -14.970 -6.926 6.141 1.00 0.00 H new ATOM 0 HB VAL A 10 -15.366 -4.973 7.532 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -17.052 -3.276 6.922 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -15.664 -3.273 5.809 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -17.202 -4.018 5.312 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -17.754 -5.331 8.045 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -17.946 -6.194 6.501 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -16.890 -6.862 7.768 1.00 0.00 H new ATOM 154 N ALA A 11 -16.897 -7.517 4.587 1.00 0.00 N ATOM 155 CA ALA A 11 -17.741 -7.991 3.502 1.00 0.00 C ATOM 156 C ALA A 11 -18.931 -7.067 3.277 1.00 0.00 C ATOM 157 O ALA A 11 -19.578 -6.617 4.224 1.00 0.00 O ATOM 158 CB ALA A 11 -18.199 -9.406 3.814 1.00 0.00 C ATOM 0 H ALA A 11 -16.860 -8.137 5.396 1.00 0.00 H new ATOM 0 HA ALA A 11 -17.164 -7.993 2.578 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -18.833 -9.770 3.005 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -17.330 -10.056 3.914 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -18.763 -9.408 4.747 1.00 0.00 H new ATOM 164 N CYS A 12 -19.195 -6.784 2.000 1.00 0.00 N ATOM 165 CA CYS A 12 -20.156 -5.776 1.575 1.00 0.00 C ATOM 166 C CYS A 12 -21.614 -6.066 1.950 1.00 0.00 C ATOM 167 O CYS A 12 -21.936 -7.143 2.444 1.00 0.00 O ATOM 168 CB CYS A 12 -20.069 -5.649 0.063 1.00 0.00 C ATOM 169 SG CYS A 12 -19.313 -4.112 -0.449 1.00 0.00 S ATOM 0 H CYS A 12 -18.737 -7.259 1.222 1.00 0.00 H new ATOM 0 HA CYS A 12 -19.888 -4.860 2.101 1.00 0.00 H new ATOM 0 HB2 CYS A 12 -19.494 -6.484 -0.337 1.00 0.00 H new ATOM 0 HB3 CYS A 12 -21.070 -5.718 -0.363 1.00 0.00 H new ATOM 0 HG CYS A 12 -18.763 -4.267 -1.617 1.00 0.00 H new ATOM 174 N PRO A 13 -22.516 -5.079 1.709 1.00 0.00 N ATOM 175 CA PRO A 13 -23.967 -5.258 1.828 1.00 0.00 C ATOM 176 C PRO A 13 -24.472 -6.594 1.270 1.00 0.00 C ATOM 177 O PRO A 13 -25.243 -7.296 1.924 1.00 0.00 O ATOM 178 CB PRO A 13 -24.502 -4.109 0.976 1.00 0.00 C ATOM 179 CG PRO A 13 -23.526 -3.005 1.173 1.00 0.00 C ATOM 180 CD PRO A 13 -22.181 -3.674 1.369 1.00 0.00 C ATOM 0 HA PRO A 13 -24.288 -5.261 2.870 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -24.571 -4.394 -0.074 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -25.502 -3.814 1.293 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -23.510 -2.339 0.310 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -23.791 -2.398 2.039 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -21.573 -3.617 0.466 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -21.612 -3.197 2.167 1.00 0.00 H new ATOM 188 N LYS A 14 -24.011 -6.950 0.070 1.00 0.00 N ATOM 189 CA LYS A 14 -24.538 -8.142 -0.588 1.00 0.00 C ATOM 190 C LYS A 14 -23.664 -8.659 -1.736 1.00 0.00 C ATOM 191 O LYS A 14 -24.018 -9.648 -2.374 1.00 0.00 O ATOM 192 CB LYS A 14 -25.994 -7.915 -1.046 1.00 0.00 C ATOM 193 CG LYS A 14 -26.177 -7.042 -2.285 1.00 0.00 C ATOM 194 CD LYS A 14 -26.272 -7.885 -3.555 1.00 0.00 C ATOM 195 CE LYS A 14 -26.872 -7.098 -4.711 1.00 0.00 C ATOM 196 NZ LYS A 14 -28.287 -6.734 -4.453 1.00 0.00 N ATOM 0 H LYS A 14 -23.295 -6.446 -0.452 1.00 0.00 H new ATOM 0 HA LYS A 14 -24.522 -8.932 0.163 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -26.449 -8.886 -1.240 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -26.547 -7.463 -0.222 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -27.080 -6.441 -2.178 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -25.340 -6.348 -2.369 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -25.279 -8.238 -3.832 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -26.881 -8.768 -3.361 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -26.288 -6.193 -4.876 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -26.809 -7.689 -5.625 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -28.763 -6.529 -5.355 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -28.768 -7.525 -3.980 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -28.323 -5.892 -3.843 1.00 0.00 H new ATOM 210 N CYS A 15 -22.525 -8.028 -2.031 1.00 0.00 N ATOM 211 CA CYS A 15 -21.698 -8.575 -3.109 1.00 0.00 C ATOM 212 C CYS A 15 -20.353 -9.099 -2.655 1.00 0.00 C ATOM 213 O CYS A 15 -19.378 -9.040 -3.408 1.00 0.00 O ATOM 214 CB CYS A 15 -21.426 -7.485 -4.138 1.00 0.00 C ATOM 215 SG CYS A 15 -20.752 -5.936 -3.440 1.00 0.00 S ATOM 0 H CYS A 15 -22.170 -7.189 -1.572 1.00 0.00 H new ATOM 0 HA CYS A 15 -22.265 -9.412 -3.516 1.00 0.00 H new ATOM 0 HB2 CYS A 15 -20.726 -7.869 -4.880 1.00 0.00 H new ATOM 0 HB3 CYS A 15 -22.354 -7.259 -4.663 1.00 0.00 H new ATOM 0 HG CYS A 15 -19.482 -5.857 -3.706 1.00 0.00 H new ATOM 220 N GLU A 16 -20.316 -9.716 -1.500 1.00 0.00 N ATOM 221 CA GLU A 16 -19.072 -10.224 -0.954 1.00 0.00 C ATOM 222 C GLU A 16 -18.847 -11.648 -1.405 1.00 0.00 C ATOM 223 O GLU A 16 -18.089 -12.398 -0.792 1.00 0.00 O ATOM 224 CB GLU A 16 -19.131 -10.196 0.573 1.00 0.00 C ATOM 225 CG GLU A 16 -20.347 -9.492 1.143 1.00 0.00 C ATOM 226 CD GLU A 16 -21.564 -10.392 1.158 1.00 0.00 C ATOM 227 OE1 GLU A 16 -21.766 -11.115 2.155 1.00 0.00 O ATOM 228 OE2 GLU A 16 -22.308 -10.391 0.161 1.00 0.00 O ATOM 0 H GLU A 16 -21.134 -9.881 -0.914 1.00 0.00 H new ATOM 0 HA GLU A 16 -18.255 -9.596 -1.308 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -19.114 -11.221 0.943 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -18.233 -9.706 0.950 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -20.130 -9.157 2.157 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -20.561 -8.601 0.552 1.00 0.00 H new ATOM 235 N ARG A 17 -19.485 -12.015 -2.501 1.00 0.00 N ATOM 236 CA ARG A 17 -19.495 -13.383 -2.953 1.00 0.00 C ATOM 237 C ARG A 17 -19.539 -13.369 -4.481 1.00 0.00 C ATOM 238 O ARG A 17 -19.356 -14.392 -5.132 1.00 0.00 O ATOM 239 CB ARG A 17 -20.666 -14.179 -2.342 1.00 0.00 C ATOM 240 CG ARG A 17 -22.024 -13.478 -2.365 1.00 0.00 C ATOM 241 CD ARG A 17 -22.661 -13.481 -3.747 1.00 0.00 C ATOM 242 NE ARG A 17 -22.864 -14.836 -4.261 1.00 0.00 N ATOM 243 CZ ARG A 17 -23.860 -15.190 -5.074 1.00 0.00 C ATOM 244 NH1 ARG A 17 -24.784 -14.308 -5.437 1.00 0.00 N ATOM 245 NH2 ARG A 17 -23.937 -16.438 -5.517 1.00 0.00 N ATOM 0 H ARG A 17 -20.007 -11.372 -3.097 1.00 0.00 H new ATOM 0 HA ARG A 17 -18.592 -13.894 -2.618 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -20.756 -15.125 -2.876 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -20.418 -14.419 -1.308 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -22.694 -13.969 -1.659 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -21.903 -12.449 -2.027 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -23.619 -12.963 -3.704 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -22.028 -12.924 -4.438 1.00 0.00 H new ATOM 0 HE ARG A 17 -22.200 -15.557 -3.979 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -24.736 -13.349 -5.094 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -25.541 -14.590 -6.059 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -23.236 -17.123 -5.236 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -24.697 -16.712 -6.139 1.00 0.00 H new ATOM 259 N ALA A 18 -19.796 -12.173 -5.043 1.00 0.00 N ATOM 260 CA ALA A 18 -19.932 -12.030 -6.491 1.00 0.00 C ATOM 261 C ALA A 18 -19.136 -10.850 -7.043 1.00 0.00 C ATOM 262 O ALA A 18 -18.630 -10.910 -8.160 1.00 0.00 O ATOM 263 CB ALA A 18 -21.396 -11.890 -6.883 1.00 0.00 C ATOM 0 H ALA A 18 -19.911 -11.306 -4.518 1.00 0.00 H new ATOM 0 HA ALA A 18 -19.521 -12.938 -6.931 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -21.474 -11.785 -7.965 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -21.944 -12.776 -6.564 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -21.819 -11.009 -6.401 1.00 0.00 H new ATOM 269 N GLY A 19 -19.030 -9.776 -6.263 1.00 0.00 N ATOM 270 CA GLY A 19 -18.304 -8.603 -6.717 1.00 0.00 C ATOM 271 C GLY A 19 -19.138 -7.697 -7.606 1.00 0.00 C ATOM 272 O GLY A 19 -18.597 -6.899 -8.366 1.00 0.00 O ATOM 0 H GLY A 19 -19.432 -9.698 -5.329 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -17.961 -8.037 -5.851 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -17.416 -8.921 -7.263 1.00 0.00 H new ATOM 276 N GLU A 20 -20.453 -7.791 -7.476 1.00 0.00 N ATOM 277 CA GLU A 20 -21.363 -6.985 -8.284 1.00 0.00 C ATOM 278 C GLU A 20 -22.598 -6.623 -7.499 1.00 0.00 C ATOM 279 O GLU A 20 -22.914 -7.231 -6.483 1.00 0.00 O ATOM 280 CB GLU A 20 -21.827 -7.703 -9.552 1.00 0.00 C ATOM 281 CG GLU A 20 -22.285 -9.130 -9.303 1.00 0.00 C ATOM 282 CD GLU A 20 -23.392 -9.563 -10.238 1.00 0.00 C ATOM 283 OE1 GLU A 20 -24.562 -9.193 -9.995 1.00 0.00 O ATOM 284 OE2 GLU A 20 -23.099 -10.284 -11.214 1.00 0.00 O ATOM 0 H GLU A 20 -20.917 -8.418 -6.818 1.00 0.00 H new ATOM 0 HA GLU A 20 -20.796 -6.097 -8.563 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -22.645 -7.140 -10.001 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -21.011 -7.712 -10.275 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -21.436 -9.804 -9.416 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -22.629 -9.221 -8.273 1.00 0.00 H new ATOM 291 N ILE A 21 -23.300 -5.643 -7.999 1.00 0.00 N ATOM 292 CA ILE A 21 -24.595 -5.282 -7.486 1.00 0.00 C ATOM 293 C ILE A 21 -25.553 -5.225 -8.651 1.00 0.00 C ATOM 294 O ILE A 21 -25.447 -4.336 -9.486 1.00 0.00 O ATOM 295 CB ILE A 21 -24.579 -3.911 -6.782 1.00 0.00 C ATOM 296 CG1 ILE A 21 -23.622 -3.929 -5.589 1.00 0.00 C ATOM 297 CG2 ILE A 21 -25.984 -3.514 -6.348 1.00 0.00 C ATOM 298 CD1 ILE A 21 -24.054 -4.823 -4.446 1.00 0.00 C ATOM 0 H ILE A 21 -22.987 -5.067 -8.781 1.00 0.00 H new ATOM 0 HA ILE A 21 -24.898 -6.025 -6.748 1.00 0.00 H new ATOM 0 HB ILE A 21 -24.221 -3.164 -7.491 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -22.639 -4.252 -5.933 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -23.510 -2.911 -5.215 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -25.951 -2.543 -5.853 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -26.632 -3.454 -7.223 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -26.376 -4.260 -5.657 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -23.316 -4.773 -3.646 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -25.021 -4.490 -4.069 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -24.137 -5.851 -4.799 1.00 0.00 H new ATOM 310 N GLU A 22 -26.456 -6.187 -8.728 1.00 0.00 N ATOM 311 CA GLU A 22 -27.465 -6.192 -9.778 1.00 0.00 C ATOM 312 C GLU A 22 -26.814 -6.249 -11.171 1.00 0.00 C ATOM 313 O GLU A 22 -27.169 -5.468 -12.051 1.00 0.00 O ATOM 314 CB GLU A 22 -28.294 -4.906 -9.652 1.00 0.00 C ATOM 315 CG GLU A 22 -29.766 -5.081 -9.943 1.00 0.00 C ATOM 316 CD GLU A 22 -30.429 -5.990 -8.936 1.00 0.00 C ATOM 317 OE1 GLU A 22 -30.787 -5.506 -7.843 1.00 0.00 O ATOM 318 OE2 GLU A 22 -30.573 -7.195 -9.222 1.00 0.00 O ATOM 0 H GLU A 22 -26.513 -6.973 -8.080 1.00 0.00 H new ATOM 0 HA GLU A 22 -28.096 -7.073 -9.666 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -28.180 -4.512 -8.642 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -27.888 -4.158 -10.333 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -30.257 -4.108 -9.934 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -29.893 -5.493 -10.944 1.00 0.00 H new ATOM 325 N GLY A 23 -25.846 -7.152 -11.370 1.00 0.00 N ATOM 326 CA GLY A 23 -25.149 -7.241 -12.659 1.00 0.00 C ATOM 327 C GLY A 23 -24.371 -5.986 -12.989 1.00 0.00 C ATOM 328 O GLY A 23 -23.852 -5.821 -14.092 1.00 0.00 O ATOM 0 H GLY A 23 -25.531 -7.821 -10.668 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -24.468 -8.092 -12.641 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -25.876 -7.431 -13.448 1.00 0.00 H new ATOM 332 N THR A 24 -24.293 -5.128 -12.010 1.00 0.00 N ATOM 333 CA THR A 24 -23.788 -3.785 -12.161 1.00 0.00 C ATOM 334 C THR A 24 -22.616 -3.538 -11.196 1.00 0.00 C ATOM 335 O THR A 24 -22.582 -4.104 -10.101 1.00 0.00 O ATOM 336 CB THR A 24 -24.984 -2.841 -11.900 1.00 0.00 C ATOM 337 OG1 THR A 24 -25.637 -2.500 -13.139 1.00 0.00 O ATOM 338 CG2 THR A 24 -24.608 -1.574 -11.147 1.00 0.00 C ATOM 0 H THR A 24 -24.586 -5.346 -11.058 1.00 0.00 H new ATOM 0 HA THR A 24 -23.387 -3.608 -13.159 1.00 0.00 H new ATOM 0 HB THR A 24 -25.669 -3.394 -11.257 1.00 0.00 H new ATOM 0 HG1 THR A 24 -26.393 -1.903 -12.957 1.00 0.00 H new ATOM 0 HG21 THR A 24 -25.497 -0.961 -11.000 1.00 0.00 H new ATOM 0 HG22 THR A 24 -24.186 -1.839 -10.178 1.00 0.00 H new ATOM 0 HG23 THR A 24 -23.872 -1.014 -11.723 1.00 0.00 H new ATOM 346 N PRO A 25 -21.613 -2.731 -11.613 1.00 0.00 N ATOM 347 CA PRO A 25 -20.432 -2.431 -10.787 1.00 0.00 C ATOM 348 C PRO A 25 -20.810 -1.797 -9.451 1.00 0.00 C ATOM 349 O PRO A 25 -21.586 -0.845 -9.396 1.00 0.00 O ATOM 350 CB PRO A 25 -19.616 -1.453 -11.642 1.00 0.00 C ATOM 351 CG PRO A 25 -20.583 -0.923 -12.644 1.00 0.00 C ATOM 352 CD PRO A 25 -21.545 -2.047 -12.914 1.00 0.00 C ATOM 0 HA PRO A 25 -19.881 -3.335 -10.528 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -19.197 -0.651 -11.034 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -18.779 -1.955 -12.127 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -21.104 -0.046 -12.260 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -20.073 -0.617 -13.557 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -22.521 -1.678 -13.230 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -21.184 -2.709 -13.702 1.00 0.00 H new ATOM 360 N CYS A 26 -20.240 -2.329 -8.381 1.00 0.00 N ATOM 361 CA CYS A 26 -20.643 -1.954 -7.038 1.00 0.00 C ATOM 362 C CYS A 26 -19.999 -0.644 -6.564 1.00 0.00 C ATOM 363 O CYS A 26 -18.799 -0.442 -6.727 1.00 0.00 O ATOM 364 CB CYS A 26 -20.296 -3.080 -6.074 1.00 0.00 C ATOM 365 SG CYS A 26 -20.913 -2.804 -4.397 1.00 0.00 S ATOM 0 H CYS A 26 -19.494 -3.024 -8.419 1.00 0.00 H new ATOM 0 HA CYS A 26 -21.720 -1.786 -7.058 1.00 0.00 H new ATOM 0 HB2 CYS A 26 -20.707 -4.015 -6.455 1.00 0.00 H new ATOM 0 HB3 CYS A 26 -19.213 -3.199 -6.040 1.00 0.00 H new ATOM 0 HG CYS A 26 -20.552 -3.793 -3.634 1.00 0.00 H new ATOM 370 N PRO A 27 -20.825 0.235 -5.952 1.00 0.00 N ATOM 371 CA PRO A 27 -20.446 1.565 -5.440 1.00 0.00 C ATOM 372 C PRO A 27 -19.015 1.698 -4.904 1.00 0.00 C ATOM 373 O PRO A 27 -18.225 2.504 -5.393 1.00 0.00 O ATOM 374 CB PRO A 27 -21.418 1.732 -4.278 1.00 0.00 C ATOM 375 CG PRO A 27 -22.657 0.992 -4.662 1.00 0.00 C ATOM 376 CD PRO A 27 -22.269 0.002 -5.742 1.00 0.00 C ATOM 0 HA PRO A 27 -20.486 2.304 -6.241 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -20.995 1.332 -3.356 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -21.633 2.785 -4.099 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -23.080 0.476 -3.800 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -23.419 1.680 -5.027 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -22.465 -1.024 -5.430 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -22.836 0.170 -6.658 1.00 0.00 H new ATOM 384 N ALA A 28 -18.696 0.885 -3.904 1.00 0.00 N ATOM 385 CA ALA A 28 -17.479 1.079 -3.114 1.00 0.00 C ATOM 386 C ALA A 28 -16.527 -0.096 -3.264 1.00 0.00 C ATOM 387 O ALA A 28 -15.377 -0.044 -2.836 1.00 0.00 O ATOM 388 CB ALA A 28 -17.832 1.292 -1.649 1.00 0.00 C ATOM 0 H ALA A 28 -19.260 0.085 -3.619 1.00 0.00 H new ATOM 0 HA ALA A 28 -16.972 1.968 -3.490 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -16.919 1.435 -1.072 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -18.465 2.174 -1.552 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -18.366 0.419 -1.273 1.00 0.00 H new ATOM 394 N CYS A 29 -17.021 -1.164 -3.857 1.00 0.00 N ATOM 395 CA CYS A 29 -16.209 -2.341 -4.095 1.00 0.00 C ATOM 396 C CYS A 29 -16.346 -2.748 -5.562 1.00 0.00 C ATOM 397 O CYS A 29 -17.253 -3.493 -5.922 1.00 0.00 O ATOM 398 CB CYS A 29 -16.651 -3.475 -3.143 1.00 0.00 C ATOM 399 SG CYS A 29 -18.266 -4.227 -3.525 1.00 0.00 S ATOM 0 H CYS A 29 -17.984 -1.241 -4.184 1.00 0.00 H new ATOM 0 HA CYS A 29 -15.159 -2.130 -3.894 1.00 0.00 H new ATOM 0 HB2 CYS A 29 -15.892 -4.257 -3.159 1.00 0.00 H new ATOM 0 HB3 CYS A 29 -16.683 -3.082 -2.127 1.00 0.00 H new ATOM 0 HG CYS A 29 -19.070 -3.317 -3.989 1.00 0.00 H new ATOM 404 N SER A 30 -15.470 -2.237 -6.424 1.00 0.00 N ATOM 405 CA SER A 30 -15.595 -2.463 -7.862 1.00 0.00 C ATOM 406 C SER A 30 -15.193 -3.887 -8.259 1.00 0.00 C ATOM 407 O SER A 30 -14.336 -4.088 -9.119 1.00 0.00 O ATOM 408 CB SER A 30 -14.740 -1.442 -8.614 1.00 0.00 C ATOM 409 OG SER A 30 -14.989 -0.128 -8.137 1.00 0.00 O ATOM 0 H SER A 30 -14.669 -1.666 -6.154 1.00 0.00 H new ATOM 0 HA SER A 30 -16.644 -2.339 -8.132 1.00 0.00 H new ATOM 0 HB2 SER A 30 -13.684 -1.684 -8.492 1.00 0.00 H new ATOM 0 HB3 SER A 30 -14.957 -1.494 -9.681 1.00 0.00 H new ATOM 0 HG SER A 30 -14.431 0.510 -8.629 1.00 0.00 H new ATOM 415 N GLY A 31 -15.812 -4.866 -7.618 1.00 0.00 N ATOM 416 CA GLY A 31 -15.568 -6.246 -7.953 1.00 0.00 C ATOM 417 C GLY A 31 -14.508 -6.855 -7.073 1.00 0.00 C ATOM 418 O GLY A 31 -13.591 -7.520 -7.556 1.00 0.00 O ATOM 0 H GLY A 31 -16.485 -4.723 -6.865 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -16.493 -6.813 -7.854 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -15.260 -6.318 -8.996 1.00 0.00 H new ATOM 422 N LYS A 32 -14.624 -6.631 -5.770 1.00 0.00 N ATOM 423 CA LYS A 32 -13.674 -7.151 -4.806 1.00 0.00 C ATOM 424 C LYS A 32 -14.385 -8.117 -3.864 1.00 0.00 C ATOM 425 O LYS A 32 -13.856 -9.163 -3.509 1.00 0.00 O ATOM 426 CB LYS A 32 -13.098 -5.996 -3.987 1.00 0.00 C ATOM 427 CG LYS A 32 -12.081 -5.146 -4.730 1.00 0.00 C ATOM 428 CD LYS A 32 -12.034 -3.717 -4.192 1.00 0.00 C ATOM 429 CE LYS A 32 -12.116 -3.662 -2.668 1.00 0.00 C ATOM 430 NZ LYS A 32 -11.023 -4.428 -2.004 1.00 0.00 N ATOM 0 H LYS A 32 -15.379 -6.084 -5.357 1.00 0.00 H new ATOM 0 HA LYS A 32 -12.872 -7.669 -5.332 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -13.917 -5.356 -3.658 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -12.629 -6.401 -3.090 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -11.094 -5.600 -4.642 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -12.329 -5.127 -5.791 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -11.111 -3.239 -4.520 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -12.858 -3.145 -4.618 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -12.074 -2.622 -2.343 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -13.079 -4.058 -2.346 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -11.107 -4.329 -0.972 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -11.096 -5.433 -2.263 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -10.102 -4.057 -2.313 1.00 0.00 H new ATOM 444 N GLY A 33 -15.592 -7.726 -3.444 1.00 0.00 N ATOM 445 CA GLY A 33 -16.364 -8.511 -2.517 1.00 0.00 C ATOM 446 C GLY A 33 -16.498 -7.794 -1.193 1.00 0.00 C ATOM 447 O GLY A 33 -17.567 -7.774 -0.585 1.00 0.00 O ATOM 0 H GLY A 33 -16.045 -6.862 -3.742 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -17.353 -8.706 -2.933 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -15.886 -9.479 -2.366 1.00 0.00 H new ATOM 451 N VAL A 34 -15.429 -7.134 -0.783 1.00 0.00 N ATOM 452 CA VAL A 34 -15.393 -6.460 0.505 1.00 0.00 C ATOM 453 C VAL A 34 -15.214 -4.952 0.344 1.00 0.00 C ATOM 454 O VAL A 34 -14.871 -4.466 -0.739 1.00 0.00 O ATOM 455 CB VAL A 34 -14.246 -7.017 1.378 1.00 0.00 C ATOM 456 CG1 VAL A 34 -14.495 -8.476 1.738 1.00 0.00 C ATOM 457 CG2 VAL A 34 -12.912 -6.872 0.663 1.00 0.00 C ATOM 0 H VAL A 34 -14.570 -7.050 -1.326 1.00 0.00 H new ATOM 0 HA VAL A 34 -16.349 -6.647 0.993 1.00 0.00 H new ATOM 0 HB VAL A 34 -14.213 -6.437 2.300 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -13.674 -8.844 2.353 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -15.429 -8.559 2.293 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -14.561 -9.070 0.826 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -12.116 -7.270 1.293 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -12.941 -7.424 -0.277 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -12.721 -5.818 0.459 1.00 0.00 H new ATOM 467 N ILE A 35 -15.470 -4.229 1.427 1.00 0.00 N ATOM 468 CA ILE A 35 -15.264 -2.787 1.487 1.00 0.00 C ATOM 469 C ILE A 35 -14.344 -2.442 2.648 1.00 0.00 C ATOM 470 O ILE A 35 -14.194 -3.222 3.574 1.00 0.00 O ATOM 471 CB ILE A 35 -16.587 -2.013 1.658 1.00 0.00 C ATOM 472 CG1 ILE A 35 -17.531 -2.774 2.594 1.00 0.00 C ATOM 473 CG2 ILE A 35 -17.233 -1.759 0.307 1.00 0.00 C ATOM 474 CD1 ILE A 35 -18.802 -2.027 2.930 1.00 0.00 C ATOM 0 H ILE A 35 -15.829 -4.629 2.294 1.00 0.00 H new ATOM 0 HA ILE A 35 -14.815 -2.491 0.539 1.00 0.00 H new ATOM 0 HB ILE A 35 -16.373 -1.045 2.111 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -17.793 -3.726 2.133 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -17.002 -3.003 3.519 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -18.165 -1.212 0.447 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -16.557 -1.172 -0.315 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -17.441 -2.711 -0.182 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -19.415 -2.634 3.596 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -18.552 -1.087 3.422 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -19.356 -1.821 2.014 1.00 0.00 H new ATOM 486 N LEU A 36 -13.750 -1.265 2.600 1.00 0.00 N ATOM 487 CA LEU A 36 -12.713 -0.901 3.558 1.00 0.00 C ATOM 488 C LEU A 36 -13.268 -0.308 4.842 1.00 0.00 C ATOM 489 O LEU A 36 -14.443 0.053 4.936 1.00 0.00 O ATOM 490 CB LEU A 36 -11.749 0.102 2.930 1.00 0.00 C ATOM 491 CG LEU A 36 -11.117 -0.351 1.619 1.00 0.00 C ATOM 492 CD1 LEU A 36 -11.905 0.169 0.424 1.00 0.00 C ATOM 493 CD2 LEU A 36 -9.672 0.094 1.561 1.00 0.00 C ATOM 0 H LEU A 36 -13.964 -0.543 1.912 1.00 0.00 H new ATOM 0 HA LEU A 36 -12.197 -1.826 3.817 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -12.282 1.037 2.756 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -10.954 0.317 3.645 1.00 0.00 H new ATOM 0 HG LEU A 36 -11.144 -1.440 1.576 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -11.432 -0.169 -0.498 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -12.926 -0.210 0.469 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -11.921 1.259 0.445 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -9.228 -0.234 0.621 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -9.623 1.181 1.626 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -9.123 -0.344 2.394 1.00 0.00 H new ATOM 505 N THR A 37 -12.380 -0.207 5.824 1.00 0.00 N ATOM 506 CA THR A 37 -12.681 0.411 7.101 1.00 0.00 C ATOM 507 C THR A 37 -12.029 1.784 7.127 1.00 0.00 C ATOM 508 O THR A 37 -11.378 2.157 6.161 1.00 0.00 O ATOM 509 CB THR A 37 -12.100 -0.422 8.268 1.00 0.00 C ATOM 510 OG1 THR A 37 -10.663 -0.355 8.240 1.00 0.00 O ATOM 511 CG2 THR A 37 -12.523 -1.882 8.179 1.00 0.00 C ATOM 0 H THR A 37 -11.424 -0.556 5.752 1.00 0.00 H new ATOM 0 HA THR A 37 -13.763 0.477 7.218 1.00 0.00 H new ATOM 0 HB THR A 37 -12.486 -0.004 9.198 1.00 0.00 H new ATOM 0 HG1 THR A 37 -10.292 -1.054 8.818 1.00 0.00 H new ATOM 0 HG21 THR A 37 -12.096 -2.436 9.015 1.00 0.00 H new ATOM 0 HG22 THR A 37 -13.610 -1.949 8.217 1.00 0.00 H new ATOM 0 HG23 THR A 37 -12.166 -2.308 7.241 1.00 0.00 H new ATOM 519 N ALA A 38 -12.176 2.531 8.208 1.00 0.00 N ATOM 520 CA ALA A 38 -11.531 3.837 8.299 1.00 0.00 C ATOM 521 C ALA A 38 -10.013 3.691 8.211 1.00 0.00 C ATOM 522 O ALA A 38 -9.346 4.462 7.516 1.00 0.00 O ATOM 523 CB ALA A 38 -11.936 4.546 9.576 1.00 0.00 C ATOM 0 H ALA A 38 -12.726 2.265 9.025 1.00 0.00 H new ATOM 0 HA ALA A 38 -11.862 4.446 7.458 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -11.444 5.518 9.624 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -13.017 4.685 9.588 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -11.638 3.946 10.436 1.00 0.00 H new ATOM 529 N GLN A 39 -9.473 2.694 8.910 1.00 0.00 N ATOM 530 CA GLN A 39 -8.053 2.385 8.814 1.00 0.00 C ATOM 531 C GLN A 39 -7.687 1.994 7.387 1.00 0.00 C ATOM 532 O GLN A 39 -6.667 2.436 6.861 1.00 0.00 O ATOM 533 CB GLN A 39 -7.671 1.259 9.777 1.00 0.00 C ATOM 534 CG GLN A 39 -6.176 0.988 9.817 1.00 0.00 C ATOM 535 CD GLN A 39 -5.802 -0.086 10.810 1.00 0.00 C ATOM 536 OE1 GLN A 39 -6.462 -0.260 11.831 1.00 0.00 O ATOM 537 NE2 GLN A 39 -4.740 -0.812 10.511 1.00 0.00 N ATOM 0 H GLN A 39 -9.996 2.091 9.545 1.00 0.00 H new ATOM 0 HA GLN A 39 -7.496 3.280 9.090 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -8.014 1.515 10.779 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -8.192 0.347 9.485 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -5.839 0.692 8.824 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -5.651 1.909 10.070 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -4.224 -0.630 9.651 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -4.436 -1.555 11.141 1.00 0.00 H new ATOM 546 N GLY A 40 -8.535 1.186 6.752 1.00 0.00 N ATOM 547 CA GLY A 40 -8.268 0.767 5.392 1.00 0.00 C ATOM 548 C GLY A 40 -8.418 1.913 4.417 1.00 0.00 C ATOM 549 O GLY A 40 -7.724 1.975 3.410 1.00 0.00 O ATOM 0 H GLY A 40 -9.396 0.818 7.155 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -7.258 0.363 5.327 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -8.951 -0.037 5.118 1.00 0.00 H new ATOM 553 N TYR A 41 -9.317 2.836 4.732 1.00 0.00 N ATOM 554 CA TYR A 41 -9.530 4.022 3.913 1.00 0.00 C ATOM 555 C TYR A 41 -8.347 4.974 3.993 1.00 0.00 C ATOM 556 O TYR A 41 -7.998 5.617 3.002 1.00 0.00 O ATOM 557 CB TYR A 41 -10.802 4.742 4.374 1.00 0.00 C ATOM 558 CG TYR A 41 -12.034 4.426 3.552 1.00 0.00 C ATOM 559 CD1 TYR A 41 -12.296 5.109 2.372 1.00 0.00 C ATOM 560 CD2 TYR A 41 -12.937 3.451 3.958 1.00 0.00 C ATOM 561 CE1 TYR A 41 -13.425 4.833 1.623 1.00 0.00 C ATOM 562 CE2 TYR A 41 -14.067 3.170 3.213 1.00 0.00 C ATOM 563 CZ TYR A 41 -14.305 3.862 2.047 1.00 0.00 C ATOM 564 OH TYR A 41 -15.431 3.585 1.302 1.00 0.00 O ATOM 0 H TYR A 41 -9.915 2.785 5.556 1.00 0.00 H new ATOM 0 HA TYR A 41 -9.637 3.703 2.876 1.00 0.00 H new ATOM 0 HB2 TYR A 41 -10.997 4.479 5.414 1.00 0.00 H new ATOM 0 HB3 TYR A 41 -10.627 5.817 4.345 1.00 0.00 H new ATOM 0 HD1 TYR A 41 -11.607 5.868 2.034 1.00 0.00 H new ATOM 0 HD2 TYR A 41 -12.753 2.904 4.871 1.00 0.00 H new ATOM 0 HE1 TYR A 41 -13.616 5.376 0.709 1.00 0.00 H new ATOM 0 HE2 TYR A 41 -14.760 2.411 3.544 1.00 0.00 H new ATOM 0 HH TYR A 41 -15.945 2.874 1.739 1.00 0.00 H new ATOM 574 N THR A 42 -7.705 5.036 5.147 1.00 0.00 N ATOM 575 CA THR A 42 -6.490 5.819 5.294 1.00 0.00 C ATOM 576 C THR A 42 -5.360 5.165 4.510 1.00 0.00 C ATOM 577 O THR A 42 -4.495 5.837 3.943 1.00 0.00 O ATOM 578 CB THR A 42 -6.079 5.899 6.772 1.00 0.00 C ATOM 579 OG1 THR A 42 -7.205 6.279 7.565 1.00 0.00 O ATOM 580 CG2 THR A 42 -4.947 6.894 6.976 1.00 0.00 C ATOM 0 H THR A 42 -8.004 4.554 5.995 1.00 0.00 H new ATOM 0 HA THR A 42 -6.680 6.823 4.915 1.00 0.00 H new ATOM 0 HB THR A 42 -5.726 4.915 7.081 1.00 0.00 H new ATOM 0 HG1 THR A 42 -7.834 5.529 7.621 1.00 0.00 H new ATOM 0 HG21 THR A 42 -4.679 6.928 8.032 1.00 0.00 H new ATOM 0 HG22 THR A 42 -4.081 6.585 6.391 1.00 0.00 H new ATOM 0 HG23 THR A 42 -5.269 7.883 6.651 1.00 0.00 H new ATOM 588 N LEU A 43 -5.417 3.845 4.437 1.00 0.00 N ATOM 589 CA LEU A 43 -4.361 3.070 3.821 1.00 0.00 C ATOM 590 C LEU A 43 -4.584 2.946 2.322 1.00 0.00 C ATOM 591 O LEU A 43 -3.637 2.725 1.580 1.00 0.00 O ATOM 592 CB LEU A 43 -4.268 1.672 4.455 1.00 0.00 C ATOM 593 CG LEU A 43 -3.181 1.480 5.532 1.00 0.00 C ATOM 594 CD1 LEU A 43 -3.266 2.569 6.593 1.00 0.00 C ATOM 595 CD2 LEU A 43 -3.324 0.110 6.176 1.00 0.00 C ATOM 0 H LEU A 43 -6.190 3.288 4.800 1.00 0.00 H new ATOM 0 HA LEU A 43 -3.421 3.595 3.992 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -5.235 1.433 4.898 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -4.094 0.947 3.660 1.00 0.00 H new ATOM 0 HG LEU A 43 -2.206 1.550 5.051 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -2.489 2.410 7.340 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -3.127 3.544 6.126 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -4.244 2.533 7.073 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -2.552 -0.017 6.935 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -4.307 0.027 6.640 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -3.215 -0.663 5.415 1.00 0.00 H new ATOM 607 N LEU A 44 -5.819 3.116 1.859 1.00 0.00 N ATOM 608 CA LEU A 44 -6.099 2.956 0.441 1.00 0.00 C ATOM 609 C LEU A 44 -5.710 4.218 -0.321 1.00 0.00 C ATOM 610 O LEU A 44 -5.092 4.142 -1.373 1.00 0.00 O ATOM 611 CB LEU A 44 -7.582 2.582 0.201 1.00 0.00 C ATOM 612 CG LEU A 44 -8.578 3.737 -0.015 1.00 0.00 C ATOM 613 CD1 LEU A 44 -8.541 4.231 -1.456 1.00 0.00 C ATOM 614 CD2 LEU A 44 -9.994 3.310 0.328 1.00 0.00 C ATOM 0 H LEU A 44 -6.626 3.360 2.434 1.00 0.00 H new ATOM 0 HA LEU A 44 -5.495 2.132 0.062 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -7.628 1.930 -0.671 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -7.924 1.997 1.055 1.00 0.00 H new ATOM 0 HG LEU A 44 -8.278 4.547 0.649 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -9.254 5.046 -1.580 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -7.538 4.587 -1.693 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -8.804 3.414 -2.128 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -10.675 4.145 0.166 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -10.286 2.475 -0.308 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -10.038 3.003 1.373 1.00 0.00 H new ATOM 626 N ASP A 45 -6.059 5.379 0.218 1.00 0.00 N ATOM 627 CA ASP A 45 -5.796 6.637 -0.472 1.00 0.00 C ATOM 628 C ASP A 45 -4.314 6.970 -0.438 1.00 0.00 C ATOM 629 O ASP A 45 -3.797 7.670 -1.310 1.00 0.00 O ATOM 630 CB ASP A 45 -6.613 7.765 0.154 1.00 0.00 C ATOM 631 CG ASP A 45 -6.459 9.082 -0.581 1.00 0.00 C ATOM 632 OD1 ASP A 45 -6.955 9.189 -1.722 1.00 0.00 O ATOM 633 OD2 ASP A 45 -5.875 10.023 -0.010 1.00 0.00 O ATOM 0 H ASP A 45 -6.521 5.477 1.122 1.00 0.00 H new ATOM 0 HA ASP A 45 -6.095 6.527 -1.514 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -7.665 7.482 0.165 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -6.307 7.896 1.192 1.00 0.00 H new ATOM 638 N PHE A 46 -3.618 6.417 0.544 1.00 0.00 N ATOM 639 CA PHE A 46 -2.181 6.580 0.639 1.00 0.00 C ATOM 640 C PHE A 46 -1.482 5.713 -0.392 1.00 0.00 C ATOM 641 O PHE A 46 -0.502 6.134 -1.008 1.00 0.00 O ATOM 642 CB PHE A 46 -1.734 6.167 2.043 1.00 0.00 C ATOM 643 CG PHE A 46 -0.257 6.246 2.292 1.00 0.00 C ATOM 644 CD1 PHE A 46 0.560 5.153 2.044 1.00 0.00 C ATOM 645 CD2 PHE A 46 0.312 7.405 2.792 1.00 0.00 C ATOM 646 CE1 PHE A 46 1.915 5.216 2.290 1.00 0.00 C ATOM 647 CE2 PHE A 46 1.669 7.473 3.037 1.00 0.00 C ATOM 648 CZ PHE A 46 2.469 6.376 2.787 1.00 0.00 C ATOM 0 H PHE A 46 -4.029 5.851 1.286 1.00 0.00 H new ATOM 0 HA PHE A 46 -1.920 7.621 0.450 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -2.243 6.800 2.770 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -2.063 5.144 2.225 1.00 0.00 H new ATOM 0 HD1 PHE A 46 0.130 4.242 1.654 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -0.311 8.264 2.992 1.00 0.00 H new ATOM 0 HE1 PHE A 46 2.541 4.358 2.094 1.00 0.00 H new ATOM 0 HE2 PHE A 46 2.104 8.383 3.424 1.00 0.00 H new ATOM 0 HZ PHE A 46 3.530 6.427 2.981 1.00 0.00 H new ATOM 658 N ILE A 47 -1.990 4.516 -0.605 1.00 0.00 N ATOM 659 CA ILE A 47 -1.371 3.634 -1.570 1.00 0.00 C ATOM 660 C ILE A 47 -1.783 4.025 -2.988 1.00 0.00 C ATOM 661 O ILE A 47 -1.021 3.857 -3.936 1.00 0.00 O ATOM 662 CB ILE A 47 -1.693 2.149 -1.292 1.00 0.00 C ATOM 663 CG1 ILE A 47 -3.202 1.899 -1.356 1.00 0.00 C ATOM 664 CG2 ILE A 47 -1.143 1.753 0.072 1.00 0.00 C ATOM 665 CD1 ILE A 47 -3.613 0.481 -1.016 1.00 0.00 C ATOM 0 H ILE A 47 -2.812 4.138 -0.134 1.00 0.00 H new ATOM 0 HA ILE A 47 -0.291 3.748 -1.473 1.00 0.00 H new ATOM 0 HB ILE A 47 -1.219 1.536 -2.059 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -3.702 2.584 -0.671 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -3.556 2.137 -2.359 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -1.371 0.705 0.266 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -0.063 1.897 0.085 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -1.601 2.373 0.843 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -4.697 0.390 -1.085 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -3.145 -0.211 -1.716 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -3.293 0.243 -0.002 1.00 0.00 H new ATOM 677 N GLN A 48 -2.975 4.588 -3.113 1.00 0.00 N ATOM 678 CA GLN A 48 -3.403 5.213 -4.344 1.00 0.00 C ATOM 679 C GLN A 48 -2.411 6.294 -4.751 1.00 0.00 C ATOM 680 O GLN A 48 -1.784 6.205 -5.790 1.00 0.00 O ATOM 681 CB GLN A 48 -4.786 5.827 -4.161 1.00 0.00 C ATOM 682 CG GLN A 48 -5.921 4.819 -4.176 1.00 0.00 C ATOM 683 CD GLN A 48 -6.243 4.349 -5.579 1.00 0.00 C ATOM 684 OE1 GLN A 48 -6.081 5.097 -6.542 1.00 0.00 O ATOM 685 NE2 GLN A 48 -6.701 3.117 -5.704 1.00 0.00 N ATOM 0 H GLN A 48 -3.667 4.622 -2.364 1.00 0.00 H new ATOM 0 HA GLN A 48 -3.448 4.456 -5.127 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -4.809 6.369 -3.215 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -4.954 6.558 -4.951 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -5.653 3.961 -3.559 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -6.809 5.267 -3.731 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -6.820 2.531 -4.878 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -6.936 2.751 -6.627 1.00 0.00 H new ATOM 694 N LYS A 49 -2.195 7.246 -3.861 1.00 0.00 N ATOM 695 CA LYS A 49 -1.489 8.484 -4.192 1.00 0.00 C ATOM 696 C LYS A 49 0.039 8.305 -4.253 1.00 0.00 C ATOM 697 O LYS A 49 0.779 9.265 -4.470 1.00 0.00 O ATOM 698 CB LYS A 49 -1.910 9.557 -3.170 1.00 0.00 C ATOM 699 CG LYS A 49 -1.274 10.927 -3.360 1.00 0.00 C ATOM 700 CD LYS A 49 -1.841 11.948 -2.383 1.00 0.00 C ATOM 701 CE LYS A 49 -3.339 12.133 -2.571 1.00 0.00 C ATOM 702 NZ LYS A 49 -3.678 12.520 -3.966 1.00 0.00 N ATOM 0 H LYS A 49 -2.501 7.189 -2.890 1.00 0.00 H new ATOM 0 HA LYS A 49 -1.769 8.798 -5.197 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -2.993 9.669 -3.213 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -1.666 9.198 -2.170 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -0.195 10.850 -3.222 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -1.441 11.268 -4.382 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -1.639 11.626 -1.361 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -1.336 12.904 -2.521 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -3.854 11.207 -2.316 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -3.700 12.898 -1.884 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -4.669 12.833 -4.008 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -3.057 13.296 -4.272 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -3.546 11.702 -4.595 1.00 0.00 H new ATOM 716 N HIS A 50 0.536 7.088 -4.030 1.00 0.00 N ATOM 717 CA HIS A 50 1.946 6.841 -4.364 1.00 0.00 C ATOM 718 C HIS A 50 2.158 5.796 -5.466 1.00 0.00 C ATOM 719 O HIS A 50 3.298 5.539 -5.844 1.00 0.00 O ATOM 720 CB HIS A 50 2.711 6.427 -3.106 1.00 0.00 C ATOM 721 CG HIS A 50 2.667 7.468 -2.035 1.00 0.00 C ATOM 722 ND1 HIS A 50 1.755 7.441 -1.004 1.00 0.00 N ATOM 723 CD2 HIS A 50 3.398 8.594 -1.856 1.00 0.00 C ATOM 724 CE1 HIS A 50 1.918 8.500 -0.244 1.00 0.00 C ATOM 725 NE2 HIS A 50 2.907 9.216 -0.736 1.00 0.00 N ATOM 0 H HIS A 50 0.022 6.297 -3.643 1.00 0.00 H new ATOM 0 HA HIS A 50 2.330 7.781 -4.761 1.00 0.00 H new ATOM 0 HB2 HIS A 50 2.292 5.497 -2.721 1.00 0.00 H new ATOM 0 HB3 HIS A 50 3.750 6.224 -3.368 1.00 0.00 H new ATOM 0 HD1 HIS A 50 1.059 6.711 -0.853 1.00 0.00 H new ATOM 0 HD2 HIS A 50 4.212 8.937 -2.477 1.00 0.00 H new ATOM 0 HE1 HIS A 50 1.339 8.742 0.635 1.00 0.00 H new ATOM 734 N LEU A 51 1.092 5.194 -5.979 1.00 0.00 N ATOM 735 CA LEU A 51 1.229 4.277 -7.121 1.00 0.00 C ATOM 736 C LEU A 51 0.410 4.759 -8.314 1.00 0.00 C ATOM 737 O LEU A 51 0.843 4.680 -9.465 1.00 0.00 O ATOM 738 CB LEU A 51 0.765 2.852 -6.777 1.00 0.00 C ATOM 739 CG LEU A 51 1.681 2.012 -5.862 1.00 0.00 C ATOM 740 CD1 LEU A 51 3.112 1.971 -6.385 1.00 0.00 C ATOM 741 CD2 LEU A 51 1.651 2.526 -4.438 1.00 0.00 C ATOM 0 H LEU A 51 0.139 5.315 -5.637 1.00 0.00 H new ATOM 0 HA LEU A 51 2.290 4.263 -7.369 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -0.214 2.921 -6.303 1.00 0.00 H new ATOM 0 HB3 LEU A 51 0.629 2.307 -7.711 1.00 0.00 H new ATOM 0 HG LEU A 51 1.294 0.993 -5.867 1.00 0.00 H new ATOM 0 HD11 LEU A 51 3.727 1.371 -5.715 1.00 0.00 H new ATOM 0 HD12 LEU A 51 3.123 1.529 -7.381 1.00 0.00 H new ATOM 0 HD13 LEU A 51 3.511 2.984 -6.433 1.00 0.00 H new ATOM 0 HD21 LEU A 51 2.306 1.915 -3.817 1.00 0.00 H new ATOM 0 HD22 LEU A 51 1.993 3.561 -4.417 1.00 0.00 H new ATOM 0 HD23 LEU A 51 0.632 2.473 -4.053 1.00 0.00 H new ATOM 753 N ASN A 52 -0.773 5.263 -8.019 1.00 0.00 N ATOM 754 CA ASN A 52 -1.796 5.507 -9.026 1.00 0.00 C ATOM 755 C ASN A 52 -2.290 6.957 -9.019 1.00 0.00 C ATOM 756 O ASN A 52 -2.697 7.485 -10.055 1.00 0.00 O ATOM 757 CB ASN A 52 -2.964 4.552 -8.772 1.00 0.00 C ATOM 758 CG ASN A 52 -2.990 3.397 -9.763 1.00 0.00 C ATOM 759 OD1 ASN A 52 -3.384 2.280 -9.425 1.00 0.00 O ATOM 760 ND2 ASN A 52 -2.609 3.662 -11.006 1.00 0.00 N ATOM 0 H ASN A 52 -1.056 5.517 -7.072 1.00 0.00 H new ATOM 0 HA ASN A 52 -1.359 5.331 -10.009 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -2.894 4.157 -7.758 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -3.902 5.104 -8.835 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -2.637 2.929 -11.715 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -2.288 4.598 -11.252 1.00 0.00 H new ATOM 767 N LYS A 53 -2.258 7.591 -7.865 1.00 0.00 N ATOM 768 CA LYS A 53 -2.716 8.963 -7.721 1.00 0.00 C ATOM 769 C LYS A 53 -1.546 9.904 -7.464 1.00 0.00 C ATOM 770 O LYS A 53 -1.493 10.498 -6.369 1.00 0.00 O ATOM 771 CB LYS A 53 -3.694 9.073 -6.554 1.00 0.00 C ATOM 772 CG LYS A 53 -5.142 9.233 -6.969 1.00 0.00 C ATOM 773 CD LYS A 53 -5.954 9.796 -5.815 1.00 0.00 C ATOM 774 CE LYS A 53 -6.377 8.720 -4.835 1.00 0.00 C ATOM 775 NZ LYS A 53 -7.342 7.760 -5.439 1.00 0.00 N ATOM 776 OXT LYS A 53 -0.696 10.052 -8.359 1.00 0.00 O ATOM 0 H LYS A 53 -1.915 7.173 -7.000 1.00 0.00 H new ATOM 0 HA LYS A 53 -3.209 9.246 -8.651 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -3.602 8.182 -5.933 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -3.409 9.924 -5.935 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -5.211 9.897 -7.831 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -5.550 8.270 -7.275 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -5.365 10.550 -5.292 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -6.839 10.297 -6.206 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -5.496 8.179 -4.489 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -6.829 9.185 -3.959 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -7.994 7.415 -4.706 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -7.884 8.237 -6.187 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -6.823 6.956 -5.846 1.00 0.00 H new ATOM 811 N VAL B 2 7.557 3.956 13.968 1.00 0.00 N ATOM 812 CA VAL B 2 7.307 2.811 14.833 1.00 0.00 C ATOM 813 C VAL B 2 7.303 1.526 14.005 1.00 0.00 C ATOM 814 O VAL B 2 7.207 0.416 14.530 1.00 0.00 O ATOM 815 CB VAL B 2 5.956 2.976 15.576 1.00 0.00 C ATOM 816 CG1 VAL B 2 4.787 2.921 14.602 1.00 0.00 C ATOM 817 CG2 VAL B 2 5.796 1.936 16.677 1.00 0.00 C ATOM 0 HA VAL B 2 8.102 2.752 15.576 1.00 0.00 H new ATOM 0 HB VAL B 2 5.958 3.959 16.047 1.00 0.00 H new ATOM 0 HG11 VAL B 2 3.852 3.039 15.149 1.00 0.00 H new ATOM 0 HG12 VAL B 2 4.884 3.724 13.871 1.00 0.00 H new ATOM 0 HG13 VAL B 2 4.787 1.960 14.087 1.00 0.00 H new ATOM 0 HG21 VAL B 2 4.838 2.080 17.177 1.00 0.00 H new ATOM 0 HG22 VAL B 2 5.831 0.937 16.242 1.00 0.00 H new ATOM 0 HG23 VAL B 2 6.604 2.045 17.401 1.00 0.00 H new ATOM 827 N ILE B 3 7.442 1.691 12.699 1.00 0.00 N ATOM 828 CA ILE B 3 7.426 0.563 11.789 1.00 0.00 C ATOM 829 C ILE B 3 8.657 0.588 10.891 1.00 0.00 C ATOM 830 O ILE B 3 9.062 1.645 10.404 1.00 0.00 O ATOM 831 CB ILE B 3 6.137 0.552 10.929 1.00 0.00 C ATOM 832 CG1 ILE B 3 6.002 -0.777 10.181 1.00 0.00 C ATOM 833 CG2 ILE B 3 6.124 1.724 9.948 1.00 0.00 C ATOM 834 CD1 ILE B 3 4.678 -0.936 9.466 1.00 0.00 C ATOM 0 H ILE B 3 7.567 2.597 12.248 1.00 0.00 H new ATOM 0 HA ILE B 3 7.441 -0.348 12.387 1.00 0.00 H new ATOM 0 HB ILE B 3 5.283 0.661 11.597 1.00 0.00 H new ATOM 0 HG12 ILE B 3 6.810 -0.860 9.454 1.00 0.00 H new ATOM 0 HG13 ILE B 3 6.124 -1.597 10.889 1.00 0.00 H new ATOM 0 HG21 ILE B 3 5.209 1.693 9.357 1.00 0.00 H new ATOM 0 HG22 ILE B 3 6.167 2.662 10.501 1.00 0.00 H new ATOM 0 HG23 ILE B 3 6.987 1.654 9.286 1.00 0.00 H new ATOM 0 HD11 ILE B 3 4.652 -1.900 8.958 1.00 0.00 H new ATOM 0 HD12 ILE B 3 3.865 -0.886 10.190 1.00 0.00 H new ATOM 0 HD13 ILE B 3 4.562 -0.137 8.734 1.00 0.00 H new ATOM 846 N ALA B 4 9.279 -0.567 10.727 1.00 0.00 N ATOM 847 CA ALA B 4 10.398 -0.704 9.814 1.00 0.00 C ATOM 848 C ALA B 4 10.123 -1.814 8.813 1.00 0.00 C ATOM 849 O ALA B 4 9.330 -2.720 9.077 1.00 0.00 O ATOM 850 CB ALA B 4 11.676 -0.987 10.585 1.00 0.00 C ATOM 0 H ALA B 4 9.026 -1.425 11.217 1.00 0.00 H new ATOM 0 HA ALA B 4 10.524 0.232 9.270 1.00 0.00 H new ATOM 0 HB1 ALA B 4 12.507 -1.087 9.887 1.00 0.00 H new ATOM 0 HB2 ALA B 4 11.876 -0.165 11.272 1.00 0.00 H new ATOM 0 HB3 ALA B 4 11.563 -1.912 11.150 1.00 0.00 H new ATOM 856 N THR B 5 10.789 -1.738 7.666 1.00 0.00 N ATOM 857 CA THR B 5 10.626 -2.723 6.604 1.00 0.00 C ATOM 858 C THR B 5 11.154 -4.092 7.042 1.00 0.00 C ATOM 859 O THR B 5 10.940 -5.098 6.372 1.00 0.00 O ATOM 860 CB THR B 5 11.364 -2.265 5.328 1.00 0.00 C ATOM 861 OG1 THR B 5 11.130 -0.866 5.118 1.00 0.00 O ATOM 862 CG2 THR B 5 10.886 -3.036 4.105 1.00 0.00 C ATOM 0 H THR B 5 11.454 -0.996 7.447 1.00 0.00 H new ATOM 0 HA THR B 5 9.561 -2.812 6.390 1.00 0.00 H new ATOM 0 HB THR B 5 12.428 -2.457 5.465 1.00 0.00 H new ATOM 0 HG1 THR B 5 11.600 -0.574 4.309 1.00 0.00 H new ATOM 0 HG21 THR B 5 11.425 -2.690 3.223 1.00 0.00 H new ATOM 0 HG22 THR B 5 11.073 -4.100 4.250 1.00 0.00 H new ATOM 0 HG23 THR B 5 9.818 -2.871 3.965 1.00 0.00 H new ATOM 870 N ASP B 6 11.790 -4.122 8.209 1.00 0.00 N ATOM 871 CA ASP B 6 12.367 -5.346 8.746 1.00 0.00 C ATOM 872 C ASP B 6 11.286 -6.193 9.406 1.00 0.00 C ATOM 873 O ASP B 6 11.497 -7.370 9.701 1.00 0.00 O ATOM 874 CB ASP B 6 13.446 -5.021 9.786 1.00 0.00 C ATOM 875 CG ASP B 6 14.620 -4.247 9.218 1.00 0.00 C ATOM 876 OD1 ASP B 6 14.517 -3.007 9.084 1.00 0.00 O ATOM 877 OD2 ASP B 6 15.666 -4.872 8.934 1.00 0.00 O ATOM 0 H ASP B 6 11.919 -3.304 8.804 1.00 0.00 H new ATOM 0 HA ASP B 6 12.814 -5.899 7.920 1.00 0.00 H new ATOM 0 HB2 ASP B 6 12.998 -4.444 10.595 1.00 0.00 H new ATOM 0 HB3 ASP B 6 13.811 -5.951 10.222 1.00 0.00 H new ATOM 882 N ASP B 7 10.129 -5.590 9.646 1.00 0.00 N ATOM 883 CA ASP B 7 9.003 -6.310 10.230 1.00 0.00 C ATOM 884 C ASP B 7 7.954 -6.596 9.166 1.00 0.00 C ATOM 885 O ASP B 7 6.888 -7.139 9.453 1.00 0.00 O ATOM 886 CB ASP B 7 8.365 -5.497 11.361 1.00 0.00 C ATOM 887 CG ASP B 7 9.358 -5.078 12.425 1.00 0.00 C ATOM 888 OD1 ASP B 7 9.777 -5.934 13.234 1.00 0.00 O ATOM 889 OD2 ASP B 7 9.724 -3.887 12.463 1.00 0.00 O ATOM 0 H ASP B 7 9.945 -4.607 9.446 1.00 0.00 H new ATOM 0 HA ASP B 7 9.378 -7.249 10.636 1.00 0.00 H new ATOM 0 HB2 ASP B 7 7.895 -4.608 10.941 1.00 0.00 H new ATOM 0 HB3 ASP B 7 7.574 -6.087 11.823 1.00 0.00 H new ATOM 894 N LEU B 8 8.268 -6.234 7.931 1.00 0.00 N ATOM 895 CA LEU B 8 7.340 -6.416 6.823 1.00 0.00 C ATOM 896 C LEU B 8 7.939 -7.309 5.756 1.00 0.00 C ATOM 897 O LEU B 8 7.221 -8.040 5.075 1.00 0.00 O ATOM 898 CB LEU B 8 6.965 -5.066 6.228 1.00 0.00 C ATOM 899 CG LEU B 8 6.210 -4.157 7.181 1.00 0.00 C ATOM 900 CD1 LEU B 8 6.141 -2.744 6.624 1.00 0.00 C ATOM 901 CD2 LEU B 8 4.813 -4.702 7.433 1.00 0.00 C ATOM 0 H LEU B 8 9.159 -5.812 7.670 1.00 0.00 H new ATOM 0 HA LEU B 8 6.441 -6.899 7.206 1.00 0.00 H new ATOM 0 HB2 LEU B 8 7.874 -4.559 5.903 1.00 0.00 H new ATOM 0 HB3 LEU B 8 6.356 -5.229 5.339 1.00 0.00 H new ATOM 0 HG LEU B 8 6.745 -4.125 8.130 1.00 0.00 H new ATOM 0 HD11 LEU B 8 5.597 -2.105 7.319 1.00 0.00 H new ATOM 0 HD12 LEU B 8 7.151 -2.356 6.489 1.00 0.00 H new ATOM 0 HD13 LEU B 8 5.626 -2.756 5.663 1.00 0.00 H new ATOM 0 HD21 LEU B 8 4.283 -4.041 8.118 1.00 0.00 H new ATOM 0 HD22 LEU B 8 4.269 -4.759 6.490 1.00 0.00 H new ATOM 0 HD23 LEU B 8 4.884 -5.697 7.872 1.00 0.00 H new ATOM 913 N GLU B 9 9.258 -7.263 5.639 1.00 0.00 N ATOM 914 CA GLU B 9 9.973 -8.094 4.688 1.00 0.00 C ATOM 915 C GLU B 9 11.298 -8.552 5.291 1.00 0.00 C ATOM 916 O GLU B 9 11.934 -7.831 6.060 1.00 0.00 O ATOM 917 CB GLU B 9 10.196 -7.381 3.339 1.00 0.00 C ATOM 918 CG GLU B 9 8.903 -7.102 2.576 1.00 0.00 C ATOM 919 CD GLU B 9 9.074 -7.070 1.064 1.00 0.00 C ATOM 920 OE1 GLU B 9 9.530 -6.045 0.522 1.00 0.00 O ATOM 921 OE2 GLU B 9 8.711 -8.062 0.390 1.00 0.00 O ATOM 0 H GLU B 9 9.856 -6.653 6.196 1.00 0.00 H new ATOM 0 HA GLU B 9 9.355 -8.967 4.479 1.00 0.00 H new ATOM 0 HB2 GLU B 9 10.714 -6.439 3.517 1.00 0.00 H new ATOM 0 HB3 GLU B 9 10.850 -7.993 2.718 1.00 0.00 H new ATOM 0 HG2 GLU B 9 8.169 -7.866 2.833 1.00 0.00 H new ATOM 0 HG3 GLU B 9 8.497 -6.146 2.906 1.00 0.00 H new ATOM 928 N VAL B 10 11.686 -9.760 4.944 1.00 0.00 N ATOM 929 CA VAL B 10 12.890 -10.384 5.455 1.00 0.00 C ATOM 930 C VAL B 10 13.652 -10.995 4.284 1.00 0.00 C ATOM 931 O VAL B 10 13.045 -11.434 3.310 1.00 0.00 O ATOM 932 CB VAL B 10 12.541 -11.469 6.509 1.00 0.00 C ATOM 933 CG1 VAL B 10 11.607 -12.520 5.928 1.00 0.00 C ATOM 934 CG2 VAL B 10 13.798 -12.121 7.063 1.00 0.00 C ATOM 0 H VAL B 10 11.167 -10.346 4.290 1.00 0.00 H new ATOM 0 HA VAL B 10 13.511 -9.636 5.948 1.00 0.00 H new ATOM 0 HB VAL B 10 12.025 -10.973 7.331 1.00 0.00 H new ATOM 0 HG11 VAL B 10 11.381 -13.266 6.689 1.00 0.00 H new ATOM 0 HG12 VAL B 10 10.683 -12.044 5.600 1.00 0.00 H new ATOM 0 HG13 VAL B 10 12.088 -13.004 5.078 1.00 0.00 H new ATOM 0 HG21 VAL B 10 13.522 -12.876 7.799 1.00 0.00 H new ATOM 0 HG22 VAL B 10 14.352 -12.591 6.251 1.00 0.00 H new ATOM 0 HG23 VAL B 10 14.422 -11.364 7.537 1.00 0.00 H new ATOM 944 N ALA B 11 14.973 -11.000 4.362 1.00 0.00 N ATOM 945 CA ALA B 11 15.795 -11.482 3.265 1.00 0.00 C ATOM 946 C ALA B 11 15.586 -12.972 3.022 1.00 0.00 C ATOM 947 O ALA B 11 15.530 -13.770 3.958 1.00 0.00 O ATOM 948 CB ALA B 11 17.254 -11.176 3.565 1.00 0.00 C ATOM 0 H ALA B 11 15.499 -10.676 5.174 1.00 0.00 H new ATOM 0 HA ALA B 11 15.499 -10.969 2.350 1.00 0.00 H new ATOM 0 HB1 ALA B 11 17.877 -11.535 2.746 1.00 0.00 H new ATOM 0 HB2 ALA B 11 17.385 -10.100 3.675 1.00 0.00 H new ATOM 0 HB3 ALA B 11 17.548 -11.674 4.489 1.00 0.00 H new ATOM 954 N CYS B 12 15.464 -13.327 1.742 1.00 0.00 N ATOM 955 CA CYS B 12 15.068 -14.658 1.301 1.00 0.00 C ATOM 956 C CYS B 12 16.032 -15.790 1.676 1.00 0.00 C ATOM 957 O CYS B 12 17.121 -15.549 2.195 1.00 0.00 O ATOM 958 CB CYS B 12 14.931 -14.634 -0.214 1.00 0.00 C ATOM 959 SG CYS B 12 13.222 -14.616 -0.747 1.00 0.00 S ATOM 0 H CYS B 12 15.642 -12.683 0.971 1.00 0.00 H new ATOM 0 HA CYS B 12 14.134 -14.878 1.818 1.00 0.00 H new ATOM 0 HB2 CYS B 12 15.440 -13.755 -0.608 1.00 0.00 H new ATOM 0 HB3 CYS B 12 15.430 -15.507 -0.635 1.00 0.00 H new ATOM 0 HG CYS B 12 13.133 -14.017 -1.898 1.00 0.00 H new ATOM 964 N PRO B 13 15.617 -17.054 1.405 1.00 0.00 N ATOM 965 CA PRO B 13 16.486 -18.231 1.502 1.00 0.00 C ATOM 966 C PRO B 13 17.897 -17.993 0.958 1.00 0.00 C ATOM 967 O PRO B 13 18.885 -18.299 1.622 1.00 0.00 O ATOM 968 CB PRO B 13 15.753 -19.245 0.625 1.00 0.00 C ATOM 969 CG PRO B 13 14.309 -18.943 0.821 1.00 0.00 C ATOM 970 CD PRO B 13 14.227 -17.449 1.056 1.00 0.00 C ATOM 0 HA PRO B 13 16.643 -18.537 2.536 1.00 0.00 H new ATOM 0 HB2 PRO B 13 16.040 -19.143 -0.422 1.00 0.00 H new ATOM 0 HB3 PRO B 13 15.987 -20.267 0.922 1.00 0.00 H new ATOM 0 HG2 PRO B 13 13.727 -19.234 -0.053 1.00 0.00 H new ATOM 0 HG3 PRO B 13 13.906 -19.495 1.670 1.00 0.00 H new ATOM 0 HD2 PRO B 13 13.876 -16.925 0.167 1.00 0.00 H new ATOM 0 HD3 PRO B 13 13.532 -17.211 1.861 1.00 0.00 H new ATOM 978 N LYS B 14 17.977 -17.410 -0.241 1.00 0.00 N ATOM 979 CA LYS B 14 19.274 -17.268 -0.899 1.00 0.00 C ATOM 980 C LYS B 14 19.290 -16.239 -2.037 1.00 0.00 C ATOM 981 O LYS B 14 20.331 -16.035 -2.648 1.00 0.00 O ATOM 982 CB LYS B 14 19.798 -18.636 -1.379 1.00 0.00 C ATOM 983 CG LYS B 14 19.126 -19.213 -2.624 1.00 0.00 C ATOM 984 CD LYS B 14 19.921 -18.884 -3.889 1.00 0.00 C ATOM 985 CE LYS B 14 19.513 -19.768 -5.061 1.00 0.00 C ATOM 986 NZ LYS B 14 19.854 -21.196 -4.830 1.00 0.00 N ATOM 0 H LYS B 14 17.183 -17.039 -0.762 1.00 0.00 H new ATOM 0 HA LYS B 14 19.950 -16.873 -0.141 1.00 0.00 H new ATOM 0 HB2 LYS B 14 20.866 -18.544 -1.577 1.00 0.00 H new ATOM 0 HB3 LYS B 14 19.685 -19.352 -0.565 1.00 0.00 H new ATOM 0 HG2 LYS B 14 19.033 -20.294 -2.521 1.00 0.00 H new ATOM 0 HG3 LYS B 14 18.116 -18.813 -2.713 1.00 0.00 H new ATOM 0 HD2 LYS B 14 19.767 -17.838 -4.153 1.00 0.00 H new ATOM 0 HD3 LYS B 14 20.986 -19.010 -3.692 1.00 0.00 H new ATOM 0 HE2 LYS B 14 18.440 -19.675 -5.229 1.00 0.00 H new ATOM 0 HE3 LYS B 14 20.009 -19.419 -5.967 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 19.882 -21.698 -5.740 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 20.785 -21.261 -4.370 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 19.134 -21.630 -4.217 1.00 0.00 H new ATOM 1000 N CYS B 15 18.172 -15.572 -2.339 1.00 0.00 N ATOM 1001 CA CYS B 15 18.235 -14.557 -3.399 1.00 0.00 C ATOM 1002 C CYS B 15 18.014 -13.140 -2.918 1.00 0.00 C ATOM 1003 O CYS B 15 17.460 -12.320 -3.649 1.00 0.00 O ATOM 1004 CB CYS B 15 17.158 -14.830 -4.442 1.00 0.00 C ATOM 1005 SG CYS B 15 15.496 -15.093 -3.731 1.00 0.00 S ATOM 0 H CYS B 15 17.262 -15.702 -1.896 1.00 0.00 H new ATOM 0 HA CYS B 15 19.246 -14.632 -3.800 1.00 0.00 H new ATOM 0 HB2 CYS B 15 17.117 -13.992 -5.137 1.00 0.00 H new ATOM 0 HB3 CYS B 15 17.439 -15.710 -5.020 1.00 0.00 H new ATOM 0 HG CYS B 15 14.695 -14.156 -4.143 1.00 0.00 H new ATOM 1010 N GLU B 16 18.540 -12.818 -1.766 1.00 0.00 N ATOM 1011 CA GLU B 16 18.372 -11.495 -1.204 1.00 0.00 C ATOM 1012 C GLU B 16 19.500 -10.589 -1.641 1.00 0.00 C ATOM 1013 O GLU B 16 19.780 -9.579 -1.004 1.00 0.00 O ATOM 1014 CB GLU B 16 18.371 -11.583 0.321 1.00 0.00 C ATOM 1015 CG GLU B 16 18.337 -13.000 0.861 1.00 0.00 C ATOM 1016 CD GLU B 16 19.714 -13.620 0.910 1.00 0.00 C ATOM 1017 OE1 GLU B 16 20.395 -13.477 1.945 1.00 0.00 O ATOM 1018 OE2 GLU B 16 20.126 -14.235 -0.091 1.00 0.00 O ATOM 0 H GLU B 16 19.092 -13.455 -1.192 1.00 0.00 H new ATOM 0 HA GLU B 16 17.425 -11.086 -1.557 1.00 0.00 H new ATOM 0 HB2 GLU B 16 19.260 -11.081 0.703 1.00 0.00 H new ATOM 0 HB3 GLU B 16 17.508 -11.039 0.705 1.00 0.00 H new ATOM 0 HG2 GLU B 16 17.905 -12.996 1.862 1.00 0.00 H new ATOM 0 HG3 GLU B 16 17.686 -13.611 0.235 1.00 0.00 H new ATOM 1025 N ARG B 17 20.133 -10.936 -2.746 1.00 0.00 N ATOM 1026 CA ARG B 17 21.316 -10.238 -3.191 1.00 0.00 C ATOM 1027 C ARG B 17 21.311 -10.250 -4.721 1.00 0.00 C ATOM 1028 O ARG B 17 22.123 -9.594 -5.365 1.00 0.00 O ATOM 1029 CB ARG B 17 22.601 -10.856 -2.604 1.00 0.00 C ATOM 1030 CG ARG B 17 22.672 -12.383 -2.639 1.00 0.00 C ATOM 1031 CD ARG B 17 23.007 -12.922 -4.022 1.00 0.00 C ATOM 1032 NE ARG B 17 24.289 -12.412 -4.512 1.00 0.00 N ATOM 1033 CZ ARG B 17 25.044 -13.020 -5.427 1.00 0.00 C ATOM 1034 NH1 ARG B 17 24.679 -14.197 -5.929 1.00 0.00 N ATOM 1035 NH2 ARG B 17 26.178 -12.455 -5.825 1.00 0.00 N ATOM 0 H ARG B 17 19.842 -11.703 -3.353 1.00 0.00 H new ATOM 0 HA ARG B 17 21.304 -9.209 -2.832 1.00 0.00 H new ATOM 0 HB2 ARG B 17 23.457 -10.457 -3.149 1.00 0.00 H new ATOM 0 HB3 ARG B 17 22.701 -10.529 -1.569 1.00 0.00 H new ATOM 0 HG2 ARG B 17 23.424 -12.724 -1.928 1.00 0.00 H new ATOM 0 HG3 ARG B 17 21.717 -12.795 -2.314 1.00 0.00 H new ATOM 0 HD2 ARG B 17 23.038 -14.011 -3.989 1.00 0.00 H new ATOM 0 HD3 ARG B 17 22.216 -12.647 -4.720 1.00 0.00 H new ATOM 0 HE ARG B 17 24.628 -11.531 -4.127 1.00 0.00 H new ATOM 0 HH11 ARG B 17 23.816 -14.640 -5.614 1.00 0.00 H new ATOM 0 HH12 ARG B 17 25.262 -14.656 -6.629 1.00 0.00 H new ATOM 0 HH21 ARG B 17 26.468 -11.560 -5.431 1.00 0.00 H new ATOM 0 HH22 ARG B 17 26.759 -12.916 -6.525 1.00 0.00 H new ATOM 1049 N ALA B 18 20.365 -11.018 -5.293 1.00 0.00 N ATOM 1050 CA ALA B 18 20.278 -11.166 -6.743 1.00 0.00 C ATOM 1051 C ALA B 18 18.844 -11.038 -7.255 1.00 0.00 C ATOM 1052 O ALA B 18 18.616 -10.487 -8.327 1.00 0.00 O ATOM 1053 CB ALA B 18 20.881 -12.493 -7.197 1.00 0.00 C ATOM 0 H ALA B 18 19.659 -11.538 -4.772 1.00 0.00 H new ATOM 0 HA ALA B 18 20.856 -10.349 -7.174 1.00 0.00 H new ATOM 0 HB1 ALA B 18 20.803 -12.576 -8.281 1.00 0.00 H new ATOM 0 HB2 ALA B 18 21.930 -12.535 -6.905 1.00 0.00 H new ATOM 0 HB3 ALA B 18 20.341 -13.317 -6.730 1.00 0.00 H new ATOM 1059 N GLY B 19 17.875 -11.526 -6.482 1.00 0.00 N ATOM 1060 CA GLY B 19 16.493 -11.492 -6.932 1.00 0.00 C ATOM 1061 C GLY B 19 16.132 -12.661 -7.843 1.00 0.00 C ATOM 1062 O GLY B 19 15.132 -12.607 -8.555 1.00 0.00 O ATOM 0 H GLY B 19 18.020 -11.940 -5.561 1.00 0.00 H new ATOM 0 HA2 GLY B 19 15.834 -11.499 -6.064 1.00 0.00 H new ATOM 0 HA3 GLY B 19 16.312 -10.557 -7.462 1.00 0.00 H new ATOM 1066 N GLU B 20 16.910 -13.739 -7.768 1.00 0.00 N ATOM 1067 CA GLU B 20 16.662 -14.932 -8.584 1.00 0.00 C ATOM 1068 C GLU B 20 16.970 -16.184 -7.812 1.00 0.00 C ATOM 1069 O GLU B 20 17.666 -16.164 -6.805 1.00 0.00 O ATOM 1070 CB GLU B 20 17.506 -15.013 -9.852 1.00 0.00 C ATOM 1071 CG GLU B 20 18.961 -14.666 -9.638 1.00 0.00 C ATOM 1072 CD GLU B 20 19.889 -15.498 -10.498 1.00 0.00 C ATOM 1073 OE1 GLU B 20 20.086 -16.695 -10.189 1.00 0.00 O ATOM 1074 OE2 GLU B 20 20.445 -14.959 -11.470 1.00 0.00 O ATOM 0 H GLU B 20 17.719 -13.814 -7.151 1.00 0.00 H new ATOM 0 HA GLU B 20 15.609 -14.849 -8.855 1.00 0.00 H new ATOM 0 HB2 GLU B 20 17.439 -16.022 -10.259 1.00 0.00 H new ATOM 0 HB3 GLU B 20 17.087 -14.339 -10.600 1.00 0.00 H new ATOM 0 HG2 GLU B 20 19.115 -13.610 -9.859 1.00 0.00 H new ATOM 0 HG3 GLU B 20 19.215 -14.812 -8.588 1.00 0.00 H new ATOM 1081 N ILE B 21 16.482 -17.272 -8.334 1.00 0.00 N ATOM 1082 CA ILE B 21 16.817 -18.578 -7.847 1.00 0.00 C ATOM 1083 C ILE B 21 17.234 -19.422 -9.025 1.00 0.00 C ATOM 1084 O ILE B 21 16.404 -19.757 -9.860 1.00 0.00 O ATOM 1085 CB ILE B 21 15.621 -19.248 -7.157 1.00 0.00 C ATOM 1086 CG1 ILE B 21 15.166 -18.429 -5.948 1.00 0.00 C ATOM 1087 CG2 ILE B 21 15.973 -20.672 -6.754 1.00 0.00 C ATOM 1088 CD1 ILE B 21 16.140 -18.419 -4.790 1.00 0.00 C ATOM 0 H ILE B 21 15.832 -17.277 -9.120 1.00 0.00 H new ATOM 0 HA ILE B 21 17.620 -18.485 -7.115 1.00 0.00 H new ATOM 0 HB ILE B 21 14.791 -19.290 -7.862 1.00 0.00 H new ATOM 0 HG12 ILE B 21 14.991 -17.402 -6.267 1.00 0.00 H new ATOM 0 HG13 ILE B 21 14.211 -18.821 -5.599 1.00 0.00 H new ATOM 0 HG21 ILE B 21 15.115 -21.135 -6.266 1.00 0.00 H new ATOM 0 HG22 ILE B 21 16.239 -21.246 -7.642 1.00 0.00 H new ATOM 0 HG23 ILE B 21 16.818 -20.657 -6.065 1.00 0.00 H new ATOM 0 HD11 ILE B 21 15.735 -17.814 -3.979 1.00 0.00 H new ATOM 0 HD12 ILE B 21 16.298 -19.439 -4.439 1.00 0.00 H new ATOM 0 HD13 ILE B 21 17.090 -17.997 -5.117 1.00 0.00 H new ATOM 1100 N GLU B 22 18.514 -19.736 -9.105 1.00 0.00 N ATOM 1101 CA GLU B 22 19.015 -20.590 -10.172 1.00 0.00 C ATOM 1102 C GLU B 22 18.715 -19.976 -11.551 1.00 0.00 C ATOM 1103 O GLU B 22 18.164 -20.647 -12.421 1.00 0.00 O ATOM 1104 CB GLU B 22 18.329 -21.958 -10.052 1.00 0.00 C ATOM 1105 CG GLU B 22 19.214 -23.139 -10.379 1.00 0.00 C ATOM 1106 CD GLU B 22 20.357 -23.265 -9.401 1.00 0.00 C ATOM 1107 OE1 GLU B 22 20.103 -23.598 -8.229 1.00 0.00 O ATOM 1108 OE2 GLU B 22 21.515 -23.035 -9.799 1.00 0.00 O ATOM 0 H GLU B 22 19.225 -19.415 -8.448 1.00 0.00 H new ATOM 0 HA GLU B 22 20.096 -20.694 -10.079 1.00 0.00 H new ATOM 0 HB2 GLU B 22 17.954 -22.073 -9.035 1.00 0.00 H new ATOM 0 HB3 GLU B 22 17.464 -21.975 -10.715 1.00 0.00 H new ATOM 0 HG2 GLU B 22 18.621 -24.053 -10.366 1.00 0.00 H new ATOM 0 HG3 GLU B 22 19.609 -23.030 -11.389 1.00 0.00 H new ATOM 1115 N GLY B 23 19.033 -18.691 -11.740 1.00 0.00 N ATOM 1116 CA GLY B 23 18.758 -18.026 -13.017 1.00 0.00 C ATOM 1117 C GLY B 23 17.278 -17.980 -13.339 1.00 0.00 C ATOM 1118 O GLY B 23 16.869 -17.671 -14.461 1.00 0.00 O ATOM 0 H GLY B 23 19.474 -18.099 -11.037 1.00 0.00 H new ATOM 0 HA2 GLY B 23 19.152 -17.010 -12.986 1.00 0.00 H new ATOM 0 HA3 GLY B 23 19.285 -18.548 -13.816 1.00 0.00 H new ATOM 1122 N THR B 24 16.499 -18.296 -12.337 1.00 0.00 N ATOM 1123 CA THR B 24 15.082 -18.527 -12.480 1.00 0.00 C ATOM 1124 C THR B 24 14.282 -17.684 -11.481 1.00 0.00 C ATOM 1125 O THR B 24 14.737 -17.430 -10.363 1.00 0.00 O ATOM 1126 CB THR B 24 14.846 -20.047 -12.302 1.00 0.00 C ATOM 1127 OG1 THR B 24 14.745 -20.677 -13.581 1.00 0.00 O ATOM 1128 CG2 THR B 24 13.624 -20.380 -11.458 1.00 0.00 C ATOM 0 H THR B 24 16.837 -18.402 -11.380 1.00 0.00 H new ATOM 0 HA THR B 24 14.732 -18.218 -13.465 1.00 0.00 H new ATOM 0 HB THR B 24 15.708 -20.432 -11.758 1.00 0.00 H new ATOM 0 HG1 THR B 24 14.598 -21.638 -13.461 1.00 0.00 H new ATOM 0 HG21 THR B 24 13.522 -21.462 -11.377 1.00 0.00 H new ATOM 0 HG22 THR B 24 13.741 -19.951 -10.463 1.00 0.00 H new ATOM 0 HG23 THR B 24 12.733 -19.966 -11.929 1.00 0.00 H new ATOM 1136 N PRO B 25 13.089 -17.208 -11.895 1.00 0.00 N ATOM 1137 CA PRO B 25 12.246 -16.348 -11.058 1.00 0.00 C ATOM 1138 C PRO B 25 11.891 -17.017 -9.737 1.00 0.00 C ATOM 1139 O PRO B 25 11.494 -18.183 -9.697 1.00 0.00 O ATOM 1140 CB PRO B 25 10.996 -16.106 -11.911 1.00 0.00 C ATOM 1141 CG PRO B 25 11.009 -17.197 -12.928 1.00 0.00 C ATOM 1142 CD PRO B 25 12.460 -17.478 -13.200 1.00 0.00 C ATOM 0 HA PRO B 25 12.751 -15.423 -10.781 1.00 0.00 H new ATOM 0 HB2 PRO B 25 10.091 -16.142 -11.305 1.00 0.00 H new ATOM 0 HB3 PRO B 25 11.024 -15.124 -12.384 1.00 0.00 H new ATOM 0 HG2 PRO B 25 10.501 -18.086 -12.555 1.00 0.00 H new ATOM 0 HG3 PRO B 25 10.492 -16.891 -13.837 1.00 0.00 H new ATOM 0 HD2 PRO B 25 12.620 -18.507 -13.522 1.00 0.00 H new ATOM 0 HD3 PRO B 25 12.858 -16.833 -13.983 1.00 0.00 H new ATOM 1150 N CYS B 26 12.052 -16.272 -8.658 1.00 0.00 N ATOM 1151 CA CYS B 26 11.933 -16.826 -7.327 1.00 0.00 C ATOM 1152 C CYS B 26 10.481 -16.918 -6.852 1.00 0.00 C ATOM 1153 O CYS B 26 9.713 -15.970 -6.999 1.00 0.00 O ATOM 1154 CB CYS B 26 12.746 -15.985 -6.357 1.00 0.00 C ATOM 1155 SG CYS B 26 12.802 -16.678 -4.688 1.00 0.00 S ATOM 0 H CYS B 26 12.267 -15.275 -8.682 1.00 0.00 H new ATOM 0 HA CYS B 26 12.318 -17.845 -7.360 1.00 0.00 H new ATOM 0 HB2 CYS B 26 13.763 -15.885 -6.736 1.00 0.00 H new ATOM 0 HB3 CYS B 26 12.323 -14.982 -6.313 1.00 0.00 H new ATOM 0 HG CYS B 26 13.708 -16.059 -3.991 1.00 0.00 H new ATOM 1160 N PRO B 27 10.127 -18.078 -6.253 1.00 0.00 N ATOM 1161 CA PRO B 27 8.782 -18.405 -5.745 1.00 0.00 C ATOM 1162 C PRO B 27 7.970 -17.229 -5.186 1.00 0.00 C ATOM 1163 O PRO B 27 6.894 -16.905 -5.684 1.00 0.00 O ATOM 1164 CB PRO B 27 9.109 -19.360 -4.602 1.00 0.00 C ATOM 1165 CG PRO B 27 10.349 -20.082 -5.010 1.00 0.00 C ATOM 1166 CD PRO B 27 11.040 -19.224 -6.054 1.00 0.00 C ATOM 0 HA PRO B 27 8.155 -18.785 -6.552 1.00 0.00 H new ATOM 0 HB2 PRO B 27 9.264 -18.815 -3.671 1.00 0.00 H new ATOM 0 HB3 PRO B 27 8.290 -20.058 -4.431 1.00 0.00 H new ATOM 0 HG2 PRO B 27 11.001 -20.244 -4.152 1.00 0.00 H new ATOM 0 HG3 PRO B 27 10.107 -21.064 -5.417 1.00 0.00 H new ATOM 0 HD2 PRO B 27 12.021 -18.895 -5.712 1.00 0.00 H new ATOM 0 HD3 PRO B 27 11.194 -19.775 -6.982 1.00 0.00 H new ATOM 1174 N ALA B 28 8.518 -16.585 -4.162 1.00 0.00 N ATOM 1175 CA ALA B 28 7.753 -15.635 -3.353 1.00 0.00 C ATOM 1176 C ALA B 28 8.308 -14.224 -3.481 1.00 0.00 C ATOM 1177 O ALA B 28 7.699 -13.254 -3.033 1.00 0.00 O ATOM 1178 CB ALA B 28 7.746 -16.073 -1.896 1.00 0.00 C ATOM 0 H ALA B 28 9.488 -16.701 -3.870 1.00 0.00 H new ATOM 0 HA ALA B 28 6.729 -15.624 -3.725 1.00 0.00 H new ATOM 0 HB1 ALA B 28 7.174 -15.359 -1.304 1.00 0.00 H new ATOM 0 HB2 ALA B 28 7.289 -17.059 -1.815 1.00 0.00 H new ATOM 0 HB3 ALA B 28 8.770 -16.115 -1.524 1.00 0.00 H new ATOM 1184 N CYS B 29 9.476 -14.118 -4.080 1.00 0.00 N ATOM 1185 CA CYS B 29 10.092 -12.826 -4.306 1.00 0.00 C ATOM 1186 C CYS B 29 10.497 -12.730 -5.774 1.00 0.00 C ATOM 1187 O CYS B 29 11.585 -13.148 -6.156 1.00 0.00 O ATOM 1188 CB CYS B 29 11.306 -12.646 -3.360 1.00 0.00 C ATOM 1189 SG CYS B 29 12.803 -13.590 -3.809 1.00 0.00 S ATOM 0 H CYS B 29 10.019 -14.912 -4.420 1.00 0.00 H new ATOM 0 HA CYS B 29 9.389 -12.023 -4.085 1.00 0.00 H new ATOM 0 HB2 CYS B 29 11.563 -11.587 -3.325 1.00 0.00 H new ATOM 0 HB3 CYS B 29 11.005 -12.934 -2.353 1.00 0.00 H new ATOM 0 HG CYS B 29 12.469 -14.803 -4.136 1.00 0.00 H new ATOM 1194 N SER B 30 9.606 -12.220 -6.617 1.00 0.00 N ATOM 1195 CA SER B 30 9.844 -12.202 -8.053 1.00 0.00 C ATOM 1196 C SER B 30 10.863 -11.133 -8.452 1.00 0.00 C ATOM 1197 O SER B 30 10.595 -10.284 -9.300 1.00 0.00 O ATOM 1198 CB SER B 30 8.520 -11.978 -8.779 1.00 0.00 C ATOM 1199 OG SER B 30 7.525 -12.865 -8.291 1.00 0.00 O ATOM 0 H SER B 30 8.715 -11.815 -6.330 1.00 0.00 H new ATOM 0 HA SER B 30 10.265 -13.165 -8.342 1.00 0.00 H new ATOM 0 HB2 SER B 30 8.194 -10.947 -8.642 1.00 0.00 H new ATOM 0 HB3 SER B 30 8.656 -12.130 -9.850 1.00 0.00 H new ATOM 0 HG SER B 30 6.683 -12.706 -8.767 1.00 0.00 H new ATOM 1205 N GLY B 31 12.030 -11.186 -7.827 1.00 0.00 N ATOM 1206 CA GLY B 31 13.096 -10.273 -8.157 1.00 0.00 C ATOM 1207 C GLY B 31 13.091 -9.065 -7.257 1.00 0.00 C ATOM 1208 O GLY B 31 13.148 -7.928 -7.724 1.00 0.00 O ATOM 0 H GLY B 31 12.255 -11.854 -7.090 1.00 0.00 H new ATOM 0 HA2 GLY B 31 14.054 -10.786 -8.073 1.00 0.00 H new ATOM 0 HA3 GLY B 31 12.995 -9.955 -9.195 1.00 0.00 H new ATOM 1212 N LYS B 32 13.011 -9.304 -5.955 1.00 0.00 N ATOM 1213 CA LYS B 32 13.003 -8.239 -4.970 1.00 0.00 C ATOM 1214 C LYS B 32 14.208 -8.396 -4.047 1.00 0.00 C ATOM 1215 O LYS B 32 14.876 -7.425 -3.705 1.00 0.00 O ATOM 1216 CB LYS B 32 11.725 -8.328 -4.137 1.00 0.00 C ATOM 1217 CG LYS B 32 10.472 -7.854 -4.857 1.00 0.00 C ATOM 1218 CD LYS B 32 9.213 -8.525 -4.310 1.00 0.00 C ATOM 1219 CE LYS B 32 9.223 -8.638 -2.788 1.00 0.00 C ATOM 1220 NZ LYS B 32 9.354 -7.315 -2.111 1.00 0.00 N ATOM 0 H LYS B 32 12.950 -10.241 -5.556 1.00 0.00 H new ATOM 0 HA LYS B 32 13.047 -7.275 -5.477 1.00 0.00 H new ATOM 0 HB2 LYS B 32 11.581 -9.362 -3.825 1.00 0.00 H new ATOM 0 HB3 LYS B 32 11.854 -7.736 -3.231 1.00 0.00 H new ATOM 0 HG2 LYS B 32 10.381 -6.773 -4.754 1.00 0.00 H new ATOM 0 HG3 LYS B 32 10.563 -8.066 -5.922 1.00 0.00 H new ATOM 0 HD2 LYS B 32 8.337 -7.956 -4.623 1.00 0.00 H new ATOM 0 HD3 LYS B 32 9.118 -9.520 -4.744 1.00 0.00 H new ATOM 0 HE2 LYS B 32 8.303 -9.120 -2.458 1.00 0.00 H new ATOM 0 HE3 LYS B 32 10.048 -9.281 -2.481 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 9.441 -7.457 -1.084 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 10.201 -6.826 -2.465 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 8.512 -6.738 -2.311 1.00 0.00 H new ATOM 1234 N GLY B 33 14.461 -9.643 -3.637 1.00 0.00 N ATOM 1235 CA GLY B 33 15.530 -9.938 -2.718 1.00 0.00 C ATOM 1236 C GLY B 33 14.978 -10.439 -1.401 1.00 0.00 C ATOM 1237 O GLY B 33 15.494 -11.387 -0.812 1.00 0.00 O ATOM 0 H GLY B 33 13.928 -10.459 -3.938 1.00 0.00 H new ATOM 0 HA2 GLY B 33 16.191 -10.689 -3.150 1.00 0.00 H new ATOM 0 HA3 GLY B 33 16.130 -9.043 -2.550 1.00 0.00 H new ATOM 1241 N VAL B 34 13.874 -9.846 -0.975 1.00 0.00 N ATOM 1242 CA VAL B 34 13.280 -10.168 0.314 1.00 0.00 C ATOM 1243 C VAL B 34 11.878 -10.763 0.157 1.00 0.00 C ATOM 1244 O VAL B 34 11.275 -10.688 -0.920 1.00 0.00 O ATOM 1245 CB VAL B 34 13.198 -8.908 1.204 1.00 0.00 C ATOM 1246 CG1 VAL B 34 14.588 -8.399 1.563 1.00 0.00 C ATOM 1247 CG2 VAL B 34 12.404 -7.814 0.510 1.00 0.00 C ATOM 0 H VAL B 34 13.369 -9.136 -1.505 1.00 0.00 H new ATOM 0 HA VAL B 34 13.923 -10.911 0.786 1.00 0.00 H new ATOM 0 HB VAL B 34 12.686 -9.184 2.126 1.00 0.00 H new ATOM 0 HG11 VAL B 34 14.500 -7.512 2.190 1.00 0.00 H new ATOM 0 HG12 VAL B 34 15.130 -9.174 2.105 1.00 0.00 H new ATOM 0 HG13 VAL B 34 15.130 -8.147 0.651 1.00 0.00 H new ATOM 0 HG21 VAL B 34 12.357 -6.935 1.153 1.00 0.00 H new ATOM 0 HG22 VAL B 34 12.891 -7.551 -0.429 1.00 0.00 H new ATOM 0 HG23 VAL B 34 11.394 -8.170 0.308 1.00 0.00 H new ATOM 1257 N ILE B 35 11.386 -11.359 1.235 1.00 0.00 N ATOM 1258 CA ILE B 35 10.034 -11.904 1.295 1.00 0.00 C ATOM 1259 C ILE B 35 9.280 -11.299 2.470 1.00 0.00 C ATOM 1260 O ILE B 35 9.886 -10.797 3.402 1.00 0.00 O ATOM 1261 CB ILE B 35 10.026 -13.439 1.440 1.00 0.00 C ATOM 1262 CG1 ILE B 35 11.161 -13.889 2.364 1.00 0.00 C ATOM 1263 CG2 ILE B 35 10.126 -14.101 0.077 1.00 0.00 C ATOM 1264 CD1 ILE B 35 11.148 -15.370 2.680 1.00 0.00 C ATOM 0 H ILE B 35 11.916 -11.479 2.098 1.00 0.00 H new ATOM 0 HA ILE B 35 9.548 -11.648 0.354 1.00 0.00 H new ATOM 0 HB ILE B 35 9.083 -13.748 1.891 1.00 0.00 H new ATOM 0 HG12 ILE B 35 12.115 -13.635 1.901 1.00 0.00 H new ATOM 0 HG13 ILE B 35 11.100 -13.328 3.297 1.00 0.00 H new ATOM 0 HG21 ILE B 35 10.119 -15.184 0.197 1.00 0.00 H new ATOM 0 HG22 ILE B 35 9.278 -13.799 -0.537 1.00 0.00 H new ATOM 0 HG23 ILE B 35 11.053 -13.796 -0.409 1.00 0.00 H new ATOM 0 HD11 ILE B 35 11.983 -15.609 3.339 1.00 0.00 H new ATOM 0 HD12 ILE B 35 10.211 -15.629 3.173 1.00 0.00 H new ATOM 0 HD13 ILE B 35 11.241 -15.940 1.756 1.00 0.00 H new ATOM 1276 N LEU B 36 7.964 -11.367 2.424 1.00 0.00 N ATOM 1277 CA LEU B 36 7.135 -10.661 3.393 1.00 0.00 C ATOM 1278 C LEU B 36 6.898 -11.456 4.668 1.00 0.00 C ATOM 1279 O LEU B 36 7.155 -12.659 4.741 1.00 0.00 O ATOM 1280 CB LEU B 36 5.784 -10.309 2.772 1.00 0.00 C ATOM 1281 CG LEU B 36 5.859 -9.516 1.472 1.00 0.00 C ATOM 1282 CD1 LEU B 36 5.792 -10.439 0.265 1.00 0.00 C ATOM 1283 CD2 LEU B 36 4.756 -8.481 1.432 1.00 0.00 C ATOM 0 H LEU B 36 7.443 -11.902 1.729 1.00 0.00 H new ATOM 0 HA LEU B 36 7.683 -9.758 3.664 1.00 0.00 H new ATOM 0 HB2 LEU B 36 5.235 -11.232 2.586 1.00 0.00 H new ATOM 0 HB3 LEU B 36 5.206 -9.736 3.497 1.00 0.00 H new ATOM 0 HG LEU B 36 6.818 -8.999 1.434 1.00 0.00 H new ATOM 0 HD11 LEU B 36 5.847 -9.848 -0.649 1.00 0.00 H new ATOM 0 HD12 LEU B 36 6.627 -11.139 0.295 1.00 0.00 H new ATOM 0 HD13 LEU B 36 4.853 -10.993 0.282 1.00 0.00 H new ATOM 0 HD21 LEU B 36 4.818 -7.919 0.500 1.00 0.00 H new ATOM 0 HD22 LEU B 36 3.788 -8.978 1.493 1.00 0.00 H new ATOM 0 HD23 LEU B 36 4.867 -7.799 2.275 1.00 0.00 H new ATOM 1295 N THR B 37 6.383 -10.748 5.664 1.00 0.00 N ATOM 1296 CA THR B 37 6.006 -11.331 6.936 1.00 0.00 C ATOM 1297 C THR B 37 4.491 -11.447 6.967 1.00 0.00 C ATOM 1298 O THR B 37 3.840 -11.057 6.006 1.00 0.00 O ATOM 1299 CB THR B 37 6.448 -10.426 8.110 1.00 0.00 C ATOM 1300 OG1 THR B 37 5.667 -9.217 8.111 1.00 0.00 O ATOM 1301 CG2 THR B 37 7.922 -10.059 8.010 1.00 0.00 C ATOM 0 H THR B 37 6.215 -9.744 5.607 1.00 0.00 H new ATOM 0 HA THR B 37 6.487 -12.303 7.041 1.00 0.00 H new ATOM 0 HB THR B 37 6.291 -10.982 9.034 1.00 0.00 H new ATOM 0 HG1 THR B 37 6.140 -8.522 8.614 1.00 0.00 H new ATOM 0 HG21 THR B 37 8.196 -9.423 8.851 1.00 0.00 H new ATOM 0 HG22 THR B 37 8.525 -10.967 8.030 1.00 0.00 H new ATOM 0 HG23 THR B 37 8.101 -9.524 7.077 1.00 0.00 H new ATOM 1309 N ALA B 38 3.920 -11.953 8.046 1.00 0.00 N ATOM 1310 CA ALA B 38 2.469 -12.046 8.139 1.00 0.00 C ATOM 1311 C ALA B 38 1.841 -10.657 8.072 1.00 0.00 C ATOM 1312 O ALA B 38 0.838 -10.450 7.382 1.00 0.00 O ATOM 1313 CB ALA B 38 2.057 -12.768 9.407 1.00 0.00 C ATOM 0 H ALA B 38 4.427 -12.302 8.860 1.00 0.00 H new ATOM 0 HA ALA B 38 2.105 -12.626 7.291 1.00 0.00 H new ATOM 0 HB1 ALA B 38 0.970 -12.826 9.456 1.00 0.00 H new ATOM 0 HB2 ALA B 38 2.474 -13.775 9.404 1.00 0.00 H new ATOM 0 HB3 ALA B 38 2.430 -12.223 10.274 1.00 0.00 H new ATOM 1319 N GLN B 39 2.440 -9.704 8.784 1.00 0.00 N ATOM 1320 CA GLN B 39 2.007 -8.317 8.712 1.00 0.00 C ATOM 1321 C GLN B 39 2.151 -7.788 7.291 1.00 0.00 C ATOM 1322 O GLN B 39 1.253 -7.120 6.778 1.00 0.00 O ATOM 1323 CB GLN B 39 2.810 -7.440 9.674 1.00 0.00 C ATOM 1324 CG GLN B 39 2.297 -6.012 9.751 1.00 0.00 C ATOM 1325 CD GLN B 39 3.073 -5.167 10.733 1.00 0.00 C ATOM 1326 OE1 GLN B 39 3.583 -5.663 11.735 1.00 0.00 O ATOM 1327 NE2 GLN B 39 3.166 -3.881 10.446 1.00 0.00 N ATOM 0 H GLN B 39 3.224 -9.870 9.415 1.00 0.00 H new ATOM 0 HA GLN B 39 0.957 -8.280 9.003 1.00 0.00 H new ATOM 0 HB2 GLN B 39 2.782 -7.884 10.669 1.00 0.00 H new ATOM 0 HB3 GLN B 39 3.854 -7.428 9.360 1.00 0.00 H new ATOM 0 HG2 GLN B 39 2.353 -5.556 8.762 1.00 0.00 H new ATOM 0 HG3 GLN B 39 1.246 -6.023 10.038 1.00 0.00 H new ATOM 0 HE21 GLN B 39 2.726 -3.514 9.602 1.00 0.00 H new ATOM 0 HE22 GLN B 39 3.678 -3.255 11.068 1.00 0.00 H new ATOM 1336 N GLY B 40 3.269 -8.111 6.646 1.00 0.00 N ATOM 1337 CA GLY B 40 3.493 -7.656 5.292 1.00 0.00 C ATOM 1338 C GLY B 40 2.566 -8.338 4.310 1.00 0.00 C ATOM 1339 O GLY B 40 2.162 -7.749 3.316 1.00 0.00 O ATOM 0 H GLY B 40 4.020 -8.679 7.039 1.00 0.00 H new ATOM 0 HA2 GLY B 40 3.346 -6.577 5.242 1.00 0.00 H new ATOM 0 HA3 GLY B 40 4.528 -7.850 5.010 1.00 0.00 H new ATOM 1343 N TYR B 41 2.212 -9.580 4.608 1.00 0.00 N ATOM 1344 CA TYR B 41 1.286 -10.339 3.781 1.00 0.00 C ATOM 1345 C TYR B 41 -0.127 -9.785 3.874 1.00 0.00 C ATOM 1346 O TYR B 41 -0.860 -9.784 2.885 1.00 0.00 O ATOM 1347 CB TYR B 41 1.293 -11.807 4.217 1.00 0.00 C ATOM 1348 CG TYR B 41 2.168 -12.701 3.365 1.00 0.00 C ATOM 1349 CD1 TYR B 41 1.684 -13.250 2.183 1.00 0.00 C ATOM 1350 CD2 TYR B 41 3.467 -13.008 3.745 1.00 0.00 C ATOM 1351 CE1 TYR B 41 2.474 -14.074 1.404 1.00 0.00 C ATOM 1352 CE2 TYR B 41 4.262 -13.831 2.971 1.00 0.00 C ATOM 1353 CZ TYR B 41 3.760 -14.361 1.802 1.00 0.00 C ATOM 1354 OH TYR B 41 4.548 -15.185 1.030 1.00 0.00 O ATOM 0 H TYR B 41 2.556 -10.087 5.424 1.00 0.00 H new ATOM 0 HA TYR B 41 1.613 -10.257 2.744 1.00 0.00 H new ATOM 0 HB2 TYR B 41 1.631 -11.866 5.252 1.00 0.00 H new ATOM 0 HB3 TYR B 41 0.272 -12.187 4.193 1.00 0.00 H new ATOM 0 HD1 TYR B 41 0.675 -13.029 1.869 1.00 0.00 H new ATOM 0 HD2 TYR B 41 3.863 -12.596 4.662 1.00 0.00 H new ATOM 0 HE1 TYR B 41 2.084 -14.491 0.487 1.00 0.00 H new ATOM 0 HE2 TYR B 41 5.272 -14.058 3.280 1.00 0.00 H new ATOM 0 HH TYR B 41 5.427 -15.285 1.451 1.00 0.00 H new ATOM 1364 N THR B 42 -0.493 -9.280 5.036 1.00 0.00 N ATOM 1365 CA THR B 42 -1.777 -8.620 5.198 1.00 0.00 C ATOM 1366 C THR B 42 -1.775 -7.302 4.436 1.00 0.00 C ATOM 1367 O THR B 42 -2.791 -6.875 3.881 1.00 0.00 O ATOM 1368 CB THR B 42 -2.046 -8.330 6.680 1.00 0.00 C ATOM 1369 OG1 THR B 42 -1.816 -9.512 7.450 1.00 0.00 O ATOM 1370 CG2 THR B 42 -3.470 -7.842 6.897 1.00 0.00 C ATOM 0 H THR B 42 0.078 -9.313 5.881 1.00 0.00 H new ATOM 0 HA THR B 42 -2.555 -9.278 4.810 1.00 0.00 H new ATOM 0 HB THR B 42 -1.366 -7.542 7.003 1.00 0.00 H new ATOM 0 HG1 THR B 42 -0.853 -9.684 7.506 1.00 0.00 H new ATOM 0 HG21 THR B 42 -3.630 -7.645 7.957 1.00 0.00 H new ATOM 0 HG22 THR B 42 -3.631 -6.925 6.329 1.00 0.00 H new ATOM 0 HG23 THR B 42 -4.171 -8.605 6.560 1.00 0.00 H new ATOM 1378 N LEU B 43 -0.600 -6.695 4.365 1.00 0.00 N ATOM 1379 CA LEU B 43 -0.454 -5.383 3.770 1.00 0.00 C ATOM 1380 C LEU B 43 -0.240 -5.491 2.270 1.00 0.00 C ATOM 1381 O LEU B 43 -0.509 -4.541 1.544 1.00 0.00 O ATOM 1382 CB LEU B 43 0.718 -4.619 4.414 1.00 0.00 C ATOM 1383 CG LEU B 43 0.346 -3.599 5.507 1.00 0.00 C ATOM 1384 CD1 LEU B 43 -0.553 -4.231 6.561 1.00 0.00 C ATOM 1385 CD2 LEU B 43 1.608 -3.050 6.156 1.00 0.00 C ATOM 0 H LEU B 43 0.269 -7.097 4.716 1.00 0.00 H new ATOM 0 HA LEU B 43 -1.375 -4.830 3.952 1.00 0.00 H new ATOM 0 HB2 LEU B 43 1.406 -5.347 4.844 1.00 0.00 H new ATOM 0 HB3 LEU B 43 1.260 -4.095 3.626 1.00 0.00 H new ATOM 0 HG LEU B 43 -0.203 -2.781 5.040 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -0.800 -3.489 7.320 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -1.469 -4.588 6.091 1.00 0.00 H new ATOM 0 HD13 LEU B 43 -0.034 -5.068 7.027 1.00 0.00 H new ATOM 0 HD21 LEU B 43 1.336 -2.330 6.928 1.00 0.00 H new ATOM 0 HD22 LEU B 43 2.171 -3.868 6.605 1.00 0.00 H new ATOM 0 HD23 LEU B 43 2.221 -2.559 5.401 1.00 0.00 H new ATOM 1397 N LEU B 44 0.218 -6.642 1.784 1.00 0.00 N ATOM 1398 CA LEU B 44 0.491 -6.782 0.362 1.00 0.00 C ATOM 1399 C LEU B 44 -0.802 -7.061 -0.401 1.00 0.00 C ATOM 1400 O LEU B 44 -1.051 -6.468 -1.443 1.00 0.00 O ATOM 1401 CB LEU B 44 1.552 -7.878 0.101 1.00 0.00 C ATOM 1402 CG LEU B 44 1.040 -9.313 -0.134 1.00 0.00 C ATOM 1403 CD1 LEU B 44 0.580 -9.505 -1.576 1.00 0.00 C ATOM 1404 CD2 LEU B 44 2.116 -10.334 0.184 1.00 0.00 C ATOM 0 H LEU B 44 0.404 -7.474 2.343 1.00 0.00 H new ATOM 0 HA LEU B 44 0.904 -5.842 -0.004 1.00 0.00 H new ATOM 0 HB2 LEU B 44 2.137 -7.581 -0.770 1.00 0.00 H new ATOM 0 HB3 LEU B 44 2.234 -7.898 0.951 1.00 0.00 H new ATOM 0 HG LEU B 44 0.192 -9.464 0.534 1.00 0.00 H new ATOM 0 HD11 LEU B 44 0.224 -10.526 -1.712 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -0.228 -8.807 -1.796 1.00 0.00 H new ATOM 0 HD13 LEU B 44 1.415 -9.319 -2.252 1.00 0.00 H new ATOM 0 HD21 LEU B 44 1.728 -11.338 0.010 1.00 0.00 H new ATOM 0 HD22 LEU B 44 2.981 -10.163 -0.457 1.00 0.00 H new ATOM 0 HD23 LEU B 44 2.413 -10.236 1.228 1.00 0.00 H new ATOM 1416 N ASP B 45 -1.632 -7.957 0.121 1.00 0.00 N ATOM 1417 CA ASP B 45 -2.856 -8.343 -0.575 1.00 0.00 C ATOM 1418 C ASP B 45 -3.882 -7.222 -0.513 1.00 0.00 C ATOM 1419 O ASP B 45 -4.746 -7.102 -1.384 1.00 0.00 O ATOM 1420 CB ASP B 45 -3.424 -9.629 0.024 1.00 0.00 C ATOM 1421 CG ASP B 45 -4.680 -10.103 -0.682 1.00 0.00 C ATOM 1422 OD1 ASP B 45 -4.570 -10.657 -1.797 1.00 0.00 O ATOM 1423 OD2 ASP B 45 -5.780 -9.941 -0.114 1.00 0.00 O ATOM 0 H ASP B 45 -1.483 -8.426 1.014 1.00 0.00 H new ATOM 0 HA ASP B 45 -2.617 -8.527 -1.622 1.00 0.00 H new ATOM 0 HB2 ASP B 45 -2.668 -10.412 -0.026 1.00 0.00 H new ATOM 0 HB3 ASP B 45 -3.645 -9.466 1.079 1.00 0.00 H new ATOM 1428 N PHE B 46 -3.748 -6.364 0.486 1.00 0.00 N ATOM 1429 CA PHE B 46 -4.605 -5.200 0.607 1.00 0.00 C ATOM 1430 C PHE B 46 -4.207 -4.142 -0.407 1.00 0.00 C ATOM 1431 O PHE B 46 -5.063 -3.498 -1.013 1.00 0.00 O ATOM 1432 CB PHE B 46 -4.461 -4.629 2.018 1.00 0.00 C ATOM 1433 CG PHE B 46 -5.265 -3.389 2.291 1.00 0.00 C ATOM 1434 CD1 PHE B 46 -4.724 -2.133 2.062 1.00 0.00 C ATOM 1435 CD2 PHE B 46 -6.551 -3.479 2.794 1.00 0.00 C ATOM 1436 CE1 PHE B 46 -5.452 -0.993 2.328 1.00 0.00 C ATOM 1437 CE2 PHE B 46 -7.283 -2.341 3.060 1.00 0.00 C ATOM 1438 CZ PHE B 46 -6.732 -1.097 2.829 1.00 0.00 C ATOM 0 H PHE B 46 -3.051 -6.454 1.226 1.00 0.00 H new ATOM 0 HA PHE B 46 -5.638 -5.492 0.420 1.00 0.00 H new ATOM 0 HB2 PHE B 46 -4.752 -5.397 2.735 1.00 0.00 H new ATOM 0 HB3 PHE B 46 -3.409 -4.408 2.198 1.00 0.00 H new ATOM 0 HD1 PHE B 46 -3.721 -2.047 1.671 1.00 0.00 H new ATOM 0 HD2 PHE B 46 -6.986 -4.450 2.980 1.00 0.00 H new ATOM 0 HE1 PHE B 46 -5.020 -0.020 2.144 1.00 0.00 H new ATOM 0 HE2 PHE B 46 -8.287 -2.423 3.449 1.00 0.00 H new ATOM 0 HZ PHE B 46 -7.303 -0.205 3.041 1.00 0.00 H new ATOM 1448 N ILE B 47 -2.917 -3.979 -0.621 1.00 0.00 N ATOM 1449 CA ILE B 47 -2.467 -2.982 -1.568 1.00 0.00 C ATOM 1450 C ILE B 47 -2.606 -3.502 -2.995 1.00 0.00 C ATOM 1451 O ILE B 47 -2.837 -2.738 -3.928 1.00 0.00 O ATOM 1452 CB ILE B 47 -1.019 -2.527 -1.291 1.00 0.00 C ATOM 1453 CG1 ILE B 47 -0.050 -3.708 -1.395 1.00 0.00 C ATOM 1454 CG2 ILE B 47 -0.943 -1.888 0.088 1.00 0.00 C ATOM 1455 CD1 ILE B 47 1.387 -3.363 -1.067 1.00 0.00 C ATOM 0 H ILE B 47 -2.177 -4.511 -0.163 1.00 0.00 H new ATOM 0 HA ILE B 47 -3.105 -2.107 -1.447 1.00 0.00 H new ATOM 0 HB ILE B 47 -0.728 -1.791 -2.041 1.00 0.00 H new ATOM 0 HG12 ILE B 47 -0.385 -4.498 -0.723 1.00 0.00 H new ATOM 0 HG13 ILE B 47 -0.093 -4.111 -2.407 1.00 0.00 H new ATOM 0 HG21 ILE B 47 0.080 -1.566 0.284 1.00 0.00 H new ATOM 0 HG22 ILE B 47 -1.608 -1.025 0.126 1.00 0.00 H new ATOM 0 HG23 ILE B 47 -1.246 -2.614 0.843 1.00 0.00 H new ATOM 0 HD11 ILE B 47 2.007 -4.254 -1.165 1.00 0.00 H new ATOM 0 HD12 ILE B 47 1.743 -2.596 -1.755 1.00 0.00 H new ATOM 0 HD13 ILE B 47 1.447 -2.990 -0.045 1.00 0.00 H new ATOM 1467 N GLN B 48 -2.504 -4.813 -3.146 1.00 0.00 N ATOM 1468 CA GLN B 48 -2.833 -5.463 -4.393 1.00 0.00 C ATOM 1469 C GLN B 48 -4.265 -5.129 -4.791 1.00 0.00 C ATOM 1470 O GLN B 48 -4.501 -4.518 -5.813 1.00 0.00 O ATOM 1471 CB GLN B 48 -2.684 -6.973 -4.251 1.00 0.00 C ATOM 1472 CG GLN B 48 -1.247 -7.463 -4.270 1.00 0.00 C ATOM 1473 CD GLN B 48 -0.667 -7.485 -5.668 1.00 0.00 C ATOM 1474 OE1 GLN B 48 -1.388 -7.687 -6.647 1.00 0.00 O ATOM 1475 NE2 GLN B 48 0.633 -7.288 -5.775 1.00 0.00 N ATOM 0 H GLN B 48 -2.193 -5.447 -2.410 1.00 0.00 H new ATOM 0 HA GLN B 48 -2.151 -5.106 -5.165 1.00 0.00 H new ATOM 0 HB2 GLN B 48 -3.150 -7.286 -3.317 1.00 0.00 H new ATOM 0 HB3 GLN B 48 -3.232 -7.458 -5.059 1.00 0.00 H new ATOM 0 HG2 GLN B 48 -0.637 -6.819 -3.636 1.00 0.00 H new ATOM 0 HG3 GLN B 48 -1.201 -8.465 -3.844 1.00 0.00 H new ATOM 0 HE21 GLN B 48 1.194 -7.124 -4.939 1.00 0.00 H new ATOM 0 HE22 GLN B 48 1.077 -7.300 -6.693 1.00 0.00 H new ATOM 1484 N LYS B 49 -5.198 -5.444 -3.913 1.00 0.00 N ATOM 1485 CA LYS B 49 -6.620 -5.445 -4.249 1.00 0.00 C ATOM 1486 C LYS B 49 -7.233 -4.033 -4.262 1.00 0.00 C ATOM 1487 O LYS B 49 -8.436 -3.870 -4.462 1.00 0.00 O ATOM 1488 CB LYS B 49 -7.338 -6.406 -3.282 1.00 0.00 C ATOM 1489 CG LYS B 49 -8.849 -6.494 -3.446 1.00 0.00 C ATOM 1490 CD LYS B 49 -9.461 -7.502 -2.482 1.00 0.00 C ATOM 1491 CE LYS B 49 -8.877 -8.894 -2.678 1.00 0.00 C ATOM 1492 NZ LYS B 49 -9.021 -9.367 -4.083 1.00 0.00 N ATOM 0 H LYS B 49 -4.999 -5.707 -2.948 1.00 0.00 H new ATOM 0 HA LYS B 49 -6.751 -5.799 -5.271 1.00 0.00 H new ATOM 0 HB2 LYS B 49 -6.918 -7.403 -3.410 1.00 0.00 H new ATOM 0 HB3 LYS B 49 -7.118 -6.096 -2.260 1.00 0.00 H new ATOM 0 HG2 LYS B 49 -9.292 -5.512 -3.276 1.00 0.00 H new ATOM 0 HG3 LYS B 49 -9.088 -6.778 -4.471 1.00 0.00 H new ATOM 0 HD2 LYS B 49 -9.288 -7.176 -1.456 1.00 0.00 H new ATOM 0 HD3 LYS B 49 -10.541 -7.536 -2.628 1.00 0.00 H new ATOM 0 HE2 LYS B 49 -7.822 -8.886 -2.404 1.00 0.00 H new ATOM 0 HE3 LYS B 49 -9.375 -9.594 -2.007 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 -8.736 -10.365 -4.144 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 -10.013 -9.271 -4.382 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 -8.415 -8.795 -4.706 1.00 0.00 H new ATOM 1506 N HIS B 50 -6.428 -3.001 -4.016 1.00 0.00 N ATOM 1507 CA HIS B 50 -6.912 -1.649 -4.329 1.00 0.00 C ATOM 1508 C HIS B 50 -6.101 -0.930 -5.414 1.00 0.00 C ATOM 1509 O HIS B 50 -6.429 0.201 -5.765 1.00 0.00 O ATOM 1510 CB HIS B 50 -6.942 -0.798 -3.057 1.00 0.00 C ATOM 1511 CG HIS B 50 -7.807 -1.384 -1.989 1.00 0.00 C ATOM 1512 ND1 HIS B 50 -7.314 -2.191 -0.988 1.00 0.00 N ATOM 1513 CD2 HIS B 50 -9.144 -1.320 -1.790 1.00 0.00 C ATOM 1514 CE1 HIS B 50 -8.301 -2.598 -0.225 1.00 0.00 C ATOM 1515 NE2 HIS B 50 -9.422 -2.087 -0.688 1.00 0.00 N ATOM 0 H HIS B 50 -5.489 -3.060 -3.623 1.00 0.00 H new ATOM 0 HA HIS B 50 -7.917 -1.775 -4.732 1.00 0.00 H new ATOM 0 HB2 HIS B 50 -5.927 -0.687 -2.676 1.00 0.00 H new ATOM 0 HB3 HIS B 50 -7.302 0.201 -3.302 1.00 0.00 H new ATOM 0 HD1 HIS B 50 -6.332 -2.435 -0.859 1.00 0.00 H new ATOM 0 HD2 HIS B 50 -9.857 -0.769 -2.386 1.00 0.00 H new ATOM 0 HE1 HIS B 50 -8.209 -3.243 0.637 1.00 0.00 H new ATOM 1524 N LEU B 51 -5.052 -1.555 -5.942 1.00 0.00 N ATOM 1525 CA LEU B 51 -4.320 -0.964 -7.076 1.00 0.00 C ATOM 1526 C LEU B 51 -4.315 -1.896 -8.282 1.00 0.00 C ATOM 1527 O LEU B 51 -4.409 -1.459 -9.428 1.00 0.00 O ATOM 1528 CB LEU B 51 -2.857 -0.653 -6.723 1.00 0.00 C ATOM 1529 CG LEU B 51 -2.593 0.551 -5.799 1.00 0.00 C ATOM 1530 CD1 LEU B 51 -3.274 1.815 -6.313 1.00 0.00 C ATOM 1531 CD2 LEU B 51 -3.028 0.254 -4.379 1.00 0.00 C ATOM 0 H LEU B 51 -4.690 -2.451 -5.617 1.00 0.00 H new ATOM 0 HA LEU B 51 -4.844 -0.038 -7.314 1.00 0.00 H new ATOM 0 HB2 LEU B 51 -2.428 -1.538 -6.254 1.00 0.00 H new ATOM 0 HB3 LEU B 51 -2.313 -0.490 -7.653 1.00 0.00 H new ATOM 0 HG LEU B 51 -1.517 0.728 -5.800 1.00 0.00 H new ATOM 0 HD11 LEU B 51 -3.065 2.642 -5.635 1.00 0.00 H new ATOM 0 HD12 LEU B 51 -2.894 2.055 -7.306 1.00 0.00 H new ATOM 0 HD13 LEU B 51 -4.351 1.653 -6.366 1.00 0.00 H new ATOM 0 HD21 LEU B 51 -2.830 1.121 -3.749 1.00 0.00 H new ATOM 0 HD22 LEU B 51 -4.095 0.031 -4.364 1.00 0.00 H new ATOM 0 HD23 LEU B 51 -2.473 -0.604 -4.000 1.00 0.00 H new ATOM 1543 N ASN B 52 -4.204 -3.182 -8.009 1.00 0.00 N ATOM 1544 CA ASN B 52 -3.901 -4.178 -9.030 1.00 0.00 C ATOM 1545 C ASN B 52 -4.889 -5.348 -9.025 1.00 0.00 C ATOM 1546 O ASN B 52 -5.084 -6.006 -10.047 1.00 0.00 O ATOM 1547 CB ASN B 52 -2.482 -4.691 -8.800 1.00 0.00 C ATOM 1548 CG ASN B 52 -1.494 -4.119 -9.802 1.00 0.00 C ATOM 1549 OD1 ASN B 52 -0.330 -3.893 -9.482 1.00 0.00 O ATOM 1550 ND2 ASN B 52 -1.942 -3.907 -11.032 1.00 0.00 N ATOM 0 H ASN B 52 -4.321 -3.570 -7.073 1.00 0.00 H new ATOM 0 HA ASN B 52 -3.989 -3.701 -10.006 1.00 0.00 H new ATOM 0 HB2 ASN B 52 -2.163 -4.432 -7.790 1.00 0.00 H new ATOM 0 HB3 ASN B 52 -2.476 -5.779 -8.867 1.00 0.00 H new ATOM 0 HD21 ASN B 52 -1.313 -3.545 -11.749 1.00 0.00 H new ATOM 0 HD22 ASN B 52 -2.916 -4.106 -11.262 1.00 0.00 H new ATOM 1557 N LYS B 53 -5.497 -5.605 -7.885 1.00 0.00 N ATOM 1558 CA LYS B 53 -6.478 -6.668 -7.750 1.00 0.00 C ATOM 1559 C LYS B 53 -7.869 -6.073 -7.550 1.00 0.00 C ATOM 1560 O LYS B 53 -8.487 -6.351 -6.502 1.00 0.00 O ATOM 1561 CB LYS B 53 -6.135 -7.557 -6.551 1.00 0.00 C ATOM 1562 CG LYS B 53 -5.569 -8.912 -6.914 1.00 0.00 C ATOM 1563 CD LYS B 53 -5.617 -9.846 -5.711 1.00 0.00 C ATOM 1564 CE LYS B 53 -4.348 -9.785 -4.882 1.00 0.00 C ATOM 1565 NZ LYS B 53 -3.138 -10.150 -5.670 1.00 0.00 N ATOM 1566 OXT LYS B 53 -8.320 -5.315 -8.435 1.00 0.00 O ATOM 0 H LYS B 53 -5.327 -5.084 -7.025 1.00 0.00 H new ATOM 0 HA LYS B 53 -6.464 -7.268 -8.660 1.00 0.00 H new ATOM 0 HB2 LYS B 53 -5.415 -7.034 -5.922 1.00 0.00 H new ATOM 0 HB3 LYS B 53 -7.035 -7.702 -5.953 1.00 0.00 H new ATOM 0 HG2 LYS B 53 -6.137 -9.342 -7.739 1.00 0.00 H new ATOM 0 HG3 LYS B 53 -4.540 -8.804 -7.258 1.00 0.00 H new ATOM 0 HD2 LYS B 53 -6.470 -9.584 -5.085 1.00 0.00 H new ATOM 0 HD3 LYS B 53 -5.775 -10.868 -6.054 1.00 0.00 H new ATOM 0 HE2 LYS B 53 -4.227 -8.779 -4.481 1.00 0.00 H new ATOM 0 HE3 LYS B 53 -4.441 -10.459 -4.030 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 -2.505 -10.731 -5.084 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 -3.422 -10.689 -6.513 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 -2.641 -9.285 -5.964 1.00 0.00 H new ATOM 1601 N VAL C 2 -7.162 4.297 14.041 1.00 0.00 N ATOM 1602 CA VAL C 2 -6.049 4.651 14.907 1.00 0.00 C ATOM 1603 C VAL C 2 -4.951 5.327 14.090 1.00 0.00 C ATOM 1604 O VAL C 2 -3.975 5.852 14.630 1.00 0.00 O ATOM 1605 CB VAL C 2 -5.492 3.393 15.622 1.00 0.00 C ATOM 1606 CG1 VAL C 2 -4.852 2.435 14.624 1.00 0.00 C ATOM 1607 CG2 VAL C 2 -4.512 3.766 16.725 1.00 0.00 C ATOM 0 HA VAL C 2 -6.405 5.346 15.668 1.00 0.00 H new ATOM 0 HB VAL C 2 -6.334 2.882 16.089 1.00 0.00 H new ATOM 0 HG11 VAL C 2 -4.470 1.561 15.152 1.00 0.00 H new ATOM 0 HG12 VAL C 2 -5.597 2.120 13.893 1.00 0.00 H new ATOM 0 HG13 VAL C 2 -4.031 2.938 14.112 1.00 0.00 H new ATOM 0 HG21 VAL C 2 -4.142 2.860 17.204 1.00 0.00 H new ATOM 0 HG22 VAL C 2 -3.675 4.318 16.297 1.00 0.00 H new ATOM 0 HG23 VAL C 2 -5.016 4.388 17.465 1.00 0.00 H new ATOM 1617 N ILE C 3 -5.141 5.344 12.781 1.00 0.00 N ATOM 1618 CA ILE C 3 -4.162 5.915 11.880 1.00 0.00 C ATOM 1619 C ILE C 3 -4.800 6.994 11.014 1.00 0.00 C ATOM 1620 O ILE C 3 -5.920 6.832 10.525 1.00 0.00 O ATOM 1621 CB ILE C 3 -3.512 4.825 10.990 1.00 0.00 C ATOM 1622 CG1 ILE C 3 -2.297 5.390 10.248 1.00 0.00 C ATOM 1623 CG2 ILE C 3 -4.527 4.253 10.003 1.00 0.00 C ATOM 1624 CD1 ILE C 3 -1.499 4.338 9.511 1.00 0.00 C ATOM 0 H ILE C 3 -5.969 4.966 12.320 1.00 0.00 H new ATOM 0 HA ILE C 3 -3.376 6.368 12.485 1.00 0.00 H new ATOM 0 HB ILE C 3 -3.174 4.015 11.636 1.00 0.00 H new ATOM 0 HG12 ILE C 3 -2.634 6.144 9.537 1.00 0.00 H new ATOM 0 HG13 ILE C 3 -1.646 5.894 10.963 1.00 0.00 H new ATOM 0 HG21 ILE C 3 -4.048 3.490 9.389 1.00 0.00 H new ATOM 0 HG22 ILE C 3 -5.357 3.809 10.552 1.00 0.00 H new ATOM 0 HG23 ILE C 3 -4.901 5.051 9.362 1.00 0.00 H new ATOM 0 HD11 ILE C 3 -0.654 4.808 9.008 1.00 0.00 H new ATOM 0 HD12 ILE C 3 -1.132 3.596 10.220 1.00 0.00 H new ATOM 0 HD13 ILE C 3 -2.135 3.850 8.772 1.00 0.00 H new ATOM 1636 N ALA C 4 -4.111 8.112 10.880 1.00 0.00 N ATOM 1637 CA ALA C 4 -4.550 9.175 9.997 1.00 0.00 C ATOM 1638 C ALA C 4 -3.457 9.511 8.997 1.00 0.00 C ATOM 1639 O ALA C 4 -2.271 9.291 9.257 1.00 0.00 O ATOM 1640 CB ALA C 4 -4.935 10.407 10.802 1.00 0.00 C ATOM 0 H ALA C 4 -3.241 8.307 11.375 1.00 0.00 H new ATOM 0 HA ALA C 4 -5.429 8.835 9.449 1.00 0.00 H new ATOM 0 HB1 ALA C 4 -5.262 11.196 10.125 1.00 0.00 H new ATOM 0 HB2 ALA C 4 -5.746 10.156 11.486 1.00 0.00 H new ATOM 0 HB3 ALA C 4 -4.073 10.753 11.373 1.00 0.00 H new ATOM 1646 N THR C 5 -3.868 10.047 7.852 1.00 0.00 N ATOM 1647 CA THR C 5 -2.948 10.413 6.784 1.00 0.00 C ATOM 1648 C THR C 5 -2.012 11.539 7.228 1.00 0.00 C ATOM 1649 O THR C 5 -1.026 11.842 6.562 1.00 0.00 O ATOM 1650 CB THR C 5 -3.733 10.856 5.534 1.00 0.00 C ATOM 1651 OG1 THR C 5 -4.865 9.994 5.356 1.00 0.00 O ATOM 1652 CG2 THR C 5 -2.861 10.808 4.286 1.00 0.00 C ATOM 0 H THR C 5 -4.847 10.239 7.640 1.00 0.00 H new ATOM 0 HA THR C 5 -2.347 9.536 6.543 1.00 0.00 H new ATOM 0 HB THR C 5 -4.060 11.885 5.682 1.00 0.00 H new ATOM 0 HG1 THR C 5 -5.368 10.274 4.563 1.00 0.00 H new ATOM 0 HG21 THR C 5 -3.444 11.126 3.422 1.00 0.00 H new ATOM 0 HG22 THR C 5 -2.007 11.474 4.413 1.00 0.00 H new ATOM 0 HG23 THR C 5 -2.506 9.789 4.129 1.00 0.00 H new ATOM 1660 N ASP C 6 -2.303 12.116 8.385 1.00 0.00 N ATOM 1661 CA ASP C 6 -1.526 13.226 8.915 1.00 0.00 C ATOM 1662 C ASP C 6 -0.263 12.714 9.592 1.00 0.00 C ATOM 1663 O ASP C 6 0.637 13.486 9.919 1.00 0.00 O ATOM 1664 CB ASP C 6 -2.357 14.025 9.926 1.00 0.00 C ATOM 1665 CG ASP C 6 -3.623 14.606 9.324 1.00 0.00 C ATOM 1666 OD1 ASP C 6 -4.625 13.869 9.212 1.00 0.00 O ATOM 1667 OD2 ASP C 6 -3.625 15.807 8.974 1.00 0.00 O ATOM 0 H ASP C 6 -3.080 11.829 8.980 1.00 0.00 H new ATOM 0 HA ASP C 6 -1.250 13.875 8.084 1.00 0.00 H new ATOM 0 HB2 ASP C 6 -2.622 13.378 10.762 1.00 0.00 H new ATOM 0 HB3 ASP C 6 -1.748 14.834 10.330 1.00 0.00 H new ATOM 1672 N ASP C 7 -0.203 11.403 9.813 1.00 0.00 N ATOM 1673 CA ASP C 7 0.987 10.780 10.382 1.00 0.00 C ATOM 1674 C ASP C 7 1.759 10.034 9.302 1.00 0.00 C ATOM 1675 O ASP C 7 2.770 9.386 9.575 1.00 0.00 O ATOM 1676 CB ASP C 7 0.611 9.796 11.496 1.00 0.00 C ATOM 1677 CG ASP C 7 -0.200 10.431 12.609 1.00 0.00 C ATOM 1678 OD1 ASP C 7 0.369 11.217 13.396 1.00 0.00 O ATOM 1679 OD2 ASP C 7 -1.409 10.133 12.711 1.00 0.00 O ATOM 0 H ASP C 7 -0.963 10.754 9.607 1.00 0.00 H new ATOM 0 HA ASP C 7 1.609 11.571 10.800 1.00 0.00 H new ATOM 0 HB2 ASP C 7 0.042 8.972 11.066 1.00 0.00 H new ATOM 0 HB3 ASP C 7 1.521 9.370 11.917 1.00 0.00 H new ATOM 1684 N LEU C 8 1.279 10.132 8.070 1.00 0.00 N ATOM 1685 CA LEU C 8 1.900 9.438 6.949 1.00 0.00 C ATOM 1686 C LEU C 8 2.368 10.420 5.894 1.00 0.00 C ATOM 1687 O LEU C 8 3.355 10.172 5.202 1.00 0.00 O ATOM 1688 CB LEU C 8 0.919 8.444 6.343 1.00 0.00 C ATOM 1689 CG LEU C 8 0.520 7.312 7.277 1.00 0.00 C ATOM 1690 CD1 LEU C 8 -0.669 6.554 6.711 1.00 0.00 C ATOM 1691 CD2 LEU C 8 1.697 6.375 7.501 1.00 0.00 C ATOM 0 H LEU C 8 0.460 10.686 7.821 1.00 0.00 H new ATOM 0 HA LEU C 8 2.771 8.899 7.321 1.00 0.00 H new ATOM 0 HB2 LEU C 8 0.021 8.979 6.035 1.00 0.00 H new ATOM 0 HB3 LEU C 8 1.361 8.018 5.442 1.00 0.00 H new ATOM 0 HG LEU C 8 0.230 7.736 8.238 1.00 0.00 H new ATOM 0 HD11 LEU C 8 -0.943 5.747 7.390 1.00 0.00 H new ATOM 0 HD12 LEU C 8 -1.513 7.234 6.596 1.00 0.00 H new ATOM 0 HD13 LEU C 8 -0.405 6.136 5.739 1.00 0.00 H new ATOM 0 HD21 LEU C 8 1.398 5.569 8.171 1.00 0.00 H new ATOM 0 HD22 LEU C 8 2.014 5.954 6.547 1.00 0.00 H new ATOM 0 HD23 LEU C 8 2.524 6.929 7.946 1.00 0.00 H new ATOM 1703 N GLU C 9 1.667 11.540 5.798 1.00 0.00 N ATOM 1704 CA GLU C 9 2.026 12.589 4.863 1.00 0.00 C ATOM 1705 C GLU C 9 1.769 13.954 5.486 1.00 0.00 C ATOM 1706 O GLU C 9 0.832 14.138 6.264 1.00 0.00 O ATOM 1707 CB GLU C 9 1.287 12.454 3.519 1.00 0.00 C ATOM 1708 CG GLU C 9 1.679 11.207 2.732 1.00 0.00 C ATOM 1709 CD GLU C 9 1.536 11.365 1.227 1.00 0.00 C ATOM 1710 OE1 GLU C 9 0.415 11.234 0.701 1.00 0.00 O ATOM 1711 OE2 GLU C 9 2.562 11.581 0.541 1.00 0.00 O ATOM 0 H GLU C 9 0.841 11.744 6.361 1.00 0.00 H new ATOM 0 HA GLU C 9 3.090 12.487 4.648 1.00 0.00 H new ATOM 0 HB2 GLU C 9 0.213 12.434 3.704 1.00 0.00 H new ATOM 0 HB3 GLU C 9 1.490 13.336 2.912 1.00 0.00 H new ATOM 0 HG2 GLU C 9 2.713 10.951 2.965 1.00 0.00 H new ATOM 0 HG3 GLU C 9 1.062 10.371 3.061 1.00 0.00 H new ATOM 1718 N VAL C 10 2.625 14.895 5.147 1.00 0.00 N ATOM 1719 CA VAL C 10 2.568 16.241 5.677 1.00 0.00 C ATOM 1720 C VAL C 10 2.716 17.220 4.523 1.00 0.00 C ATOM 1721 O VAL C 10 3.389 16.923 3.537 1.00 0.00 O ATOM 1722 CB VAL C 10 3.684 16.471 6.729 1.00 0.00 C ATOM 1723 CG1 VAL C 10 5.059 16.190 6.139 1.00 0.00 C ATOM 1724 CG2 VAL C 10 3.626 17.882 7.296 1.00 0.00 C ATOM 0 H VAL C 10 3.389 14.745 4.488 1.00 0.00 H new ATOM 0 HA VAL C 10 1.611 16.395 6.176 1.00 0.00 H new ATOM 0 HB VAL C 10 3.513 15.770 7.546 1.00 0.00 H new ATOM 0 HG11 VAL C 10 5.822 16.359 6.898 1.00 0.00 H new ATOM 0 HG12 VAL C 10 5.106 15.154 5.802 1.00 0.00 H new ATOM 0 HG13 VAL C 10 5.235 16.855 5.293 1.00 0.00 H new ATOM 0 HG21 VAL C 10 4.421 18.012 8.030 1.00 0.00 H new ATOM 0 HG22 VAL C 10 3.756 18.604 6.490 1.00 0.00 H new ATOM 0 HG23 VAL C 10 2.660 18.042 7.775 1.00 0.00 H new ATOM 1734 N ALA C 11 2.077 18.369 4.622 1.00 0.00 N ATOM 1735 CA ALA C 11 2.090 19.332 3.538 1.00 0.00 C ATOM 1736 C ALA C 11 3.494 19.886 3.285 1.00 0.00 C ATOM 1737 O ALA C 11 4.202 20.280 4.216 1.00 0.00 O ATOM 1738 CB ALA C 11 1.117 20.444 3.871 1.00 0.00 C ATOM 0 H ALA C 11 1.543 18.659 5.441 1.00 0.00 H new ATOM 0 HA ALA C 11 1.784 18.836 2.617 1.00 0.00 H new ATOM 0 HB1 ALA C 11 1.114 21.178 3.065 1.00 0.00 H new ATOM 0 HB2 ALA C 11 0.116 20.029 3.987 1.00 0.00 H new ATOM 0 HB3 ALA C 11 1.420 20.926 4.800 1.00 0.00 H new ATOM 1744 N CYS C 12 3.869 19.924 1.997 1.00 0.00 N ATOM 1745 CA CYS C 12 5.221 20.236 1.530 1.00 0.00 C ATOM 1746 C CYS C 12 5.702 21.648 1.919 1.00 0.00 C ATOM 1747 O CYS C 12 4.925 22.449 2.427 1.00 0.00 O ATOM 1748 CB CYS C 12 5.192 20.146 0.008 1.00 0.00 C ATOM 1749 SG CYS C 12 6.490 19.126 -0.708 1.00 0.00 S ATOM 0 H CYS C 12 3.220 19.733 1.234 1.00 0.00 H new ATOM 0 HA CYS C 12 5.910 19.532 1.997 1.00 0.00 H new ATOM 0 HB2 CYS C 12 4.225 19.750 -0.301 1.00 0.00 H new ATOM 0 HB3 CYS C 12 5.270 21.152 -0.404 1.00 0.00 H new ATOM 0 HG CYS C 12 5.992 18.397 -1.662 1.00 0.00 H new ATOM 1754 N PRO C 13 6.998 21.962 1.672 1.00 0.00 N ATOM 1755 CA PRO C 13 7.555 23.318 1.808 1.00 0.00 C ATOM 1756 C PRO C 13 6.636 24.441 1.291 1.00 0.00 C ATOM 1757 O PRO C 13 6.443 25.451 1.975 1.00 0.00 O ATOM 1758 CB PRO C 13 8.806 23.228 0.938 1.00 0.00 C ATOM 1759 CG PRO C 13 9.289 21.830 1.109 1.00 0.00 C ATOM 1760 CD PRO C 13 8.046 20.989 1.290 1.00 0.00 C ATOM 0 HA PRO C 13 7.718 23.581 2.853 1.00 0.00 H new ATOM 0 HB2 PRO C 13 8.578 23.443 -0.106 1.00 0.00 H new ATOM 0 HB3 PRO C 13 9.560 23.949 1.254 1.00 0.00 H new ATOM 0 HG2 PRO C 13 9.860 21.504 0.240 1.00 0.00 H new ATOM 0 HG3 PRO C 13 9.948 21.746 1.973 1.00 0.00 H new ATOM 0 HD2 PRO C 13 7.785 20.463 0.372 1.00 0.00 H new ATOM 0 HD3 PRO C 13 8.187 20.232 2.062 1.00 0.00 H new ATOM 1768 N LYS C 14 6.066 24.250 0.093 1.00 0.00 N ATOM 1769 CA LYS C 14 5.296 25.324 -0.542 1.00 0.00 C ATOM 1770 C LYS C 14 4.383 24.873 -1.697 1.00 0.00 C ATOM 1771 O LYS C 14 3.705 25.704 -2.302 1.00 0.00 O ATOM 1772 CB LYS C 14 6.229 26.463 -0.995 1.00 0.00 C ATOM 1773 CG LYS C 14 7.051 26.209 -2.259 1.00 0.00 C ATOM 1774 CD LYS C 14 6.338 26.739 -3.501 1.00 0.00 C ATOM 1775 CE LYS C 14 7.276 26.847 -4.695 1.00 0.00 C ATOM 1776 NZ LYS C 14 8.311 27.900 -4.504 1.00 0.00 N ATOM 0 H LYS C 14 6.122 23.384 -0.443 1.00 0.00 H new ATOM 0 HA LYS C 14 4.616 25.685 0.230 1.00 0.00 H new ATOM 0 HB2 LYS C 14 5.625 27.356 -1.155 1.00 0.00 H new ATOM 0 HB3 LYS C 14 6.917 26.685 -0.179 1.00 0.00 H new ATOM 0 HG2 LYS C 14 8.025 26.688 -2.164 1.00 0.00 H new ATOM 0 HG3 LYS C 14 7.231 25.140 -2.369 1.00 0.00 H new ATOM 0 HD2 LYS C 14 5.507 26.079 -3.751 1.00 0.00 H new ATOM 0 HD3 LYS C 14 5.913 27.719 -3.284 1.00 0.00 H new ATOM 0 HE2 LYS C 14 7.764 25.886 -4.860 1.00 0.00 H new ATOM 0 HE3 LYS C 14 6.696 27.068 -5.591 1.00 0.00 H new ATOM 0 HZ1 LYS C 14 8.736 28.140 -5.423 1.00 0.00 H new ATOM 0 HZ2 LYS C 14 7.871 28.748 -4.093 1.00 0.00 H new ATOM 0 HZ3 LYS C 14 9.050 27.548 -3.862 1.00 0.00 H new ATOM 1790 N CYS C 15 4.341 23.586 -2.033 1.00 0.00 N ATOM 1791 CA CYS C 15 3.419 23.165 -3.086 1.00 0.00 C ATOM 1792 C CYS C 15 2.331 22.233 -2.608 1.00 0.00 C ATOM 1793 O CYS C 15 1.927 21.330 -3.343 1.00 0.00 O ATOM 1794 CB CYS C 15 4.187 22.411 -4.151 1.00 0.00 C ATOM 1795 SG CYS C 15 5.248 21.073 -3.521 1.00 0.00 S ATOM 0 H CYS C 15 4.905 22.846 -1.615 1.00 0.00 H new ATOM 0 HA CYS C 15 2.957 24.080 -3.455 1.00 0.00 H new ATOM 0 HB2 CYS C 15 3.476 21.989 -4.861 1.00 0.00 H new ATOM 0 HB3 CYS C 15 4.807 23.118 -4.702 1.00 0.00 H new ATOM 0 HG CYS C 15 4.730 19.923 -3.837 1.00 0.00 H new ATOM 1800 N GLU C 16 1.794 22.497 -1.443 1.00 0.00 N ATOM 1801 CA GLU C 16 0.746 21.663 -0.887 1.00 0.00 C ATOM 1802 C GLU C 16 -0.610 22.177 -1.309 1.00 0.00 C ATOM 1803 O GLU C 16 -1.625 21.874 -0.680 1.00 0.00 O ATOM 1804 CB GLU C 16 0.830 21.676 0.645 1.00 0.00 C ATOM 1805 CG GLU C 16 2.086 22.330 1.185 1.00 0.00 C ATOM 1806 CD GLU C 16 1.952 23.833 1.295 1.00 0.00 C ATOM 1807 OE1 GLU C 16 2.201 24.525 0.291 1.00 0.00 O ATOM 1808 OE2 GLU C 16 1.583 24.325 2.384 1.00 0.00 O ATOM 0 H GLU C 16 2.064 23.286 -0.855 1.00 0.00 H new ATOM 0 HA GLU C 16 0.879 20.646 -1.256 1.00 0.00 H new ATOM 0 HB2 GLU C 16 -0.040 22.199 1.042 1.00 0.00 H new ATOM 0 HB3 GLU C 16 0.780 20.650 1.011 1.00 0.00 H new ATOM 0 HG2 GLU C 16 2.315 21.916 2.167 1.00 0.00 H new ATOM 0 HG3 GLU C 16 2.926 22.090 0.534 1.00 0.00 H new ATOM 1815 N ARG C 17 -0.640 22.925 -2.403 1.00 0.00 N ATOM 1816 CA ARG C 17 -1.841 23.593 -2.837 1.00 0.00 C ATOM 1817 C ARG C 17 -1.822 23.626 -4.367 1.00 0.00 C ATOM 1818 O ARG C 17 -2.795 23.996 -5.011 1.00 0.00 O ATOM 1819 CB ARG C 17 -1.971 25.002 -2.223 1.00 0.00 C ATOM 1820 CG ARG C 17 -0.697 25.847 -2.243 1.00 0.00 C ATOM 1821 CD ARG C 17 -0.393 26.429 -3.616 1.00 0.00 C ATOM 1822 NE ARG C 17 -1.478 27.277 -4.112 1.00 0.00 N ATOM 1823 CZ ARG C 17 -1.310 28.287 -4.968 1.00 0.00 C ATOM 1824 NH1 ARG C 17 -0.096 28.614 -5.392 1.00 0.00 N ATOM 1825 NH2 ARG C 17 -2.358 28.980 -5.389 1.00 0.00 N ATOM 0 H ARG C 17 0.168 23.080 -3.006 1.00 0.00 H new ATOM 0 HA ARG C 17 -2.720 23.049 -2.490 1.00 0.00 H new ATOM 0 HB2 ARG C 17 -2.753 25.542 -2.757 1.00 0.00 H new ATOM 0 HB3 ARG C 17 -2.303 24.900 -1.190 1.00 0.00 H new ATOM 0 HG2 ARG C 17 -0.795 26.660 -1.523 1.00 0.00 H new ATOM 0 HG3 ARG C 17 0.144 25.234 -1.919 1.00 0.00 H new ATOM 0 HD2 ARG C 17 0.527 27.012 -3.566 1.00 0.00 H new ATOM 0 HD3 ARG C 17 -0.218 25.617 -4.322 1.00 0.00 H new ATOM 0 HE ARG C 17 -2.424 27.084 -3.782 1.00 0.00 H new ATOM 0 HH11 ARG C 17 0.717 28.092 -5.064 1.00 0.00 H new ATOM 0 HH12 ARG C 17 0.025 29.387 -6.046 1.00 0.00 H new ATOM 0 HH21 ARG C 17 -3.293 28.742 -5.059 1.00 0.00 H new ATOM 0 HH22 ARG C 17 -2.230 29.752 -6.043 1.00 0.00 H new ATOM 1839 N ALA C 18 -0.672 23.222 -4.943 1.00 0.00 N ATOM 1840 CA ALA C 18 -0.497 23.253 -6.396 1.00 0.00 C ATOM 1841 C ALA C 18 0.120 21.966 -6.938 1.00 0.00 C ATOM 1842 O ALA C 18 -0.193 21.545 -8.047 1.00 0.00 O ATOM 1843 CB ALA C 18 0.346 24.450 -6.825 1.00 0.00 C ATOM 0 H ALA C 18 0.136 22.876 -4.426 1.00 0.00 H new ATOM 0 HA ALA C 18 -1.496 23.348 -6.821 1.00 0.00 H new ATOM 0 HB1 ALA C 18 0.458 24.446 -7.909 1.00 0.00 H new ATOM 0 HB2 ALA C 18 -0.146 25.372 -6.515 1.00 0.00 H new ATOM 0 HB3 ALA C 18 1.329 24.389 -6.358 1.00 0.00 H new ATOM 1849 N GLY C 19 0.997 21.344 -6.153 1.00 0.00 N ATOM 1850 CA GLY C 19 1.656 20.132 -6.603 1.00 0.00 C ATOM 1851 C GLY C 19 2.865 20.406 -7.489 1.00 0.00 C ATOM 1852 O GLY C 19 3.357 19.505 -8.159 1.00 0.00 O ATOM 0 H GLY C 19 1.261 21.657 -5.219 1.00 0.00 H new ATOM 0 HA2 GLY C 19 1.972 19.553 -5.735 1.00 0.00 H new ATOM 0 HA3 GLY C 19 0.941 19.519 -7.152 1.00 0.00 H new ATOM 1856 N GLU C 20 3.397 21.624 -7.420 1.00 0.00 N ATOM 1857 CA GLU C 20 4.544 22.012 -8.249 1.00 0.00 C ATOM 1858 C GLU C 20 5.479 22.903 -7.486 1.00 0.00 C ATOM 1859 O GLU C 20 5.122 23.488 -6.472 1.00 0.00 O ATOM 1860 CB GLU C 20 4.175 22.785 -9.511 1.00 0.00 C ATOM 1861 CG GLU C 20 3.142 23.861 -9.291 1.00 0.00 C ATOM 1862 CD GLU C 20 3.422 25.099 -10.110 1.00 0.00 C ATOM 1863 OE1 GLU C 20 4.203 25.962 -9.650 1.00 0.00 O ATOM 1864 OE2 GLU C 20 2.863 25.215 -11.214 1.00 0.00 O ATOM 0 H GLU C 20 3.056 22.360 -6.802 1.00 0.00 H new ATOM 0 HA GLU C 20 4.999 21.062 -8.529 1.00 0.00 H new ATOM 0 HB2 GLU C 20 5.076 23.239 -9.923 1.00 0.00 H new ATOM 0 HB3 GLU C 20 3.802 22.084 -10.258 1.00 0.00 H new ATOM 0 HG2 GLU C 20 2.156 23.473 -9.548 1.00 0.00 H new ATOM 0 HG3 GLU C 20 3.115 24.125 -8.234 1.00 0.00 H new ATOM 1871 N ILE C 21 6.663 23.025 -8.007 1.00 0.00 N ATOM 1872 CA ILE C 21 7.628 23.960 -7.511 1.00 0.00 C ATOM 1873 C ILE C 21 8.136 24.766 -8.680 1.00 0.00 C ATOM 1874 O ILE C 21 8.828 24.226 -9.534 1.00 0.00 O ATOM 1875 CB ILE C 21 8.815 23.247 -6.843 1.00 0.00 C ATOM 1876 CG1 ILE C 21 8.347 22.420 -5.642 1.00 0.00 C ATOM 1877 CG2 ILE C 21 9.880 24.251 -6.430 1.00 0.00 C ATOM 1878 CD1 ILE C 21 7.860 23.238 -4.465 1.00 0.00 C ATOM 0 H ILE C 21 6.990 22.471 -8.798 1.00 0.00 H new ATOM 0 HA ILE C 21 7.154 24.594 -6.762 1.00 0.00 H new ATOM 0 HB ILE C 21 9.256 22.564 -7.569 1.00 0.00 H new ATOM 0 HG12 ILE C 21 7.544 21.758 -5.965 1.00 0.00 H new ATOM 0 HG13 ILE C 21 9.170 21.786 -5.311 1.00 0.00 H new ATOM 0 HG21 ILE C 21 10.711 23.726 -5.959 1.00 0.00 H new ATOM 0 HG22 ILE C 21 10.239 24.784 -7.311 1.00 0.00 H new ATOM 0 HG23 ILE C 21 9.454 24.964 -5.724 1.00 0.00 H new ATOM 0 HD11 ILE C 21 7.549 22.570 -3.662 1.00 0.00 H new ATOM 0 HD12 ILE C 21 8.666 23.881 -4.111 1.00 0.00 H new ATOM 0 HD13 ILE C 21 7.014 23.852 -4.774 1.00 0.00 H new ATOM 1890 N GLU C 22 7.769 26.033 -8.740 1.00 0.00 N ATOM 1891 CA GLU C 22 8.250 26.899 -9.802 1.00 0.00 C ATOM 1892 C GLU C 22 7.840 26.356 -11.183 1.00 0.00 C ATOM 1893 O GLU C 22 8.681 26.218 -12.065 1.00 0.00 O ATOM 1894 CB GLU C 22 9.781 26.972 -9.703 1.00 0.00 C ATOM 1895 CG GLU C 22 10.360 28.340 -9.970 1.00 0.00 C ATOM 1896 CD GLU C 22 9.962 29.328 -8.900 1.00 0.00 C ATOM 1897 OE1 GLU C 22 8.865 29.913 -8.997 1.00 0.00 O ATOM 1898 OE2 GLU C 22 10.731 29.502 -7.937 1.00 0.00 O ATOM 0 H GLU C 22 7.144 26.483 -8.071 1.00 0.00 H new ATOM 0 HA GLU C 22 7.811 27.890 -9.691 1.00 0.00 H new ATOM 0 HB2 GLU C 22 10.084 26.651 -8.706 1.00 0.00 H new ATOM 0 HB3 GLU C 22 10.213 26.264 -10.411 1.00 0.00 H new ATOM 0 HG2 GLU C 22 11.447 28.273 -10.019 1.00 0.00 H new ATOM 0 HG3 GLU C 22 10.019 28.697 -10.942 1.00 0.00 H new ATOM 1905 N GLY C 23 6.558 26.006 -11.363 1.00 0.00 N ATOM 1906 CA GLY C 23 6.104 25.453 -12.644 1.00 0.00 C ATOM 1907 C GLY C 23 6.800 24.153 -12.998 1.00 0.00 C ATOM 1908 O GLY C 23 6.728 23.668 -14.128 1.00 0.00 O ATOM 0 H GLY C 23 5.831 26.094 -10.653 1.00 0.00 H new ATOM 0 HA2 GLY C 23 5.028 25.285 -12.602 1.00 0.00 H new ATOM 0 HA3 GLY C 23 6.282 26.183 -13.434 1.00 0.00 H new ATOM 1912 N THR C 24 7.475 23.617 -12.012 1.00 0.00 N ATOM 1913 CA THR C 24 8.380 22.505 -12.185 1.00 0.00 C ATOM 1914 C THR C 24 8.071 21.376 -11.192 1.00 0.00 C ATOM 1915 O THR C 24 7.626 21.627 -10.065 1.00 0.00 O ATOM 1916 CB THR C 24 9.817 23.060 -12.023 1.00 0.00 C ATOM 1917 OG1 THR C 24 10.375 23.346 -13.307 1.00 0.00 O ATOM 1918 CG2 THR C 24 10.751 22.142 -11.247 1.00 0.00 C ATOM 0 H THR C 24 7.411 23.946 -11.049 1.00 0.00 H new ATOM 0 HA THR C 24 8.267 22.059 -13.173 1.00 0.00 H new ATOM 0 HB THR C 24 9.726 23.971 -11.432 1.00 0.00 H new ATOM 0 HG1 THR C 24 11.283 23.698 -13.198 1.00 0.00 H new ATOM 0 HG21 THR C 24 11.737 22.601 -11.177 1.00 0.00 H new ATOM 0 HG22 THR C 24 10.353 21.981 -10.245 1.00 0.00 H new ATOM 0 HG23 THR C 24 10.832 21.185 -11.763 1.00 0.00 H new ATOM 1926 N PRO C 25 8.271 20.111 -11.616 1.00 0.00 N ATOM 1927 CA PRO C 25 7.962 18.940 -10.789 1.00 0.00 C ATOM 1928 C PRO C 25 8.723 18.951 -9.462 1.00 0.00 C ATOM 1929 O PRO C 25 9.934 19.151 -9.424 1.00 0.00 O ATOM 1930 CB PRO C 25 8.380 17.753 -11.660 1.00 0.00 C ATOM 1931 CG PRO C 25 9.316 18.326 -12.665 1.00 0.00 C ATOM 1932 CD PRO C 25 8.826 19.721 -12.923 1.00 0.00 C ATOM 0 HA PRO C 25 6.910 18.908 -10.504 1.00 0.00 H new ATOM 0 HB2 PRO C 25 8.864 16.978 -11.066 1.00 0.00 H new ATOM 0 HB3 PRO C 25 7.517 17.293 -12.141 1.00 0.00 H new ATOM 0 HG2 PRO C 25 10.339 18.333 -12.289 1.00 0.00 H new ATOM 0 HG3 PRO C 25 9.317 17.735 -13.581 1.00 0.00 H new ATOM 0 HD2 PRO C 25 9.633 20.383 -13.235 1.00 0.00 H new ATOM 0 HD3 PRO C 25 8.071 19.747 -13.709 1.00 0.00 H new ATOM 1940 N CYS C 26 7.991 18.733 -8.376 1.00 0.00 N ATOM 1941 CA CYS C 26 8.530 18.880 -7.034 1.00 0.00 C ATOM 1942 C CYS C 26 9.346 17.663 -6.595 1.00 0.00 C ATOM 1943 O CYS C 26 8.917 16.523 -6.766 1.00 0.00 O ATOM 1944 CB CYS C 26 7.374 19.150 -6.069 1.00 0.00 C ATOM 1945 SG CYS C 26 7.869 19.444 -4.335 1.00 0.00 S ATOM 0 H CYS C 26 7.011 18.451 -8.403 1.00 0.00 H new ATOM 0 HA CYS C 26 9.223 19.722 -7.028 1.00 0.00 H new ATOM 0 HB2 CYS C 26 6.819 20.018 -6.425 1.00 0.00 H new ATOM 0 HB3 CYS C 26 6.691 18.301 -6.097 1.00 0.00 H new ATOM 0 HG CYS C 26 6.942 20.124 -3.728 1.00 0.00 H new ATOM 1950 N PRO C 27 10.536 17.931 -6.015 1.00 0.00 N ATOM 1951 CA PRO C 27 11.497 16.922 -5.536 1.00 0.00 C ATOM 1952 C PRO C 27 10.889 15.617 -4.993 1.00 0.00 C ATOM 1953 O PRO C 27 11.124 14.540 -5.528 1.00 0.00 O ATOM 1954 CB PRO C 27 12.171 17.667 -4.389 1.00 0.00 C ATOM 1955 CG PRO C 27 12.182 19.111 -4.784 1.00 0.00 C ATOM 1956 CD PRO C 27 11.077 19.296 -5.809 1.00 0.00 C ATOM 0 HA PRO C 27 12.132 16.581 -6.354 1.00 0.00 H new ATOM 0 HB2 PRO C 27 11.626 17.522 -3.456 1.00 0.00 H new ATOM 0 HB3 PRO C 27 13.184 17.299 -4.227 1.00 0.00 H new ATOM 0 HG2 PRO C 27 12.015 19.750 -3.917 1.00 0.00 H new ATOM 0 HG3 PRO C 27 13.149 19.389 -5.204 1.00 0.00 H new ATOM 0 HD2 PRO C 27 10.308 19.978 -5.446 1.00 0.00 H new ATOM 0 HD3 PRO C 27 11.463 19.716 -6.738 1.00 0.00 H new ATOM 1964 N ALA C 28 10.074 15.738 -3.949 1.00 0.00 N ATOM 1965 CA ALA C 28 9.660 14.568 -3.168 1.00 0.00 C ATOM 1966 C ALA C 28 8.166 14.302 -3.300 1.00 0.00 C ATOM 1967 O ALA C 28 7.667 13.251 -2.900 1.00 0.00 O ATOM 1968 CB ALA C 28 10.041 14.750 -1.711 1.00 0.00 C ATOM 0 H ALA C 28 9.688 16.624 -3.623 1.00 0.00 H new ATOM 0 HA ALA C 28 10.183 13.699 -3.567 1.00 0.00 H new ATOM 0 HB1 ALA C 28 9.728 13.875 -1.141 1.00 0.00 H new ATOM 0 HB2 ALA C 28 11.121 14.869 -1.630 1.00 0.00 H new ATOM 0 HB3 ALA C 28 9.547 15.637 -1.314 1.00 0.00 H new ATOM 1974 N CYS C 29 7.456 15.262 -3.860 1.00 0.00 N ATOM 1975 CA CYS C 29 6.034 15.112 -4.093 1.00 0.00 C ATOM 1976 C CYS C 29 5.734 15.479 -5.544 1.00 0.00 C ATOM 1977 O CYS C 29 5.549 16.655 -5.870 1.00 0.00 O ATOM 1978 CB CYS C 29 5.235 15.982 -3.093 1.00 0.00 C ATOM 1979 SG CYS C 29 5.227 17.776 -3.418 1.00 0.00 S ATOM 0 H CYS C 29 7.842 16.156 -4.163 1.00 0.00 H new ATOM 0 HA CYS C 29 5.728 14.079 -3.929 1.00 0.00 H new ATOM 0 HB2 CYS C 29 4.203 15.631 -3.081 1.00 0.00 H new ATOM 0 HB3 CYS C 29 5.640 15.816 -2.095 1.00 0.00 H new ATOM 0 HG CYS C 29 6.444 18.186 -3.619 1.00 0.00 H new ATOM 1984 N SER C 30 5.724 14.483 -6.430 1.00 0.00 N ATOM 1985 CA SER C 30 5.584 14.727 -7.864 1.00 0.00 C ATOM 1986 C SER C 30 4.152 15.106 -8.248 1.00 0.00 C ATOM 1987 O SER C 30 3.544 14.486 -9.118 1.00 0.00 O ATOM 1988 CB SER C 30 6.021 13.483 -8.634 1.00 0.00 C ATOM 1989 OG SER C 30 7.270 13.008 -8.159 1.00 0.00 O ATOM 0 H SER C 30 5.811 13.498 -6.178 1.00 0.00 H new ATOM 0 HA SER C 30 6.221 15.572 -8.124 1.00 0.00 H new ATOM 0 HB2 SER C 30 5.267 12.703 -8.530 1.00 0.00 H new ATOM 0 HB3 SER C 30 6.096 13.715 -9.696 1.00 0.00 H new ATOM 0 HG SER C 30 7.530 12.210 -8.665 1.00 0.00 H new ATOM 1995 N GLY C 31 3.624 16.123 -7.590 1.00 0.00 N ATOM 1996 CA GLY C 31 2.307 16.613 -7.908 1.00 0.00 C ATOM 1997 C GLY C 31 1.254 16.004 -7.022 1.00 0.00 C ATOM 1998 O GLY C 31 0.218 15.547 -7.497 1.00 0.00 O ATOM 0 H GLY C 31 4.092 16.621 -6.833 1.00 0.00 H new ATOM 0 HA2 GLY C 31 2.288 17.698 -7.802 1.00 0.00 H new ATOM 0 HA3 GLY C 31 2.078 16.390 -8.950 1.00 0.00 H new ATOM 2002 N LYS C 32 1.518 15.988 -5.722 1.00 0.00 N ATOM 2003 CA LYS C 32 0.591 15.441 -4.752 1.00 0.00 C ATOM 2004 C LYS C 32 0.129 16.549 -3.810 1.00 0.00 C ATOM 2005 O LYS C 32 -1.039 16.631 -3.450 1.00 0.00 O ATOM 2006 CB LYS C 32 1.294 14.354 -3.938 1.00 0.00 C ATOM 2007 CG LYS C 32 1.505 13.048 -4.687 1.00 0.00 C ATOM 2008 CD LYS C 32 2.716 12.281 -4.161 1.00 0.00 C ATOM 2009 CE LYS C 32 2.819 12.318 -2.640 1.00 0.00 C ATOM 2010 NZ LYS C 32 1.609 11.773 -1.967 1.00 0.00 N ATOM 0 H LYS C 32 2.379 16.354 -5.316 1.00 0.00 H new ATOM 0 HA LYS C 32 -0.269 15.017 -5.270 1.00 0.00 H new ATOM 0 HB2 LYS C 32 2.263 14.732 -3.610 1.00 0.00 H new ATOM 0 HB3 LYS C 32 0.709 14.154 -3.040 1.00 0.00 H new ATOM 0 HG2 LYS C 32 0.614 12.428 -4.594 1.00 0.00 H new ATOM 0 HG3 LYS C 32 1.639 13.256 -5.749 1.00 0.00 H new ATOM 0 HD2 LYS C 32 2.657 11.244 -4.492 1.00 0.00 H new ATOM 0 HD3 LYS C 32 3.624 12.702 -4.593 1.00 0.00 H new ATOM 0 HE2 LYS C 32 3.692 11.747 -2.326 1.00 0.00 H new ATOM 0 HE3 LYS C 32 2.977 13.347 -2.316 1.00 0.00 H new ATOM 0 HZ1 LYS C 32 1.704 11.885 -0.937 1.00 0.00 H new ATOM 0 HZ2 LYS C 32 0.768 12.289 -2.295 1.00 0.00 H new ATOM 0 HZ3 LYS C 32 1.508 10.764 -2.198 1.00 0.00 H new ATOM 2024 N GLY C 33 1.081 17.389 -3.397 1.00 0.00 N ATOM 2025 CA GLY C 33 0.804 18.447 -2.458 1.00 0.00 C ATOM 2026 C GLY C 33 1.516 18.195 -1.147 1.00 0.00 C ATOM 2027 O GLY C 33 2.099 19.102 -0.559 1.00 0.00 O ATOM 0 H GLY C 33 2.052 17.346 -3.708 1.00 0.00 H new ATOM 0 HA2 GLY C 33 1.124 19.403 -2.874 1.00 0.00 H new ATOM 0 HA3 GLY C 33 -0.270 18.517 -2.287 1.00 0.00 H new ATOM 2031 N VAL C 34 1.548 16.938 -0.740 1.00 0.00 N ATOM 2032 CA VAL C 34 2.134 16.558 0.538 1.00 0.00 C ATOM 2033 C VAL C 34 3.346 15.643 0.349 1.00 0.00 C ATOM 2034 O VAL C 34 3.570 15.110 -0.741 1.00 0.00 O ATOM 2035 CB VAL C 34 1.092 15.844 1.427 1.00 0.00 C ATOM 2036 CG1 VAL C 34 -0.037 16.789 1.813 1.00 0.00 C ATOM 2037 CG2 VAL C 34 0.538 14.621 0.718 1.00 0.00 C ATOM 0 H VAL C 34 1.173 16.157 -1.279 1.00 0.00 H new ATOM 0 HA VAL C 34 2.461 17.476 1.027 1.00 0.00 H new ATOM 0 HB VAL C 34 1.592 15.523 2.340 1.00 0.00 H new ATOM 0 HG11 VAL C 34 -0.756 16.260 2.439 1.00 0.00 H new ATOM 0 HG12 VAL C 34 0.370 17.636 2.365 1.00 0.00 H new ATOM 0 HG13 VAL C 34 -0.535 17.148 0.912 1.00 0.00 H new ATOM 0 HG21 VAL C 34 -0.195 14.130 1.358 1.00 0.00 H new ATOM 0 HG22 VAL C 34 0.060 14.926 -0.213 1.00 0.00 H new ATOM 0 HG23 VAL C 34 1.351 13.928 0.499 1.00 0.00 H new ATOM 2047 N ILE C 35 4.123 15.498 1.415 1.00 0.00 N ATOM 2048 CA ILE C 35 5.274 14.602 1.452 1.00 0.00 C ATOM 2049 C ILE C 35 5.139 13.633 2.620 1.00 0.00 C ATOM 2050 O ILE C 35 4.412 13.899 3.565 1.00 0.00 O ATOM 2051 CB ILE C 35 6.603 15.373 1.588 1.00 0.00 C ATOM 2052 CG1 ILE C 35 6.434 16.550 2.551 1.00 0.00 C ATOM 2053 CG2 ILE C 35 7.085 15.844 0.228 1.00 0.00 C ATOM 2054 CD1 ILE C 35 7.723 17.271 2.880 1.00 0.00 C ATOM 0 H ILE C 35 3.971 16.004 2.288 1.00 0.00 H new ATOM 0 HA ILE C 35 5.292 14.058 0.508 1.00 0.00 H new ATOM 0 HB ILE C 35 7.359 14.703 1.998 1.00 0.00 H new ATOM 0 HG12 ILE C 35 5.733 17.263 2.117 1.00 0.00 H new ATOM 0 HG13 ILE C 35 5.987 16.187 3.477 1.00 0.00 H new ATOM 0 HG21 ILE C 35 8.024 16.386 0.342 1.00 0.00 H new ATOM 0 HG22 ILE C 35 7.240 14.982 -0.421 1.00 0.00 H new ATOM 0 HG23 ILE C 35 6.338 16.502 -0.215 1.00 0.00 H new ATOM 0 HD11 ILE C 35 7.516 18.091 3.568 1.00 0.00 H new ATOM 0 HD12 ILE C 35 8.421 16.575 3.345 1.00 0.00 H new ATOM 0 HD13 ILE C 35 8.162 17.667 1.964 1.00 0.00 H new ATOM 2066 N LEU C 36 5.854 12.526 2.558 1.00 0.00 N ATOM 2067 CA LEU C 36 5.656 11.441 3.515 1.00 0.00 C ATOM 2068 C LEU C 36 6.461 11.610 4.796 1.00 0.00 C ATOM 2069 O LEU C 36 7.362 12.446 4.892 1.00 0.00 O ATOM 2070 CB LEU C 36 6.030 10.106 2.873 1.00 0.00 C ATOM 2071 CG LEU C 36 5.303 9.792 1.569 1.00 0.00 C ATOM 2072 CD1 LEU C 36 6.135 10.210 0.364 1.00 0.00 C ATOM 2073 CD2 LEU C 36 4.957 8.319 1.511 1.00 0.00 C ATOM 0 H LEU C 36 6.576 12.349 1.860 1.00 0.00 H new ATOM 0 HA LEU C 36 4.601 11.464 3.787 1.00 0.00 H new ATOM 0 HB2 LEU C 36 7.103 10.099 2.684 1.00 0.00 H new ATOM 0 HB3 LEU C 36 5.827 9.307 3.586 1.00 0.00 H new ATOM 0 HG LEU C 36 4.377 10.366 1.540 1.00 0.00 H new ATOM 0 HD11 LEU C 36 5.593 9.975 -0.552 1.00 0.00 H new ATOM 0 HD12 LEU C 36 6.325 11.282 0.408 1.00 0.00 H new ATOM 0 HD13 LEU C 36 7.083 9.673 0.373 1.00 0.00 H new ATOM 0 HD21 LEU C 36 4.438 8.104 0.577 1.00 0.00 H new ATOM 0 HD22 LEU C 36 5.871 7.728 1.563 1.00 0.00 H new ATOM 0 HD23 LEU C 36 4.312 8.063 2.352 1.00 0.00 H new ATOM 2085 N THR C 37 6.114 10.782 5.774 1.00 0.00 N ATOM 2086 CA THR C 37 6.812 10.719 7.043 1.00 0.00 C ATOM 2087 C THR C 37 7.677 9.470 7.049 1.00 0.00 C ATOM 2088 O THR C 37 7.665 8.727 6.075 1.00 0.00 O ATOM 2089 CB THR C 37 5.814 10.625 8.220 1.00 0.00 C ATOM 2090 OG1 THR C 37 5.144 9.352 8.189 1.00 0.00 O ATOM 2091 CG2 THR C 37 4.770 11.729 8.157 1.00 0.00 C ATOM 0 H THR C 37 5.332 10.131 5.703 1.00 0.00 H new ATOM 0 HA THR C 37 7.412 11.622 7.161 1.00 0.00 H new ATOM 0 HB THR C 37 6.382 10.735 9.144 1.00 0.00 H new ATOM 0 HG1 THR C 37 4.376 9.372 8.797 1.00 0.00 H new ATOM 0 HG21 THR C 37 4.086 11.631 9.000 1.00 0.00 H new ATOM 0 HG22 THR C 37 5.264 12.700 8.201 1.00 0.00 H new ATOM 0 HG23 THR C 37 4.211 11.648 7.225 1.00 0.00 H new ATOM 2099 N ALA C 38 8.409 9.217 8.119 1.00 0.00 N ATOM 2100 CA ALA C 38 9.217 8.006 8.191 1.00 0.00 C ATOM 2101 C ALA C 38 8.328 6.767 8.108 1.00 0.00 C ATOM 2102 O ALA C 38 8.646 5.809 7.396 1.00 0.00 O ATOM 2103 CB ALA C 38 10.053 7.992 9.456 1.00 0.00 C ATOM 0 H ALA C 38 8.463 9.821 8.939 1.00 0.00 H new ATOM 0 HA ALA C 38 9.898 7.994 7.340 1.00 0.00 H new ATOM 0 HB1 ALA C 38 10.648 7.079 9.489 1.00 0.00 H new ATOM 0 HB2 ALA C 38 10.716 8.858 9.464 1.00 0.00 H new ATOM 0 HB3 ALA C 38 9.397 8.029 10.326 1.00 0.00 H new ATOM 2109 N GLN C 39 7.206 6.794 8.828 1.00 0.00 N ATOM 2110 CA GLN C 39 6.223 5.719 8.742 1.00 0.00 C ATOM 2111 C GLN C 39 5.687 5.602 7.320 1.00 0.00 C ATOM 2112 O GLN C 39 5.555 4.499 6.791 1.00 0.00 O ATOM 2113 CB GLN C 39 5.069 5.953 9.720 1.00 0.00 C ATOM 2114 CG GLN C 39 4.087 4.793 9.776 1.00 0.00 C ATOM 2115 CD GLN C 39 2.980 5.006 10.783 1.00 0.00 C ATOM 2116 OE1 GLN C 39 3.167 5.662 11.807 1.00 0.00 O ATOM 2117 NE2 GLN C 39 1.818 4.449 10.494 1.00 0.00 N ATOM 0 H GLN C 39 6.958 7.544 9.473 1.00 0.00 H new ATOM 0 HA GLN C 39 6.719 4.786 9.012 1.00 0.00 H new ATOM 0 HB2 GLN C 39 5.475 6.125 10.717 1.00 0.00 H new ATOM 0 HB3 GLN C 39 4.535 6.859 9.432 1.00 0.00 H new ATOM 0 HG2 GLN C 39 3.649 4.646 8.789 1.00 0.00 H new ATOM 0 HG3 GLN C 39 4.626 3.879 10.025 1.00 0.00 H new ATOM 0 HE21 GLN C 39 1.709 3.914 9.633 1.00 0.00 H new ATOM 0 HE22 GLN C 39 1.029 4.554 11.132 1.00 0.00 H new ATOM 2126 N GLY C 40 5.411 6.742 6.690 1.00 0.00 N ATOM 2127 CA GLY C 40 4.903 6.727 5.334 1.00 0.00 C ATOM 2128 C GLY C 40 5.960 6.287 4.342 1.00 0.00 C ATOM 2129 O GLY C 40 5.656 5.658 3.336 1.00 0.00 O ATOM 0 H GLY C 40 5.530 7.671 7.095 1.00 0.00 H new ATOM 0 HA2 GLY C 40 4.046 6.056 5.274 1.00 0.00 H new ATOM 0 HA3 GLY C 40 4.547 7.722 5.068 1.00 0.00 H new ATOM 2133 N TYR C 41 7.211 6.602 4.645 1.00 0.00 N ATOM 2134 CA TYR C 41 8.334 6.196 3.809 1.00 0.00 C ATOM 2135 C TYR C 41 8.573 4.695 3.883 1.00 0.00 C ATOM 2136 O TYR C 41 8.981 4.078 2.898 1.00 0.00 O ATOM 2137 CB TYR C 41 9.598 6.942 4.250 1.00 0.00 C ATOM 2138 CG TYR C 41 9.924 8.167 3.419 1.00 0.00 C ATOM 2139 CD1 TYR C 41 10.631 8.051 2.228 1.00 0.00 C ATOM 2140 CD2 TYR C 41 9.539 9.437 3.829 1.00 0.00 C ATOM 2141 CE1 TYR C 41 10.938 9.165 1.468 1.00 0.00 C ATOM 2142 CE2 TYR C 41 9.843 10.556 3.075 1.00 0.00 C ATOM 2143 CZ TYR C 41 10.544 10.416 1.896 1.00 0.00 C ATOM 2144 OH TYR C 41 10.850 11.529 1.143 1.00 0.00 O ATOM 0 H TYR C 41 7.476 7.141 5.469 1.00 0.00 H new ATOM 0 HA TYR C 41 8.094 6.447 2.776 1.00 0.00 H new ATOM 0 HB2 TYR C 41 9.482 7.244 5.291 1.00 0.00 H new ATOM 0 HB3 TYR C 41 10.443 6.255 4.210 1.00 0.00 H new ATOM 0 HD1 TYR C 41 10.946 7.075 1.890 1.00 0.00 H new ATOM 0 HD2 TYR C 41 8.992 9.553 4.753 1.00 0.00 H new ATOM 0 HE1 TYR C 41 11.484 9.056 0.543 1.00 0.00 H new ATOM 0 HE2 TYR C 41 9.533 11.535 3.408 1.00 0.00 H new ATOM 0 HH TYR C 41 10.499 12.330 1.585 1.00 0.00 H new ATOM 2154 N THR C 42 8.302 4.102 5.033 1.00 0.00 N ATOM 2155 CA THR C 42 8.364 2.658 5.168 1.00 0.00 C ATOM 2156 C THR C 42 7.220 2.018 4.394 1.00 0.00 C ATOM 2157 O THR C 42 7.360 0.940 3.810 1.00 0.00 O ATOM 2158 CB THR C 42 8.253 2.250 6.644 1.00 0.00 C ATOM 2159 OG1 THR C 42 9.170 3.019 7.423 1.00 0.00 O ATOM 2160 CG2 THR C 42 8.533 0.768 6.831 1.00 0.00 C ATOM 0 H THR C 42 8.038 4.597 5.885 1.00 0.00 H new ATOM 0 HA THR C 42 9.320 2.317 4.771 1.00 0.00 H new ATOM 0 HB THR C 42 7.233 2.444 6.976 1.00 0.00 H new ATOM 0 HG1 THR C 42 8.851 3.944 7.485 1.00 0.00 H new ATOM 0 HG21 THR C 42 8.446 0.512 7.887 1.00 0.00 H new ATOM 0 HG22 THR C 42 7.813 0.186 6.256 1.00 0.00 H new ATOM 0 HG23 THR C 42 9.541 0.542 6.484 1.00 0.00 H new ATOM 2168 N LEU C 43 6.105 2.729 4.342 1.00 0.00 N ATOM 2169 CA LEU C 43 4.893 2.205 3.743 1.00 0.00 C ATOM 2170 C LEU C 43 4.871 2.466 2.244 1.00 0.00 C ATOM 2171 O LEU C 43 4.195 1.757 1.510 1.00 0.00 O ATOM 2172 CB LEU C 43 3.647 2.824 4.403 1.00 0.00 C ATOM 2173 CG LEU C 43 2.959 1.980 5.495 1.00 0.00 C ATOM 2174 CD1 LEU C 43 3.962 1.510 6.538 1.00 0.00 C ATOM 2175 CD2 LEU C 43 1.856 2.788 6.161 1.00 0.00 C ATOM 0 H LEU C 43 6.017 3.676 4.710 1.00 0.00 H new ATOM 0 HA LEU C 43 4.879 1.128 3.908 1.00 0.00 H new ATOM 0 HB2 LEU C 43 3.932 3.781 4.840 1.00 0.00 H new ATOM 0 HB3 LEU C 43 2.916 3.034 3.622 1.00 0.00 H new ATOM 0 HG LEU C 43 2.524 1.100 5.020 1.00 0.00 H new ATOM 0 HD11 LEU C 43 3.449 0.917 7.295 1.00 0.00 H new ATOM 0 HD12 LEU C 43 4.728 0.901 6.058 1.00 0.00 H new ATOM 0 HD13 LEU C 43 4.429 2.375 7.009 1.00 0.00 H new ATOM 0 HD21 LEU C 43 1.376 2.183 6.931 1.00 0.00 H new ATOM 0 HD22 LEU C 43 2.283 3.682 6.616 1.00 0.00 H new ATOM 0 HD23 LEU C 43 1.117 3.079 5.415 1.00 0.00 H new ATOM 2187 N LEU C 44 5.625 3.456 1.769 1.00 0.00 N ATOM 2188 CA LEU C 44 5.606 3.783 0.351 1.00 0.00 C ATOM 2189 C LEU C 44 6.491 2.815 -0.430 1.00 0.00 C ATOM 2190 O LEU C 44 6.096 2.319 -1.477 1.00 0.00 O ATOM 2191 CB LEU C 44 6.027 5.253 0.110 1.00 0.00 C ATOM 2192 CG LEU C 44 7.524 5.529 -0.121 1.00 0.00 C ATOM 2193 CD1 LEU C 44 7.917 5.259 -1.570 1.00 0.00 C ATOM 2194 CD2 LEU C 44 7.874 6.963 0.230 1.00 0.00 C ATOM 0 H LEU C 44 6.245 4.034 2.336 1.00 0.00 H new ATOM 0 HA LEU C 44 4.584 3.676 -0.012 1.00 0.00 H new ATOM 0 HB2 LEU C 44 5.478 5.624 -0.756 1.00 0.00 H new ATOM 0 HB3 LEU C 44 5.704 5.842 0.969 1.00 0.00 H new ATOM 0 HG LEU C 44 8.079 4.854 0.531 1.00 0.00 H new ATOM 0 HD11 LEU C 44 8.980 5.463 -1.703 1.00 0.00 H new ATOM 0 HD12 LEU C 44 7.714 4.216 -1.814 1.00 0.00 H new ATOM 0 HD13 LEU C 44 7.339 5.905 -2.230 1.00 0.00 H new ATOM 0 HD21 LEU C 44 8.937 7.131 0.058 1.00 0.00 H new ATOM 0 HD22 LEU C 44 7.294 7.642 -0.394 1.00 0.00 H new ATOM 0 HD23 LEU C 44 7.643 7.148 1.279 1.00 0.00 H new ATOM 2206 N ASP C 45 7.681 2.537 0.084 1.00 0.00 N ATOM 2207 CA ASP C 45 8.630 1.685 -0.624 1.00 0.00 C ATOM 2208 C ASP C 45 8.181 0.233 -0.585 1.00 0.00 C ATOM 2209 O ASP C 45 8.515 -0.560 -1.468 1.00 0.00 O ATOM 2210 CB ASP C 45 10.026 1.837 -0.022 1.00 0.00 C ATOM 2211 CG ASP C 45 11.084 1.050 -0.771 1.00 0.00 C ATOM 2212 OD1 ASP C 45 11.425 1.442 -1.906 1.00 0.00 O ATOM 2213 OD2 ASP C 45 11.602 0.061 -0.216 1.00 0.00 O ATOM 0 H ASP C 45 8.012 2.886 0.983 1.00 0.00 H new ATOM 0 HA ASP C 45 8.667 1.998 -1.667 1.00 0.00 H new ATOM 0 HB2 ASP C 45 10.301 2.892 -0.018 1.00 0.00 H new ATOM 0 HB3 ASP C 45 10.005 1.509 1.017 1.00 0.00 H new ATOM 2218 N PHE C 46 7.374 -0.098 0.409 1.00 0.00 N ATOM 2219 CA PHE C 46 6.797 -1.426 0.508 1.00 0.00 C ATOM 2220 C PHE C 46 5.673 -1.590 -0.501 1.00 0.00 C ATOM 2221 O PHE C 46 5.535 -2.646 -1.122 1.00 0.00 O ATOM 2222 CB PHE C 46 6.243 -1.613 1.923 1.00 0.00 C ATOM 2223 CG PHE C 46 5.572 -2.932 2.180 1.00 0.00 C ATOM 2224 CD1 PHE C 46 4.212 -3.089 1.958 1.00 0.00 C ATOM 2225 CD2 PHE C 46 6.297 -4.006 2.667 1.00 0.00 C ATOM 2226 CE1 PHE C 46 3.592 -4.293 2.212 1.00 0.00 C ATOM 2227 CE2 PHE C 46 5.679 -5.213 2.921 1.00 0.00 C ATOM 2228 CZ PHE C 46 4.326 -5.355 2.696 1.00 0.00 C ATOM 0 H PHE C 46 7.104 0.537 1.160 1.00 0.00 H new ATOM 0 HA PHE C 46 7.564 -2.172 0.299 1.00 0.00 H new ATOM 0 HB2 PHE C 46 7.061 -1.495 2.634 1.00 0.00 H new ATOM 0 HB3 PHE C 46 5.528 -0.815 2.124 1.00 0.00 H new ATOM 0 HD1 PHE C 46 3.633 -2.259 1.582 1.00 0.00 H new ATOM 0 HD2 PHE C 46 7.356 -3.898 2.850 1.00 0.00 H new ATOM 0 HE1 PHE C 46 2.533 -4.405 2.032 1.00 0.00 H new ATOM 0 HE2 PHE C 46 6.255 -6.046 3.296 1.00 0.00 H new ATOM 0 HZ PHE C 46 3.841 -6.298 2.899 1.00 0.00 H new ATOM 2238 N ILE C 47 4.887 -0.550 -0.691 1.00 0.00 N ATOM 2239 CA ILE C 47 3.792 -0.636 -1.633 1.00 0.00 C ATOM 2240 C ILE C 47 4.304 -0.471 -3.061 1.00 0.00 C ATOM 2241 O ILE C 47 3.755 -1.040 -4.001 1.00 0.00 O ATOM 2242 CB ILE C 47 2.675 0.385 -1.328 1.00 0.00 C ATOM 2243 CG1 ILE C 47 3.212 1.817 -1.408 1.00 0.00 C ATOM 2244 CG2 ILE C 47 2.089 0.107 0.047 1.00 0.00 C ATOM 2245 CD1 ILE C 47 2.196 2.882 -1.054 1.00 0.00 C ATOM 0 H ILE C 47 4.983 0.348 -0.216 1.00 0.00 H new ATOM 0 HA ILE C 47 3.351 -1.627 -1.529 1.00 0.00 H new ATOM 0 HB ILE C 47 1.889 0.281 -2.076 1.00 0.00 H new ATOM 0 HG12 ILE C 47 4.067 1.910 -0.739 1.00 0.00 H new ATOM 0 HG13 ILE C 47 3.577 2.000 -2.419 1.00 0.00 H new ATOM 0 HG21 ILE C 47 1.301 0.829 0.259 1.00 0.00 H new ATOM 0 HG22 ILE C 47 1.673 -0.900 0.068 1.00 0.00 H new ATOM 0 HG23 ILE C 47 2.872 0.192 0.800 1.00 0.00 H new ATOM 0 HD11 ILE C 47 2.657 3.866 -1.136 1.00 0.00 H new ATOM 0 HD12 ILE C 47 1.350 2.820 -1.738 1.00 0.00 H new ATOM 0 HD13 ILE C 47 1.848 2.728 -0.032 1.00 0.00 H new ATOM 2257 N GLN C 48 5.386 0.276 -3.205 1.00 0.00 N ATOM 2258 CA GLN C 48 6.116 0.331 -4.450 1.00 0.00 C ATOM 2259 C GLN C 48 6.536 -1.071 -4.865 1.00 0.00 C ATOM 2260 O GLN C 48 6.112 -1.570 -5.889 1.00 0.00 O ATOM 2261 CB GLN C 48 7.349 1.216 -4.295 1.00 0.00 C ATOM 2262 CG GLN C 48 7.044 2.704 -4.300 1.00 0.00 C ATOM 2263 CD GLN C 48 6.773 3.220 -5.697 1.00 0.00 C ATOM 2264 OE1 GLN C 48 7.328 2.713 -6.673 1.00 0.00 O ATOM 2265 NE2 GLN C 48 5.918 4.221 -5.806 1.00 0.00 N ATOM 0 H GLN C 48 5.777 0.857 -2.463 1.00 0.00 H new ATOM 0 HA GLN C 48 5.471 0.754 -5.220 1.00 0.00 H new ATOM 0 HB2 GLN C 48 7.852 0.961 -3.362 1.00 0.00 H new ATOM 0 HB3 GLN C 48 8.046 0.995 -5.103 1.00 0.00 H new ATOM 0 HG2 GLN C 48 6.179 2.899 -3.667 1.00 0.00 H new ATOM 0 HG3 GLN C 48 7.884 3.248 -3.869 1.00 0.00 H new ATOM 0 HE21 GLN C 48 5.481 4.611 -4.971 1.00 0.00 H new ATOM 0 HE22 GLN C 48 5.695 4.603 -6.725 1.00 0.00 H new ATOM 2274 N LYS C 49 7.273 -1.736 -3.997 1.00 0.00 N ATOM 2275 CA LYS C 49 7.984 -2.961 -4.352 1.00 0.00 C ATOM 2276 C LYS C 49 7.065 -4.195 -4.390 1.00 0.00 C ATOM 2277 O LYS C 49 7.523 -5.316 -4.610 1.00 0.00 O ATOM 2278 CB LYS C 49 9.150 -3.127 -3.366 1.00 0.00 C ATOM 2279 CG LYS C 49 10.007 -4.369 -3.581 1.00 0.00 C ATOM 2280 CD LYS C 49 11.220 -4.396 -2.660 1.00 0.00 C ATOM 2281 CE LYS C 49 12.130 -3.198 -2.890 1.00 0.00 C ATOM 2282 NZ LYS C 49 12.576 -3.093 -4.309 1.00 0.00 N ATOM 0 H LYS C 49 7.399 -1.448 -3.027 1.00 0.00 H new ATOM 0 HA LYS C 49 8.368 -2.877 -5.369 1.00 0.00 H new ATOM 0 HB2 LYS C 49 9.790 -2.247 -3.433 1.00 0.00 H new ATOM 0 HB3 LYS C 49 8.748 -3.153 -2.353 1.00 0.00 H new ATOM 0 HG2 LYS C 49 9.403 -5.260 -3.410 1.00 0.00 H new ATOM 0 HG3 LYS C 49 10.339 -4.404 -4.618 1.00 0.00 H new ATOM 0 HD2 LYS C 49 10.888 -4.407 -1.622 1.00 0.00 H new ATOM 0 HD3 LYS C 49 11.781 -5.316 -2.825 1.00 0.00 H new ATOM 0 HE2 LYS C 49 11.605 -2.286 -2.608 1.00 0.00 H new ATOM 0 HE3 LYS C 49 13.003 -3.277 -2.242 1.00 0.00 H new ATOM 0 HZ1 LYS C 49 13.321 -2.372 -4.386 1.00 0.00 H new ATOM 0 HZ2 LYS C 49 12.949 -4.011 -4.625 1.00 0.00 H new ATOM 0 HZ3 LYS C 49 11.769 -2.823 -4.907 1.00 0.00 H new ATOM 2296 N HIS C 50 5.769 -4.019 -4.145 1.00 0.00 N ATOM 2297 CA HIS C 50 4.849 -5.115 -4.476 1.00 0.00 C ATOM 2298 C HIS C 50 3.828 -4.759 -5.561 1.00 0.00 C ATOM 2299 O HIS C 50 3.043 -5.617 -5.960 1.00 0.00 O ATOM 2300 CB HIS C 50 4.123 -5.585 -3.213 1.00 0.00 C ATOM 2301 CG HIS C 50 5.062 -6.068 -2.154 1.00 0.00 C ATOM 2302 ND1 HIS C 50 5.522 -5.258 -1.142 1.00 0.00 N ATOM 2303 CD2 HIS C 50 5.668 -7.265 -1.980 1.00 0.00 C ATOM 2304 CE1 HIS C 50 6.370 -5.929 -0.394 1.00 0.00 C ATOM 2305 NE2 HIS C 50 6.478 -7.148 -0.879 1.00 0.00 N ATOM 0 H HIS C 50 5.346 -3.183 -3.743 1.00 0.00 H new ATOM 0 HA HIS C 50 5.463 -5.917 -4.885 1.00 0.00 H new ATOM 0 HB2 HIS C 50 3.525 -4.765 -2.816 1.00 0.00 H new ATOM 0 HB3 HIS C 50 3.432 -6.387 -3.473 1.00 0.00 H new ATOM 0 HD1 HIS C 50 5.248 -4.287 -0.995 1.00 0.00 H new ATOM 0 HD2 HIS C 50 5.539 -8.146 -2.592 1.00 0.00 H new ATOM 0 HE1 HIS C 50 6.890 -5.545 0.471 1.00 0.00 H new ATOM 2314 N LEU C 51 3.836 -3.526 -6.057 1.00 0.00 N ATOM 2315 CA LEU C 51 2.957 -3.166 -7.179 1.00 0.00 C ATOM 2316 C LEU C 51 3.765 -2.678 -8.378 1.00 0.00 C ATOM 2317 O LEU C 51 3.485 -3.031 -9.524 1.00 0.00 O ATOM 2318 CB LEU C 51 1.957 -2.061 -6.801 1.00 0.00 C ATOM 2319 CG LEU C 51 0.789 -2.452 -5.873 1.00 0.00 C ATOM 2320 CD1 LEU C 51 0.030 -3.663 -6.404 1.00 0.00 C ATOM 2321 CD2 LEU C 51 1.276 -2.710 -4.462 1.00 0.00 C ATOM 0 H LEU C 51 4.426 -2.768 -5.713 1.00 0.00 H new ATOM 0 HA LEU C 51 2.411 -4.074 -7.435 1.00 0.00 H new ATOM 0 HB2 LEU C 51 2.511 -1.253 -6.323 1.00 0.00 H new ATOM 0 HB3 LEU C 51 1.536 -1.658 -7.722 1.00 0.00 H new ATOM 0 HG LEU C 51 0.099 -1.608 -5.851 1.00 0.00 H new ATOM 0 HD11 LEU C 51 -0.785 -3.908 -5.724 1.00 0.00 H new ATOM 0 HD12 LEU C 51 -0.376 -3.435 -7.389 1.00 0.00 H new ATOM 0 HD13 LEU C 51 0.708 -4.513 -6.479 1.00 0.00 H new ATOM 0 HD21 LEU C 51 0.431 -2.984 -3.830 1.00 0.00 H new ATOM 0 HD22 LEU C 51 2.001 -3.524 -4.471 1.00 0.00 H new ATOM 0 HD23 LEU C 51 1.746 -1.809 -4.069 1.00 0.00 H new ATOM 2333 N ASN C 52 4.776 -1.879 -8.094 1.00 0.00 N ATOM 2334 CA ASN C 52 5.479 -1.103 -9.110 1.00 0.00 C ATOM 2335 C ASN C 52 6.986 -1.374 -9.113 1.00 0.00 C ATOM 2336 O ASN C 52 7.652 -1.195 -10.131 1.00 0.00 O ATOM 2337 CB ASN C 52 5.206 0.382 -8.867 1.00 0.00 C ATOM 2338 CG ASN C 52 4.202 0.958 -9.855 1.00 0.00 C ATOM 2339 OD1 ASN C 52 3.419 1.847 -9.521 1.00 0.00 O ATOM 2340 ND2 ASN C 52 4.234 0.477 -11.091 1.00 0.00 N ATOM 0 H ASN C 52 5.138 -1.746 -7.150 1.00 0.00 H new ATOM 0 HA ASN C 52 5.107 -1.404 -10.089 1.00 0.00 H new ATOM 0 HB2 ASN C 52 4.832 0.518 -7.852 1.00 0.00 H new ATOM 0 HB3 ASN C 52 6.141 0.937 -8.939 1.00 0.00 H new ATOM 0 HD21 ASN C 52 3.597 0.844 -11.798 1.00 0.00 H new ATOM 0 HD22 ASN C 52 4.896 -0.260 -11.334 1.00 0.00 H new ATOM 2347 N LYS C 53 7.516 -1.793 -7.980 1.00 0.00 N ATOM 2348 CA LYS C 53 8.921 -2.147 -7.860 1.00 0.00 C ATOM 2349 C LYS C 53 9.068 -3.650 -7.663 1.00 0.00 C ATOM 2350 O LYS C 53 9.668 -4.059 -6.647 1.00 0.00 O ATOM 2351 CB LYS C 53 9.570 -1.414 -6.677 1.00 0.00 C ATOM 2352 CG LYS C 53 10.458 -0.253 -7.087 1.00 0.00 C ATOM 2353 CD LYS C 53 11.352 0.189 -5.937 1.00 0.00 C ATOM 2354 CE LYS C 53 10.625 1.096 -4.966 1.00 0.00 C ATOM 2355 NZ LYS C 53 10.279 2.403 -5.591 1.00 0.00 N ATOM 2356 OXT LYS C 53 8.557 -4.413 -8.507 1.00 0.00 O ATOM 0 H LYS C 53 6.986 -1.898 -7.115 1.00 0.00 H new ATOM 0 HA LYS C 53 9.424 -1.848 -8.779 1.00 0.00 H new ATOM 0 HB2 LYS C 53 8.786 -1.044 -6.017 1.00 0.00 H new ATOM 0 HB3 LYS C 53 10.162 -2.126 -6.101 1.00 0.00 H new ATOM 0 HG2 LYS C 53 11.073 -0.545 -7.938 1.00 0.00 H new ATOM 0 HG3 LYS C 53 9.840 0.584 -7.413 1.00 0.00 H new ATOM 0 HD2 LYS C 53 11.720 -0.689 -5.406 1.00 0.00 H new ATOM 0 HD3 LYS C 53 12.223 0.709 -6.335 1.00 0.00 H new ATOM 0 HE2 LYS C 53 9.715 0.605 -4.620 1.00 0.00 H new ATOM 0 HE3 LYS C 53 11.249 1.265 -4.089 1.00 0.00 H new ATOM 0 HZ1 LYS C 53 10.284 3.147 -4.865 1.00 0.00 H new ATOM 0 HZ2 LYS C 53 10.978 2.632 -6.326 1.00 0.00 H new ATOM 0 HZ3 LYS C 53 9.333 2.343 -6.019 1.00 0.00 H new