USER MOD reduce.3.24.130724 H: found=0, std=0, add=1164, rem=0, adj=42 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: C 12 CYS SG : rot 175:sc= 0.0977 USER MOD Set 1.2: C 15 CYS SG : rot 110:sc= -1.5! USER MOD Set 1.3: C 26 CYS SG : rot -175:sc= -2.01! USER MOD Set 1.4: C 29 CYS SG : rot -45:sc= -2.06! USER MOD Set 2.1: B 12 CYS SG : rot 148:sc= -2.72! USER MOD Set 2.2: B 15 CYS SG : rot -162:sc= 1.23 USER MOD Set 2.3: B 26 CYS SG : rot -178:sc= 1.22 USER MOD Set 2.4: B 29 CYS SG : rot -30:sc= 0.836 USER MOD Set 3.1: A 12 CYS SG : rot 155:sc= -1.27! USER MOD Set 3.2: A 15 CYS SG : rot -158:sc= 0.628 USER MOD Set 3.3: A 26 CYS SG : rot -171:sc= 0.828! USER MOD Set 3.4: A 29 CYS SG : rot -27:sc= 0.339 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ -118:sc= -0.363 (180deg=-1.92!) 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 32 LYS NZ :NH3+ 168:sc= 1.12 (180deg=0.733) USER MOD Single : A 37 THR OG1 : rot 180:sc= -0.0637 USER MOD Single : A 39 GLN : amide:sc= 0 K(o=0,f=-0.63) USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot -171:sc= 0.139 USER MOD Single : A 48 GLN : amide:sc= -0.267 K(o=-0.27,f=-1.7!) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 HIS : no HE2:sc= -3.24 K(o=-3.2,f=-6.3!) USER MOD Single : A 52 ASN : amide:sc= -0.411 X(o=-0.41,f=-0.66) USER MOD Single : A 53 LYS NZ :NH3+ -153:sc= 1.22 (180deg=0.789) USER MOD Single : B 5 THR OG1 : rot 180:sc= 0 USER MOD Single : B 14 LYS NZ :NH3+ -114:sc= -0.496 (180deg=-2.26!) 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 32 LYS NZ :NH3+ 168:sc= 1.02 (180deg=0.616) USER MOD Single : B 37 THR OG1 : rot 48:sc= -0.109 USER MOD Single : B 39 GLN : amide:sc= 0 K(o=0,f=-0.58) USER MOD Single : B 41 TYR OH : rot 180:sc= 0 USER MOD Single : B 42 THR OG1 : rot -170:sc= 0.182 USER MOD Single : B 48 GLN : amide:sc= -0.153 K(o=-0.15,f=-1.6!) USER MOD Single : B 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 50 HIS : no HE2:sc= -3.99 K(o=-4,f=-7!) USER MOD Single : B 52 ASN : amide:sc= -0.386 X(o=-0.39,f=-0.83) USER MOD Single : B 53 LYS NZ :NH3+ -139:sc= 1.09 (180deg=0.0684) USER MOD Single : C 5 THR OG1 : rot 180:sc= 0.00105 USER MOD Single : C 14 LYS NZ :NH3+ 127:sc= -0.697 (180deg=-2.66!) USER MOD Single : C 24 THR OG1 : rot 86:sc=0.000227 USER MOD Single : C 30 SER OG : rot 180:sc= 0 USER MOD Single : C 32 LYS NZ :NH3+ 169:sc= 1.05 (180deg=0.643) USER MOD Single : C 37 THR OG1 : rot 180:sc= -0.1 USER MOD Single : C 39 GLN : amide:sc= 0 K(o=0,f=-0.57) USER MOD Single : C 41 TYR OH : rot 180:sc= 0 USER MOD Single : C 42 THR OG1 : rot -170:sc= 0.236 USER MOD Single : C 48 GLN : amide:sc= -0.188 K(o=-0.19,f=-1.6!) USER MOD Single : C 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 50 HIS : no HE2:sc= -3.23 K(o=-3.2,f=-5.6!) USER MOD Single : C 52 ASN : amide:sc= -0.548 X(o=-0.55,f=-0.81) USER MOD Single : C 53 LYS NZ :NH3+ -165:sc= 1.13 (180deg=0.785) USER MOD ----------------------------------------------------------------- ATOM 21 N VAL A 2 -0.423 -9.045 13.864 1.00 0.00 N ATOM 22 CA VAL A 2 -1.253 -8.225 14.739 1.00 0.00 C ATOM 23 C VAL A 2 -2.394 -7.579 13.947 1.00 0.00 C ATOM 24 O VAL A 2 -3.316 -6.990 14.512 1.00 0.00 O ATOM 25 CB VAL A 2 -0.400 -7.138 15.441 1.00 0.00 C ATOM 26 CG1 VAL A 2 0.121 -6.116 14.440 1.00 0.00 C ATOM 27 CG2 VAL A 2 -1.179 -6.459 16.561 1.00 0.00 C ATOM 0 HA VAL A 2 -1.684 -8.871 15.504 1.00 0.00 H new ATOM 0 HB VAL A 2 0.460 -7.635 15.890 1.00 0.00 H new ATOM 0 HG11 VAL A 2 0.716 -5.366 14.962 1.00 0.00 H new ATOM 0 HG12 VAL A 2 0.741 -6.618 13.697 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -0.720 -5.631 13.944 1.00 0.00 H new ATOM 0 HG21 VAL A 2 -0.553 -5.702 17.033 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -2.071 -5.987 16.149 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -1.472 -7.202 17.303 1.00 0.00 H new ATOM 37 N ILE A 3 -2.343 -7.729 12.632 1.00 0.00 N ATOM 38 CA ILE A 3 -3.345 -7.136 11.766 1.00 0.00 C ATOM 39 C ILE A 3 -3.912 -8.185 10.813 1.00 0.00 C ATOM 40 O ILE A 3 -3.177 -9.026 10.297 1.00 0.00 O ATOM 41 CB ILE A 3 -2.775 -5.935 10.966 1.00 0.00 C ATOM 42 CG1 ILE A 3 -3.905 -5.171 10.270 1.00 0.00 C ATOM 43 CG2 ILE A 3 -1.733 -6.396 9.949 1.00 0.00 C ATOM 44 CD1 ILE A 3 -3.452 -3.885 9.616 1.00 0.00 C ATOM 0 H ILE A 3 -1.619 -8.256 12.144 1.00 0.00 H new ATOM 0 HA ILE A 3 -4.147 -6.760 12.401 1.00 0.00 H new ATOM 0 HB ILE A 3 -2.283 -5.264 11.670 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -4.356 -5.814 9.514 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -4.682 -4.944 11.000 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -1.351 -5.533 9.403 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -0.912 -6.890 10.468 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -2.192 -7.094 9.249 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -4.304 -3.397 9.143 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -3.028 -3.223 10.371 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -2.697 -4.107 8.862 1.00 0.00 H new ATOM 56 N ALA A 4 -5.225 -8.171 10.639 1.00 0.00 N ATOM 57 CA ALA A 4 -5.871 -9.053 9.684 1.00 0.00 C ATOM 58 C ALA A 4 -6.628 -8.247 8.642 1.00 0.00 C ATOM 59 O ALA A 4 -6.756 -7.027 8.777 1.00 0.00 O ATOM 60 CB ALA A 4 -6.800 -10.024 10.398 1.00 0.00 C ATOM 0 H ALA A 4 -5.862 -7.558 11.147 1.00 0.00 H new ATOM 0 HA ALA A 4 -5.102 -9.632 9.173 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -7.275 -10.677 9.666 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -6.226 -10.626 11.103 1.00 0.00 H new ATOM 0 HB3 ALA A 4 -7.565 -9.466 10.937 1.00 0.00 H new ATOM 66 N THR A 5 -7.141 -8.913 7.617 1.00 0.00 N ATOM 67 CA THR A 5 -7.861 -8.231 6.549 1.00 0.00 C ATOM 68 C THR A 5 -9.111 -7.541 7.094 1.00 0.00 C ATOM 69 O THR A 5 -9.561 -6.524 6.566 1.00 0.00 O ATOM 70 CB THR A 5 -8.263 -9.227 5.439 1.00 0.00 C ATOM 71 OG1 THR A 5 -7.121 -10.003 5.048 1.00 0.00 O ATOM 72 CG2 THR A 5 -8.822 -8.500 4.222 1.00 0.00 C ATOM 0 H THR A 5 -7.072 -9.924 7.502 1.00 0.00 H new ATOM 0 HA THR A 5 -7.196 -7.478 6.127 1.00 0.00 H new ATOM 0 HB THR A 5 -9.039 -9.881 5.836 1.00 0.00 H new ATOM 0 HG1 THR A 5 -7.380 -10.635 4.345 1.00 0.00 H new ATOM 0 HG21 THR A 5 -9.096 -9.227 3.458 1.00 0.00 H new ATOM 0 HG22 THR A 5 -9.704 -7.929 4.513 1.00 0.00 H new ATOM 0 HG23 THR A 5 -8.066 -7.823 3.824 1.00 0.00 H new ATOM 80 N ASP A 6 -9.617 -8.052 8.208 1.00 0.00 N ATOM 81 CA ASP A 6 -10.889 -7.604 8.749 1.00 0.00 C ATOM 82 C ASP A 6 -10.729 -6.329 9.563 1.00 0.00 C ATOM 83 O ASP A 6 -11.713 -5.764 10.045 1.00 0.00 O ATOM 84 CB ASP A 6 -11.503 -8.704 9.614 1.00 0.00 C ATOM 85 CG ASP A 6 -11.832 -9.947 8.814 1.00 0.00 C ATOM 86 OD1 ASP A 6 -12.935 -10.010 8.237 1.00 0.00 O ATOM 87 OD2 ASP A 6 -10.981 -10.863 8.745 1.00 0.00 O ATOM 0 H ASP A 6 -9.161 -8.782 8.756 1.00 0.00 H new ATOM 0 HA ASP A 6 -11.553 -7.386 7.913 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -10.810 -8.963 10.415 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -12.410 -8.328 10.086 1.00 0.00 H new ATOM 92 N ASP A 7 -9.489 -5.874 9.719 1.00 0.00 N ATOM 93 CA ASP A 7 -9.229 -4.612 10.404 1.00 0.00 C ATOM 94 C ASP A 7 -8.946 -3.503 9.396 1.00 0.00 C ATOM 95 O ASP A 7 -8.707 -2.356 9.770 1.00 0.00 O ATOM 96 CB ASP A 7 -8.021 -4.748 11.343 1.00 0.00 C ATOM 97 CG ASP A 7 -8.169 -5.864 12.360 1.00 0.00 C ATOM 98 OD1 ASP A 7 -8.854 -5.658 13.382 1.00 0.00 O ATOM 99 OD2 ASP A 7 -7.585 -6.951 12.150 1.00 0.00 O ATOM 0 H ASP A 7 -8.655 -6.356 9.383 1.00 0.00 H new ATOM 0 HA ASP A 7 -10.116 -4.359 10.984 1.00 0.00 H new ATOM 0 HB2 ASP A 7 -7.126 -4.926 10.747 1.00 0.00 H new ATOM 0 HB3 ASP A 7 -7.871 -3.805 11.869 1.00 0.00 H new ATOM 104 N LEU A 8 -8.982 -3.847 8.116 1.00 0.00 N ATOM 105 CA LEU A 8 -8.761 -2.868 7.056 1.00 0.00 C ATOM 106 C LEU A 8 -9.916 -2.860 6.068 1.00 0.00 C ATOM 107 O LEU A 8 -10.233 -1.824 5.473 1.00 0.00 O ATOM 108 CB LEU A 8 -7.453 -3.158 6.323 1.00 0.00 C ATOM 109 CG LEU A 8 -6.186 -2.921 7.140 1.00 0.00 C ATOM 110 CD1 LEU A 8 -4.955 -3.331 6.349 1.00 0.00 C ATOM 111 CD2 LEU A 8 -6.085 -1.461 7.552 1.00 0.00 C ATOM 0 H LEU A 8 -9.162 -4.795 7.785 1.00 0.00 H new ATOM 0 HA LEU A 8 -8.698 -1.884 7.521 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -7.463 -4.196 5.991 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -7.411 -2.537 5.428 1.00 0.00 H new ATOM 0 HG LEU A 8 -6.239 -3.534 8.040 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -4.062 -3.154 6.948 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -5.020 -4.390 6.098 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -4.899 -2.743 5.433 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -5.176 -1.309 8.134 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -6.055 -0.833 6.662 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -6.952 -1.193 8.156 1.00 0.00 H new ATOM 123 N GLU A 9 -10.566 -4.003 5.929 1.00 0.00 N ATOM 124 CA GLU A 9 -11.647 -4.154 4.976 1.00 0.00 C ATOM 125 C GLU A 9 -12.735 -5.044 5.550 1.00 0.00 C ATOM 126 O GLU A 9 -12.467 -5.964 6.324 1.00 0.00 O ATOM 127 CB GLU A 9 -11.149 -4.712 3.638 1.00 0.00 C ATOM 128 CG GLU A 9 -10.213 -3.759 2.916 1.00 0.00 C ATOM 129 CD GLU A 9 -9.942 -4.150 1.482 1.00 0.00 C ATOM 130 OE1 GLU A 9 -10.877 -4.091 0.659 1.00 0.00 O ATOM 131 OE2 GLU A 9 -8.775 -4.443 1.153 1.00 0.00 O ATOM 0 H GLU A 9 -10.360 -4.844 6.469 1.00 0.00 H new ATOM 0 HA GLU A 9 -12.062 -3.164 4.785 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -10.635 -5.657 3.812 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -12.005 -4.928 2.998 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -10.641 -2.757 2.936 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -9.267 -3.712 3.456 1.00 0.00 H new ATOM 138 N VAL A 10 -13.958 -4.749 5.169 1.00 0.00 N ATOM 139 CA VAL A 10 -15.118 -5.464 5.652 1.00 0.00 C ATOM 140 C VAL A 10 -15.954 -5.941 4.468 1.00 0.00 C ATOM 141 O VAL A 10 -16.088 -5.237 3.464 1.00 0.00 O ATOM 142 CB VAL A 10 -15.962 -4.564 6.589 1.00 0.00 C ATOM 143 CG1 VAL A 10 -16.319 -3.251 5.907 1.00 0.00 C ATOM 144 CG2 VAL A 10 -17.218 -5.283 7.053 1.00 0.00 C ATOM 0 H VAL A 10 -14.177 -4.001 4.511 1.00 0.00 H new ATOM 0 HA VAL A 10 -14.788 -6.330 6.226 1.00 0.00 H new ATOM 0 HB VAL A 10 -15.356 -4.339 7.467 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -16.911 -2.638 6.586 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -15.406 -2.719 5.641 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -16.896 -3.455 5.005 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -17.791 -4.628 7.709 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -17.825 -5.551 6.188 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -16.940 -6.187 7.595 1.00 0.00 H new ATOM 154 N ALA A 11 -16.479 -7.152 4.573 1.00 0.00 N ATOM 155 CA ALA A 11 -17.285 -7.732 3.513 1.00 0.00 C ATOM 156 C ALA A 11 -18.576 -6.954 3.317 1.00 0.00 C ATOM 157 O ALA A 11 -19.222 -6.538 4.281 1.00 0.00 O ATOM 158 CB ALA A 11 -17.569 -9.190 3.842 1.00 0.00 C ATOM 0 H ALA A 11 -16.360 -7.754 5.387 1.00 0.00 H new ATOM 0 HA ALA A 11 -16.733 -7.678 2.575 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -18.174 -9.631 3.050 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -16.628 -9.734 3.926 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -18.109 -9.251 4.787 1.00 0.00 H new ATOM 164 N CYS A 12 -18.925 -6.740 2.052 1.00 0.00 N ATOM 165 CA CYS A 12 -20.048 -5.903 1.670 1.00 0.00 C ATOM 166 C CYS A 12 -21.397 -6.360 2.222 1.00 0.00 C ATOM 167 O CYS A 12 -21.523 -7.457 2.758 1.00 0.00 O ATOM 168 CB CYS A 12 -20.133 -5.871 0.149 1.00 0.00 C ATOM 169 SG CYS A 12 -19.808 -4.254 -0.560 1.00 0.00 S ATOM 0 H CYS A 12 -18.429 -7.148 1.259 1.00 0.00 H new ATOM 0 HA CYS A 12 -19.858 -4.920 2.100 1.00 0.00 H new ATOM 0 HB2 CYS A 12 -19.421 -6.587 -0.261 1.00 0.00 H new ATOM 0 HB3 CYS A 12 -21.126 -6.199 -0.157 1.00 0.00 H new ATOM 0 HG CYS A 12 -19.388 -4.393 -1.782 1.00 0.00 H new ATOM 174 N PRO A 13 -22.431 -5.506 2.077 1.00 0.00 N ATOM 175 CA PRO A 13 -23.811 -5.856 2.429 1.00 0.00 C ATOM 176 C PRO A 13 -24.267 -7.208 1.869 1.00 0.00 C ATOM 177 O PRO A 13 -24.962 -7.966 2.546 1.00 0.00 O ATOM 178 CB PRO A 13 -24.610 -4.735 1.767 1.00 0.00 C ATOM 179 CG PRO A 13 -23.720 -3.549 1.817 1.00 0.00 C ATOM 180 CD PRO A 13 -22.324 -4.091 1.636 1.00 0.00 C ATOM 0 HA PRO A 13 -23.936 -5.950 3.508 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -24.871 -4.990 0.740 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -25.544 -4.550 2.297 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -23.970 -2.836 1.031 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -23.818 -3.024 2.767 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -21.999 -4.019 0.598 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -21.600 -3.539 2.236 1.00 0.00 H new ATOM 188 N LYS A 14 -23.838 -7.533 0.646 1.00 0.00 N ATOM 189 CA LYS A 14 -24.439 -8.668 -0.054 1.00 0.00 C ATOM 190 C LYS A 14 -23.602 -9.226 -1.217 1.00 0.00 C ATOM 191 O LYS A 14 -23.905 -10.317 -1.705 1.00 0.00 O ATOM 192 CB LYS A 14 -25.838 -8.311 -0.566 1.00 0.00 C ATOM 193 CG LYS A 14 -25.860 -7.144 -1.528 1.00 0.00 C ATOM 194 CD LYS A 14 -27.252 -6.933 -2.121 1.00 0.00 C ATOM 195 CE LYS A 14 -27.590 -7.948 -3.208 1.00 0.00 C ATOM 196 NZ LYS A 14 -28.219 -9.177 -2.655 1.00 0.00 N ATOM 0 H LYS A 14 -23.102 -7.045 0.135 1.00 0.00 H new ATOM 0 HA LYS A 14 -24.490 -9.459 0.695 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -26.267 -9.183 -1.059 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -26.478 -8.079 0.286 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -25.543 -6.239 -1.011 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -25.144 -7.320 -2.331 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -27.995 -6.998 -1.326 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -27.317 -5.927 -2.536 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -28.265 -7.491 -3.932 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -26.681 -8.218 -3.746 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -27.614 -9.998 -2.858 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -28.332 -9.076 -1.626 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -29.152 -9.317 -3.093 1.00 0.00 H new ATOM 210 N CYS A 15 -22.568 -8.509 -1.677 1.00 0.00 N ATOM 211 CA CYS A 15 -21.797 -8.996 -2.822 1.00 0.00 C ATOM 212 C CYS A 15 -20.351 -9.283 -2.481 1.00 0.00 C ATOM 213 O CYS A 15 -19.453 -9.033 -3.281 1.00 0.00 O ATOM 214 CB CYS A 15 -21.822 -7.927 -3.910 1.00 0.00 C ATOM 215 SG CYS A 15 -21.212 -6.304 -3.357 1.00 0.00 S ATOM 0 H CYS A 15 -22.255 -7.619 -1.288 1.00 0.00 H new ATOM 0 HA CYS A 15 -22.254 -9.930 -3.148 1.00 0.00 H new ATOM 0 HB2 CYS A 15 -21.218 -8.264 -4.752 1.00 0.00 H new ATOM 0 HB3 CYS A 15 -22.843 -7.816 -4.274 1.00 0.00 H new ATOM 0 HG CYS A 15 -21.680 -5.376 -4.137 1.00 0.00 H new ATOM 220 N GLU A 16 -20.131 -9.911 -1.352 1.00 0.00 N ATOM 221 CA GLU A 16 -18.787 -10.199 -0.896 1.00 0.00 C ATOM 222 C GLU A 16 -18.360 -11.565 -1.368 1.00 0.00 C ATOM 223 O GLU A 16 -17.555 -12.228 -0.719 1.00 0.00 O ATOM 224 CB GLU A 16 -18.710 -10.174 0.622 1.00 0.00 C ATOM 225 CG GLU A 16 -19.907 -9.542 1.295 1.00 0.00 C ATOM 226 CD GLU A 16 -21.062 -10.503 1.432 1.00 0.00 C ATOM 227 OE1 GLU A 16 -21.871 -10.585 0.494 1.00 0.00 O ATOM 228 OE2 GLU A 16 -21.164 -11.183 2.472 1.00 0.00 O ATOM 0 H GLU A 16 -20.868 -10.236 -0.726 1.00 0.00 H new ATOM 0 HA GLU A 16 -18.129 -9.433 -1.307 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -18.601 -11.196 0.986 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -17.812 -9.632 0.920 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -19.618 -9.182 2.282 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -20.227 -8.673 0.720 1.00 0.00 H new ATOM 235 N ARG A 17 -18.892 -11.989 -2.499 1.00 0.00 N ATOM 236 CA ARG A 17 -18.654 -13.325 -2.994 1.00 0.00 C ATOM 237 C ARG A 17 -18.682 -13.257 -4.515 1.00 0.00 C ATOM 238 O ARG A 17 -18.197 -14.156 -5.199 1.00 0.00 O ATOM 239 CB ARG A 17 -19.678 -14.354 -2.487 1.00 0.00 C ATOM 240 CG ARG A 17 -21.126 -14.068 -2.863 1.00 0.00 C ATOM 241 CD ARG A 17 -21.830 -13.257 -1.787 1.00 0.00 C ATOM 242 NE ARG A 17 -21.827 -13.949 -0.498 1.00 0.00 N ATOM 243 CZ ARG A 17 -22.682 -13.687 0.490 1.00 0.00 C ATOM 244 NH1 ARG A 17 -23.618 -12.758 0.338 1.00 0.00 N ATOM 245 NH2 ARG A 17 -22.594 -14.354 1.632 1.00 0.00 N ATOM 0 H ARG A 17 -19.495 -11.420 -3.093 1.00 0.00 H new ATOM 0 HA ARG A 17 -17.688 -13.667 -2.623 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -19.406 -15.335 -2.875 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -19.606 -14.410 -1.401 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -21.158 -13.526 -3.808 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -21.656 -15.008 -3.017 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -21.340 -12.289 -1.682 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -22.858 -13.062 -2.093 1.00 0.00 H new ATOM 0 HE ARG A 17 -21.128 -14.676 -0.346 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -23.685 -12.241 -0.538 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -24.270 -12.562 1.098 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -21.873 -15.066 1.753 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -23.247 -14.156 2.390 1.00 0.00 H new ATOM 259 N ALA A 18 -19.276 -12.171 -5.040 1.00 0.00 N ATOM 260 CA ALA A 18 -19.456 -12.043 -6.480 1.00 0.00 C ATOM 261 C ALA A 18 -19.029 -10.675 -7.002 1.00 0.00 C ATOM 262 O ALA A 18 -18.612 -10.547 -8.148 1.00 0.00 O ATOM 263 CB ALA A 18 -20.901 -12.319 -6.849 1.00 0.00 C ATOM 0 H ALA A 18 -19.631 -11.387 -4.493 1.00 0.00 H new ATOM 0 HA ALA A 18 -18.809 -12.781 -6.954 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -21.026 -12.221 -7.927 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -21.168 -13.331 -6.543 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -21.549 -11.604 -6.342 1.00 0.00 H new ATOM 269 N GLY A 19 -19.146 -9.654 -6.157 1.00 0.00 N ATOM 270 CA GLY A 19 -18.709 -8.322 -6.541 1.00 0.00 C ATOM 271 C GLY A 19 -19.713 -7.555 -7.403 1.00 0.00 C ATOM 272 O GLY A 19 -19.332 -6.631 -8.117 1.00 0.00 O ATOM 0 H GLY A 19 -19.534 -9.724 -5.216 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -18.506 -7.745 -5.639 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -17.768 -8.404 -7.085 1.00 0.00 H new ATOM 276 N GLU A 20 -20.999 -7.878 -7.273 1.00 0.00 N ATOM 277 CA GLU A 20 -22.044 -7.202 -8.055 1.00 0.00 C ATOM 278 C GLU A 20 -23.256 -6.913 -7.204 1.00 0.00 C ATOM 279 O GLU A 20 -23.476 -7.533 -6.167 1.00 0.00 O ATOM 280 CB GLU A 20 -22.534 -8.030 -9.239 1.00 0.00 C ATOM 281 CG GLU A 20 -22.953 -9.430 -8.832 1.00 0.00 C ATOM 282 CD GLU A 20 -23.760 -10.140 -9.893 1.00 0.00 C ATOM 283 OE1 GLU A 20 -24.992 -9.930 -9.945 1.00 0.00 O ATOM 284 OE2 GLU A 20 -23.179 -10.931 -10.658 1.00 0.00 O ATOM 0 H GLU A 20 -21.345 -8.598 -6.639 1.00 0.00 H new ATOM 0 HA GLU A 20 -21.577 -6.286 -8.416 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -23.377 -7.524 -9.709 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -21.743 -8.093 -9.987 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -22.063 -10.018 -8.607 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -23.539 -9.375 -7.915 1.00 0.00 H new ATOM 291 N ILE A 21 -24.045 -5.978 -7.669 1.00 0.00 N ATOM 292 CA ILE A 21 -25.342 -5.717 -7.112 1.00 0.00 C ATOM 293 C ILE A 21 -26.351 -5.746 -8.234 1.00 0.00 C ATOM 294 O ILE A 21 -26.352 -4.857 -9.082 1.00 0.00 O ATOM 295 CB ILE A 21 -25.412 -4.346 -6.414 1.00 0.00 C ATOM 296 CG1 ILE A 21 -24.412 -4.275 -5.262 1.00 0.00 C ATOM 297 CG2 ILE A 21 -26.826 -4.071 -5.919 1.00 0.00 C ATOM 298 CD1 ILE A 21 -24.665 -5.279 -4.159 1.00 0.00 C ATOM 0 H ILE A 21 -23.800 -5.372 -8.452 1.00 0.00 H new ATOM 0 HA ILE A 21 -25.552 -6.479 -6.362 1.00 0.00 H new ATOM 0 HB ILE A 21 -25.148 -3.577 -7.140 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -23.408 -4.431 -5.657 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -24.435 -3.272 -4.837 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -26.857 -3.098 -5.428 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -27.514 -4.073 -6.764 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -27.120 -4.845 -5.210 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -23.911 -5.162 -3.380 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -25.655 -5.111 -3.734 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -24.612 -6.288 -4.567 1.00 0.00 H new ATOM 310 N GLU A 22 -27.182 -6.777 -8.257 1.00 0.00 N ATOM 311 CA GLU A 22 -28.248 -6.859 -9.242 1.00 0.00 C ATOM 312 C GLU A 22 -27.690 -6.905 -10.664 1.00 0.00 C ATOM 313 O GLU A 22 -28.140 -6.167 -11.545 1.00 0.00 O ATOM 314 CB GLU A 22 -29.126 -5.628 -9.060 1.00 0.00 C ATOM 315 CG GLU A 22 -30.451 -5.658 -9.794 1.00 0.00 C ATOM 316 CD GLU A 22 -31.332 -4.484 -9.431 1.00 0.00 C ATOM 317 OE1 GLU A 22 -31.121 -3.387 -9.989 1.00 0.00 O ATOM 318 OE2 GLU A 22 -32.233 -4.646 -8.582 1.00 0.00 O ATOM 0 H GLU A 22 -27.139 -7.564 -7.609 1.00 0.00 H new ATOM 0 HA GLU A 22 -28.821 -7.775 -9.096 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -29.323 -5.498 -7.996 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -28.567 -4.752 -9.390 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -30.269 -5.655 -10.869 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -30.972 -6.587 -9.562 1.00 0.00 H new ATOM 325 N GLY A 23 -26.686 -7.742 -10.894 1.00 0.00 N ATOM 326 CA GLY A 23 -26.080 -7.804 -12.208 1.00 0.00 C ATOM 327 C GLY A 23 -25.294 -6.561 -12.540 1.00 0.00 C ATOM 328 O GLY A 23 -24.682 -6.456 -13.604 1.00 0.00 O ATOM 0 H GLY A 23 -26.284 -8.373 -10.201 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -25.422 -8.671 -12.261 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -26.858 -7.949 -12.957 1.00 0.00 H new ATOM 332 N THR A 24 -25.308 -5.628 -11.620 1.00 0.00 N ATOM 333 CA THR A 24 -24.816 -4.298 -11.867 1.00 0.00 C ATOM 334 C THR A 24 -23.632 -3.947 -10.945 1.00 0.00 C ATOM 335 O THR A 24 -23.553 -4.437 -9.816 1.00 0.00 O ATOM 336 CB THR A 24 -26.029 -3.396 -11.641 1.00 0.00 C ATOM 337 OG1 THR A 24 -26.861 -3.410 -12.806 1.00 0.00 O ATOM 338 CG2 THR A 24 -25.678 -1.972 -11.258 1.00 0.00 C ATOM 0 H THR A 24 -25.663 -5.772 -10.675 1.00 0.00 H new ATOM 0 HA THR A 24 -24.413 -4.182 -12.873 1.00 0.00 H new ATOM 0 HB THR A 24 -26.565 -3.806 -10.785 1.00 0.00 H new ATOM 0 HG1 THR A 24 -27.639 -2.833 -12.659 1.00 0.00 H new ATOM 0 HG21 THR A 24 -26.593 -1.397 -11.116 1.00 0.00 H new ATOM 0 HG22 THR A 24 -25.104 -1.975 -10.331 1.00 0.00 H new ATOM 0 HG23 THR A 24 -25.084 -1.518 -12.051 1.00 0.00 H new ATOM 346 N PRO A 25 -22.673 -3.122 -11.435 1.00 0.00 N ATOM 347 CA PRO A 25 -21.476 -2.727 -10.669 1.00 0.00 C ATOM 348 C PRO A 25 -21.832 -2.101 -9.321 1.00 0.00 C ATOM 349 O PRO A 25 -22.596 -1.138 -9.241 1.00 0.00 O ATOM 350 CB PRO A 25 -20.769 -1.710 -11.579 1.00 0.00 C ATOM 351 CG PRO A 25 -21.816 -1.282 -12.548 1.00 0.00 C ATOM 352 CD PRO A 25 -22.677 -2.493 -12.765 1.00 0.00 C ATOM 0 HA PRO A 25 -20.851 -3.586 -10.424 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -20.388 -0.864 -11.007 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -19.917 -2.159 -12.089 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -22.400 -0.450 -12.154 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -21.371 -0.944 -13.484 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -23.684 -2.224 -13.085 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -22.266 -3.153 -13.528 1.00 0.00 H new ATOM 360 N CYS A 26 -21.262 -2.670 -8.270 1.00 0.00 N ATOM 361 CA CYS A 26 -21.605 -2.332 -6.905 1.00 0.00 C ATOM 362 C CYS A 26 -21.056 -0.970 -6.440 1.00 0.00 C ATOM 363 O CYS A 26 -19.905 -0.630 -6.713 1.00 0.00 O ATOM 364 CB CYS A 26 -21.094 -3.454 -6.017 1.00 0.00 C ATOM 365 SG CYS A 26 -21.469 -3.236 -4.262 1.00 0.00 S ATOM 0 H CYS A 26 -20.541 -3.387 -8.346 1.00 0.00 H new ATOM 0 HA CYS A 26 -22.688 -2.230 -6.839 1.00 0.00 H new ATOM 0 HB2 CYS A 26 -21.526 -4.396 -6.355 1.00 0.00 H new ATOM 0 HB3 CYS A 26 -20.014 -3.536 -6.139 1.00 0.00 H new ATOM 0 HG CYS A 26 -20.834 -4.133 -3.568 1.00 0.00 H new ATOM 370 N PRO A 27 -21.909 -0.205 -5.707 1.00 0.00 N ATOM 371 CA PRO A 27 -21.630 1.137 -5.161 1.00 0.00 C ATOM 372 C PRO A 27 -20.170 1.433 -4.807 1.00 0.00 C ATOM 373 O PRO A 27 -19.587 2.406 -5.288 1.00 0.00 O ATOM 374 CB PRO A 27 -22.454 1.116 -3.876 1.00 0.00 C ATOM 375 CG PRO A 27 -23.651 0.275 -4.177 1.00 0.00 C ATOM 376 CD PRO A 27 -23.293 -0.594 -5.372 1.00 0.00 C ATOM 0 HA PRO A 27 -21.866 1.904 -5.899 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -21.880 0.698 -3.049 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -22.747 2.124 -3.583 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -23.916 -0.341 -3.318 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -24.516 0.900 -4.400 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -23.360 -1.654 -5.127 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -23.969 -0.417 -6.209 1.00 0.00 H new ATOM 384 N ALA A 28 -19.585 0.573 -3.985 1.00 0.00 N ATOM 385 CA ALA A 28 -18.301 0.874 -3.359 1.00 0.00 C ATOM 386 C ALA A 28 -17.265 -0.211 -3.643 1.00 0.00 C ATOM 387 O ALA A 28 -16.082 -0.044 -3.353 1.00 0.00 O ATOM 388 CB ALA A 28 -18.480 1.067 -1.859 1.00 0.00 C ATOM 0 H ALA A 28 -19.975 -0.336 -3.735 1.00 0.00 H new ATOM 0 HA ALA A 28 -17.927 1.801 -3.793 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -17.515 1.291 -1.403 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -19.167 1.893 -1.678 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -18.885 0.155 -1.421 1.00 0.00 H new ATOM 394 N CYS A 29 -17.705 -1.322 -4.216 1.00 0.00 N ATOM 395 CA CYS A 29 -16.796 -2.411 -4.542 1.00 0.00 C ATOM 396 C CYS A 29 -17.032 -2.881 -5.969 1.00 0.00 C ATOM 397 O CYS A 29 -17.958 -3.650 -6.235 1.00 0.00 O ATOM 398 CB CYS A 29 -16.951 -3.584 -3.565 1.00 0.00 C ATOM 399 SG CYS A 29 -18.622 -4.313 -3.521 1.00 0.00 S ATOM 0 H CYS A 29 -18.680 -1.493 -4.463 1.00 0.00 H new ATOM 0 HA CYS A 29 -15.777 -2.035 -4.452 1.00 0.00 H new ATOM 0 HB2 CYS A 29 -16.236 -4.361 -3.834 1.00 0.00 H new ATOM 0 HB3 CYS A 29 -16.690 -3.243 -2.563 1.00 0.00 H new ATOM 0 HG CYS A 29 -19.497 -3.413 -3.858 1.00 0.00 H new ATOM 404 N SER A 30 -16.199 -2.408 -6.882 1.00 0.00 N ATOM 405 CA SER A 30 -16.344 -2.718 -8.296 1.00 0.00 C ATOM 406 C SER A 30 -15.834 -4.124 -8.635 1.00 0.00 C ATOM 407 O SER A 30 -14.923 -4.281 -9.445 1.00 0.00 O ATOM 408 CB SER A 30 -15.595 -1.669 -9.120 1.00 0.00 C ATOM 409 OG SER A 30 -15.984 -0.357 -8.746 1.00 0.00 O ATOM 0 H SER A 30 -15.408 -1.802 -6.666 1.00 0.00 H new ATOM 0 HA SER A 30 -17.406 -2.697 -8.541 1.00 0.00 H new ATOM 0 HB2 SER A 30 -14.521 -1.788 -8.978 1.00 0.00 H new ATOM 0 HB3 SER A 30 -15.795 -1.823 -10.180 1.00 0.00 H new ATOM 0 HG SER A 30 -15.491 0.296 -9.285 1.00 0.00 H new ATOM 415 N GLY A 31 -16.407 -5.143 -7.996 1.00 0.00 N ATOM 416 CA GLY A 31 -16.081 -6.512 -8.351 1.00 0.00 C ATOM 417 C GLY A 31 -14.932 -7.034 -7.530 1.00 0.00 C ATOM 418 O GLY A 31 -14.011 -7.659 -8.050 1.00 0.00 O ATOM 0 H GLY A 31 -17.088 -5.044 -7.243 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -16.955 -7.146 -8.201 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -15.827 -6.564 -9.410 1.00 0.00 H new ATOM 422 N LYS A 32 -14.995 -6.783 -6.232 1.00 0.00 N ATOM 423 CA LYS A 32 -13.885 -7.056 -5.338 1.00 0.00 C ATOM 424 C LYS A 32 -14.353 -7.981 -4.226 1.00 0.00 C ATOM 425 O LYS A 32 -13.632 -8.877 -3.798 1.00 0.00 O ATOM 426 CB LYS A 32 -13.404 -5.736 -4.744 1.00 0.00 C ATOM 427 CG LYS A 32 -13.386 -4.613 -5.766 1.00 0.00 C ATOM 428 CD LYS A 32 -13.414 -3.250 -5.110 1.00 0.00 C ATOM 429 CE LYS A 32 -12.128 -2.966 -4.371 1.00 0.00 C ATOM 430 NZ LYS A 32 -10.956 -2.986 -5.294 1.00 0.00 N ATOM 0 H LYS A 32 -15.814 -6.386 -5.772 1.00 0.00 H new ATOM 0 HA LYS A 32 -13.070 -7.535 -5.881 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -14.052 -5.457 -3.913 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -12.402 -5.868 -4.336 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -12.492 -4.700 -6.384 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -14.244 -4.713 -6.430 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -13.577 -2.483 -5.868 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -14.253 -3.196 -4.417 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -12.193 -1.993 -3.884 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -11.987 -3.707 -3.585 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -10.125 -2.593 -4.808 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -10.757 -3.965 -5.582 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -11.168 -2.414 -6.136 1.00 0.00 H new ATOM 444 N GLY A 33 -15.572 -7.727 -3.745 1.00 0.00 N ATOM 445 CA GLY A 33 -16.158 -8.533 -2.719 1.00 0.00 C ATOM 446 C GLY A 33 -16.268 -7.753 -1.433 1.00 0.00 C ATOM 447 O GLY A 33 -17.293 -7.795 -0.758 1.00 0.00 O ATOM 0 H GLY A 33 -16.162 -6.959 -4.065 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -17.146 -8.870 -3.033 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -15.553 -9.425 -2.559 1.00 0.00 H new ATOM 451 N VAL A 34 -15.250 -6.967 -1.125 1.00 0.00 N ATOM 452 CA VAL A 34 -15.219 -6.251 0.145 1.00 0.00 C ATOM 453 C VAL A 34 -15.071 -4.744 -0.050 1.00 0.00 C ATOM 454 O VAL A 34 -14.806 -4.267 -1.158 1.00 0.00 O ATOM 455 CB VAL A 34 -14.052 -6.751 1.030 1.00 0.00 C ATOM 456 CG1 VAL A 34 -14.211 -8.222 1.382 1.00 0.00 C ATOM 457 CG2 VAL A 34 -12.721 -6.523 0.335 1.00 0.00 C ATOM 0 H VAL A 34 -14.442 -6.808 -1.727 1.00 0.00 H new ATOM 0 HA VAL A 34 -16.172 -6.450 0.635 1.00 0.00 H new ATOM 0 HB VAL A 34 -14.073 -6.177 1.957 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -13.374 -8.540 2.004 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -15.144 -8.367 1.927 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -14.229 -8.815 0.468 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -11.912 -6.881 0.972 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -12.706 -7.066 -0.610 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -12.588 -5.458 0.143 1.00 0.00 H new ATOM 467 N ILE A 35 -15.287 -4.013 1.037 1.00 0.00 N ATOM 468 CA ILE A 35 -15.085 -2.569 1.073 1.00 0.00 C ATOM 469 C ILE A 35 -14.243 -2.180 2.288 1.00 0.00 C ATOM 470 O ILE A 35 -14.091 -2.959 3.224 1.00 0.00 O ATOM 471 CB ILE A 35 -16.427 -1.809 1.119 1.00 0.00 C ATOM 472 CG1 ILE A 35 -17.334 -2.399 2.201 1.00 0.00 C ATOM 473 CG2 ILE A 35 -17.110 -1.850 -0.239 1.00 0.00 C ATOM 474 CD1 ILE A 35 -18.650 -1.673 2.365 1.00 0.00 C ATOM 0 H ILE A 35 -15.608 -4.406 1.922 1.00 0.00 H new ATOM 0 HA ILE A 35 -14.562 -2.291 0.158 1.00 0.00 H new ATOM 0 HB ILE A 35 -16.229 -0.766 1.368 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -17.535 -3.443 1.962 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -16.803 -2.386 3.153 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -18.055 -1.309 -0.188 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -16.465 -1.384 -0.985 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -17.300 -2.886 -0.520 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -19.235 -2.152 3.150 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -18.461 -0.634 2.636 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -19.204 -1.708 1.427 1.00 0.00 H new ATOM 486 N LEU A 36 -13.710 -0.968 2.272 1.00 0.00 N ATOM 487 CA LEU A 36 -12.754 -0.537 3.290 1.00 0.00 C ATOM 488 C LEU A 36 -13.418 0.068 4.517 1.00 0.00 C ATOM 489 O LEU A 36 -14.563 0.521 4.473 1.00 0.00 O ATOM 490 CB LEU A 36 -11.790 0.499 2.709 1.00 0.00 C ATOM 491 CG LEU A 36 -11.077 0.078 1.430 1.00 0.00 C ATOM 492 CD1 LEU A 36 -11.810 0.603 0.203 1.00 0.00 C ATOM 493 CD2 LEU A 36 -9.642 0.554 1.457 1.00 0.00 C ATOM 0 H LEU A 36 -13.921 -0.262 1.566 1.00 0.00 H new ATOM 0 HA LEU A 36 -12.223 -1.437 3.601 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -12.344 1.417 2.512 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -11.039 0.736 3.463 1.00 0.00 H new ATOM 0 HG LEU A 36 -11.077 -1.010 1.370 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -11.282 0.290 -0.698 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -12.824 0.204 0.187 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -11.849 1.692 0.241 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -9.140 0.249 0.539 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -9.621 1.641 1.538 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -9.129 0.116 2.314 1.00 0.00 H new ATOM 505 N THR A 37 -12.660 0.070 5.608 1.00 0.00 N ATOM 506 CA THR A 37 -13.016 0.801 6.812 1.00 0.00 C ATOM 507 C THR A 37 -12.100 2.020 6.914 1.00 0.00 C ATOM 508 O THR A 37 -11.209 2.175 6.084 1.00 0.00 O ATOM 509 CB THR A 37 -12.878 -0.079 8.082 1.00 0.00 C ATOM 510 OG1 THR A 37 -13.289 0.653 9.245 1.00 0.00 O ATOM 511 CG2 THR A 37 -11.446 -0.562 8.268 1.00 0.00 C ATOM 0 H THR A 37 -11.779 -0.438 5.679 1.00 0.00 H new ATOM 0 HA THR A 37 -14.060 1.106 6.749 1.00 0.00 H new ATOM 0 HB THR A 37 -13.523 -0.948 7.951 1.00 0.00 H new ATOM 0 HG1 THR A 37 -13.198 0.085 10.038 1.00 0.00 H new ATOM 0 HG21 THR A 37 -11.383 -1.176 9.166 1.00 0.00 H new ATOM 0 HG22 THR A 37 -11.146 -1.153 7.403 1.00 0.00 H new ATOM 0 HG23 THR A 37 -10.782 0.297 8.368 1.00 0.00 H new ATOM 519 N ALA A 38 -12.303 2.866 7.918 1.00 0.00 N ATOM 520 CA ALA A 38 -11.559 4.124 8.039 1.00 0.00 C ATOM 521 C ALA A 38 -10.050 3.914 7.986 1.00 0.00 C ATOM 522 O ALA A 38 -9.350 4.639 7.277 1.00 0.00 O ATOM 523 CB ALA A 38 -11.946 4.846 9.315 1.00 0.00 C ATOM 0 H ALA A 38 -12.979 2.706 8.665 1.00 0.00 H new ATOM 0 HA ALA A 38 -11.828 4.740 7.181 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -11.385 5.778 9.390 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -13.014 5.065 9.300 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -11.718 4.215 10.174 1.00 0.00 H new ATOM 529 N GLN A 39 -9.547 2.938 8.733 1.00 0.00 N ATOM 530 CA GLN A 39 -8.125 2.620 8.694 1.00 0.00 C ATOM 531 C GLN A 39 -7.694 2.270 7.274 1.00 0.00 C ATOM 532 O GLN A 39 -6.662 2.736 6.792 1.00 0.00 O ATOM 533 CB GLN A 39 -7.800 1.459 9.630 1.00 0.00 C ATOM 534 CG GLN A 39 -6.310 1.305 9.878 1.00 0.00 C ATOM 535 CD GLN A 39 -5.981 0.199 10.854 1.00 0.00 C ATOM 536 OE1 GLN A 39 -6.760 -0.106 11.756 1.00 0.00 O ATOM 537 NE2 GLN A 39 -4.818 -0.404 10.679 1.00 0.00 N ATOM 0 H GLN A 39 -10.097 2.358 9.367 1.00 0.00 H new ATOM 0 HA GLN A 39 -7.577 3.502 9.027 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -8.309 1.612 10.582 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -8.191 0.535 9.205 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -5.809 1.106 8.931 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -5.912 2.246 10.257 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -4.204 -0.117 9.917 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -4.534 -1.156 11.306 1.00 0.00 H new ATOM 546 N GLY A 40 -8.508 1.462 6.602 1.00 0.00 N ATOM 547 CA GLY A 40 -8.219 1.081 5.237 1.00 0.00 C ATOM 548 C GLY A 40 -8.350 2.251 4.286 1.00 0.00 C ATOM 549 O GLY A 40 -7.656 2.323 3.278 1.00 0.00 O ATOM 0 H GLY A 40 -9.366 1.064 6.983 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -7.208 0.677 5.179 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -8.898 0.286 4.930 1.00 0.00 H new ATOM 553 N TYR A 41 -9.225 3.184 4.623 1.00 0.00 N ATOM 554 CA TYR A 41 -9.404 4.383 3.820 1.00 0.00 C ATOM 555 C TYR A 41 -8.184 5.287 3.902 1.00 0.00 C ATOM 556 O TYR A 41 -7.826 5.945 2.924 1.00 0.00 O ATOM 557 CB TYR A 41 -10.647 5.144 4.296 1.00 0.00 C ATOM 558 CG TYR A 41 -11.936 4.708 3.632 1.00 0.00 C ATOM 559 CD1 TYR A 41 -12.185 4.998 2.297 1.00 0.00 C ATOM 560 CD2 TYR A 41 -12.906 4.016 4.343 1.00 0.00 C ATOM 561 CE1 TYR A 41 -13.363 4.610 1.690 1.00 0.00 C ATOM 562 CE2 TYR A 41 -14.085 3.624 3.743 1.00 0.00 C ATOM 563 CZ TYR A 41 -14.310 3.923 2.418 1.00 0.00 C ATOM 564 OH TYR A 41 -15.487 3.532 1.819 1.00 0.00 O ATOM 0 H TYR A 41 -9.823 3.134 5.448 1.00 0.00 H new ATOM 0 HA TYR A 41 -9.534 4.081 2.781 1.00 0.00 H new ATOM 0 HB2 TYR A 41 -10.746 5.017 5.374 1.00 0.00 H new ATOM 0 HB3 TYR A 41 -10.499 6.208 4.113 1.00 0.00 H new ATOM 0 HD1 TYR A 41 -11.445 5.536 1.724 1.00 0.00 H new ATOM 0 HD2 TYR A 41 -12.735 3.780 5.383 1.00 0.00 H new ATOM 0 HE1 TYR A 41 -13.541 4.844 0.651 1.00 0.00 H new ATOM 0 HE2 TYR A 41 -14.829 3.085 4.311 1.00 0.00 H new ATOM 0 HH TYR A 41 -16.044 3.058 2.471 1.00 0.00 H new ATOM 574 N THR A 42 -7.525 5.298 5.047 1.00 0.00 N ATOM 575 CA THR A 42 -6.287 6.047 5.200 1.00 0.00 C ATOM 576 C THR A 42 -5.154 5.367 4.438 1.00 0.00 C ATOM 577 O THR A 42 -4.279 6.023 3.867 1.00 0.00 O ATOM 578 CB THR A 42 -5.900 6.144 6.683 1.00 0.00 C ATOM 579 OG1 THR A 42 -7.038 6.552 7.445 1.00 0.00 O ATOM 580 CG2 THR A 42 -4.763 7.132 6.888 1.00 0.00 C ATOM 0 H THR A 42 -7.824 4.798 5.884 1.00 0.00 H new ATOM 0 HA THR A 42 -6.447 7.047 4.798 1.00 0.00 H new ATOM 0 HB THR A 42 -5.562 5.163 7.018 1.00 0.00 H new ATOM 0 HG1 THR A 42 -6.763 6.747 8.365 1.00 0.00 H new ATOM 0 HG21 THR A 42 -4.510 7.181 7.947 1.00 0.00 H new ATOM 0 HG22 THR A 42 -3.891 6.806 6.321 1.00 0.00 H new ATOM 0 HG23 THR A 42 -5.072 8.119 6.543 1.00 0.00 H new ATOM 588 N LEU A 43 -5.210 4.046 4.391 1.00 0.00 N ATOM 589 CA LEU A 43 -4.142 3.258 3.807 1.00 0.00 C ATOM 590 C LEU A 43 -4.339 3.110 2.304 1.00 0.00 C ATOM 591 O LEU A 43 -3.398 2.788 1.588 1.00 0.00 O ATOM 592 CB LEU A 43 -4.072 1.874 4.474 1.00 0.00 C ATOM 593 CG LEU A 43 -3.037 1.711 5.607 1.00 0.00 C ATOM 594 CD1 LEU A 43 -3.173 2.822 6.637 1.00 0.00 C ATOM 595 CD2 LEU A 43 -3.210 0.357 6.275 1.00 0.00 C ATOM 0 H LEU A 43 -5.989 3.496 4.753 1.00 0.00 H new ATOM 0 HA LEU A 43 -3.200 3.779 3.980 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -5.058 1.637 4.875 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -3.855 1.134 3.704 1.00 0.00 H new ATOM 0 HG LEU A 43 -2.040 1.774 5.171 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -2.431 2.682 7.423 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -3.013 3.786 6.155 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -4.172 2.795 7.072 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -2.476 0.249 7.074 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -4.214 0.283 6.692 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -3.064 -0.433 5.539 1.00 0.00 H new ATOM 607 N LEU A 44 -5.548 3.371 1.812 1.00 0.00 N ATOM 608 CA LEU A 44 -5.810 3.250 0.385 1.00 0.00 C ATOM 609 C LEU A 44 -5.336 4.499 -0.346 1.00 0.00 C ATOM 610 O LEU A 44 -4.672 4.405 -1.371 1.00 0.00 O ATOM 611 CB LEU A 44 -7.308 2.961 0.111 1.00 0.00 C ATOM 612 CG LEU A 44 -8.255 4.165 -0.084 1.00 0.00 C ATOM 613 CD1 LEU A 44 -8.143 4.756 -1.488 1.00 0.00 C ATOM 614 CD2 LEU A 44 -9.694 3.751 0.160 1.00 0.00 C ATOM 0 H LEU A 44 -6.349 3.663 2.372 1.00 0.00 H new ATOM 0 HA LEU A 44 -5.246 2.400 0.001 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -7.370 2.339 -0.782 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -7.690 2.366 0.941 1.00 0.00 H new ATOM 0 HG LEU A 44 -7.956 4.925 0.638 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -8.826 5.600 -1.583 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -7.121 5.094 -1.660 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -8.402 3.995 -2.225 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -10.349 4.611 0.019 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -9.971 2.965 -0.543 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -9.798 3.380 1.179 1.00 0.00 H new ATOM 626 N ASP A 45 -5.653 5.670 0.196 1.00 0.00 N ATOM 627 CA ASP A 45 -5.338 6.922 -0.482 1.00 0.00 C ATOM 628 C ASP A 45 -3.845 7.203 -0.417 1.00 0.00 C ATOM 629 O ASP A 45 -3.298 7.944 -1.237 1.00 0.00 O ATOM 630 CB ASP A 45 -6.130 8.077 0.129 1.00 0.00 C ATOM 631 CG ASP A 45 -6.163 9.286 -0.781 1.00 0.00 C ATOM 632 OD1 ASP A 45 -6.963 9.285 -1.743 1.00 0.00 O ATOM 633 OD2 ASP A 45 -5.400 10.240 -0.545 1.00 0.00 O ATOM 0 H ASP A 45 -6.123 5.778 1.094 1.00 0.00 H new ATOM 0 HA ASP A 45 -5.624 6.827 -1.530 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -7.149 7.749 0.334 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -5.686 8.355 1.085 1.00 0.00 H new ATOM 638 N PHE A 46 -3.181 6.571 0.536 1.00 0.00 N ATOM 639 CA PHE A 46 -1.732 6.622 0.625 1.00 0.00 C ATOM 640 C PHE A 46 -1.113 5.757 -0.448 1.00 0.00 C ATOM 641 O PHE A 46 -0.187 6.179 -1.140 1.00 0.00 O ATOM 642 CB PHE A 46 -1.316 6.096 1.999 1.00 0.00 C ATOM 643 CG PHE A 46 0.161 6.063 2.251 1.00 0.00 C ATOM 644 CD1 PHE A 46 0.802 7.154 2.807 1.00 0.00 C ATOM 645 CD2 PHE A 46 0.905 4.936 1.942 1.00 0.00 C ATOM 646 CE1 PHE A 46 2.157 7.123 3.053 1.00 0.00 C ATOM 647 CE2 PHE A 46 2.261 4.899 2.188 1.00 0.00 C ATOM 648 CZ PHE A 46 2.888 5.996 2.741 1.00 0.00 C ATOM 0 H PHE A 46 -3.627 6.013 1.264 1.00 0.00 H new ATOM 0 HA PHE A 46 -1.392 7.648 0.488 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -1.785 6.715 2.764 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -1.711 5.087 2.119 1.00 0.00 H new ATOM 0 HD1 PHE A 46 0.235 8.040 3.051 1.00 0.00 H new ATOM 0 HD2 PHE A 46 0.418 4.078 1.504 1.00 0.00 H new ATOM 0 HE1 PHE A 46 2.647 7.981 3.490 1.00 0.00 H new ATOM 0 HE2 PHE A 46 2.831 4.013 1.948 1.00 0.00 H new ATOM 0 HZ PHE A 46 3.951 5.972 2.930 1.00 0.00 H new ATOM 658 N ILE A 47 -1.648 4.571 -0.636 1.00 0.00 N ATOM 659 CA ILE A 47 -1.051 3.668 -1.585 1.00 0.00 C ATOM 660 C ILE A 47 -1.440 4.063 -3.006 1.00 0.00 C ATOM 661 O ILE A 47 -0.679 3.844 -3.947 1.00 0.00 O ATOM 662 CB ILE A 47 -1.383 2.189 -1.270 1.00 0.00 C ATOM 663 CG1 ILE A 47 -2.894 1.908 -1.296 1.00 0.00 C ATOM 664 CG2 ILE A 47 -0.810 1.838 0.092 1.00 0.00 C ATOM 665 CD1 ILE A 47 -3.410 1.437 -2.634 1.00 0.00 C ATOM 0 H ILE A 47 -2.476 4.218 -0.156 1.00 0.00 H new ATOM 0 HA ILE A 47 0.032 3.753 -1.501 1.00 0.00 H new ATOM 0 HB ILE A 47 -0.934 1.568 -2.046 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -3.126 1.154 -0.543 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -3.427 2.816 -1.012 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -1.038 0.798 0.325 1.00 0.00 H new ATOM 0 HG22 ILE A 47 0.271 1.979 0.079 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -1.251 2.485 0.850 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -4.484 1.261 -2.568 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -3.212 2.198 -3.389 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -2.907 0.511 -2.913 1.00 0.00 H new ATOM 677 N GLN A 48 -2.601 4.706 -3.133 1.00 0.00 N ATOM 678 CA GLN A 48 -2.974 5.397 -4.358 1.00 0.00 C ATOM 679 C GLN A 48 -1.858 6.343 -4.752 1.00 0.00 C ATOM 680 O GLN A 48 -1.207 6.166 -5.765 1.00 0.00 O ATOM 681 CB GLN A 48 -4.247 6.224 -4.151 1.00 0.00 C ATOM 682 CG GLN A 48 -5.539 5.423 -4.072 1.00 0.00 C ATOM 683 CD GLN A 48 -6.119 5.121 -5.440 1.00 0.00 C ATOM 684 OE1 GLN A 48 -5.912 5.874 -6.389 1.00 0.00 O ATOM 685 NE2 GLN A 48 -6.860 4.031 -5.548 1.00 0.00 N ATOM 0 H GLN A 48 -3.301 4.760 -2.393 1.00 0.00 H new ATOM 0 HA GLN A 48 -3.149 4.651 -5.134 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -4.140 6.801 -3.232 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -4.332 6.940 -4.969 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -5.351 4.487 -3.546 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -6.271 5.977 -3.485 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -7.008 3.432 -4.736 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -7.284 3.789 -6.444 1.00 0.00 H new ATOM 694 N LYS A 49 -1.577 7.269 -3.855 1.00 0.00 N ATOM 695 CA LYS A 49 -0.758 8.434 -4.143 1.00 0.00 C ATOM 696 C LYS A 49 0.737 8.112 -4.131 1.00 0.00 C ATOM 697 O LYS A 49 1.564 9.000 -4.287 1.00 0.00 O ATOM 698 CB LYS A 49 -1.125 9.546 -3.138 1.00 0.00 C ATOM 699 CG LYS A 49 -0.430 10.883 -3.354 1.00 0.00 C ATOM 700 CD LYS A 49 -0.456 11.741 -2.092 1.00 0.00 C ATOM 701 CE LYS A 49 -1.874 11.982 -1.579 1.00 0.00 C ATOM 702 NZ LYS A 49 -2.654 12.891 -2.464 1.00 0.00 N ATOM 0 H LYS A 49 -1.915 7.234 -2.893 1.00 0.00 H new ATOM 0 HA LYS A 49 -0.966 8.779 -5.156 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -2.202 9.706 -3.178 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -0.892 9.194 -2.133 1.00 0.00 H new ATOM 0 HG2 LYS A 49 0.603 10.712 -3.657 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -0.916 11.419 -4.169 1.00 0.00 H new ATOM 0 HD2 LYS A 49 0.131 11.254 -1.313 1.00 0.00 H new ATOM 0 HD3 LYS A 49 0.020 12.699 -2.298 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -2.394 11.028 -1.495 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -1.827 12.408 -0.577 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -3.608 13.022 -2.072 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -2.175 13.812 -2.524 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -2.724 12.474 -3.414 1.00 0.00 H new ATOM 716 N HIS A 50 1.123 6.860 -3.912 1.00 0.00 N ATOM 717 CA HIS A 50 2.534 6.571 -4.151 1.00 0.00 C ATOM 718 C HIS A 50 2.806 5.587 -5.288 1.00 0.00 C ATOM 719 O HIS A 50 3.968 5.378 -5.625 1.00 0.00 O ATOM 720 CB HIS A 50 3.169 6.103 -2.841 1.00 0.00 C ATOM 721 CG HIS A 50 3.051 7.157 -1.785 1.00 0.00 C ATOM 722 ND1 HIS A 50 3.500 8.442 -1.973 1.00 0.00 N ATOM 723 CD2 HIS A 50 2.422 7.154 -0.593 1.00 0.00 C ATOM 724 CE1 HIS A 50 3.146 9.183 -0.945 1.00 0.00 C ATOM 725 NE2 HIS A 50 2.486 8.427 -0.091 1.00 0.00 N ATOM 0 H HIS A 50 0.538 6.086 -3.596 1.00 0.00 H new ATOM 0 HA HIS A 50 2.994 7.498 -4.492 1.00 0.00 H new ATOM 0 HB2 HIS A 50 2.683 5.188 -2.503 1.00 0.00 H new ATOM 0 HB3 HIS A 50 4.220 5.864 -3.006 1.00 0.00 H new ATOM 0 HD1 HIS A 50 4.026 8.770 -2.783 1.00 0.00 H new ATOM 0 HD2 HIS A 50 1.953 6.304 -0.120 1.00 0.00 H new ATOM 0 HE1 HIS A 50 3.360 10.234 -0.822 1.00 0.00 H new ATOM 734 N LEU A 51 1.774 5.017 -5.913 1.00 0.00 N ATOM 735 CA LEU A 51 1.993 4.249 -7.154 1.00 0.00 C ATOM 736 C LEU A 51 1.096 4.737 -8.287 1.00 0.00 C ATOM 737 O LEU A 51 1.513 4.786 -9.444 1.00 0.00 O ATOM 738 CB LEU A 51 1.764 2.743 -6.967 1.00 0.00 C ATOM 739 CG LEU A 51 2.657 2.051 -5.936 1.00 0.00 C ATOM 740 CD1 LEU A 51 2.578 0.538 -6.068 1.00 0.00 C ATOM 741 CD2 LEU A 51 4.090 2.507 -6.075 1.00 0.00 C ATOM 0 H LEU A 51 0.805 5.065 -5.598 1.00 0.00 H new ATOM 0 HA LEU A 51 3.038 4.415 -7.414 1.00 0.00 H new ATOM 0 HB2 LEU A 51 0.724 2.587 -6.680 1.00 0.00 H new ATOM 0 HB3 LEU A 51 1.907 2.252 -7.930 1.00 0.00 H new ATOM 0 HG LEU A 51 2.294 2.330 -4.947 1.00 0.00 H new ATOM 0 HD11 LEU A 51 3.223 0.074 -5.322 1.00 0.00 H new ATOM 0 HD12 LEU A 51 1.550 0.212 -5.912 1.00 0.00 H new ATOM 0 HD13 LEU A 51 2.905 0.242 -7.065 1.00 0.00 H new ATOM 0 HD21 LEU A 51 4.706 2.002 -5.332 1.00 0.00 H new ATOM 0 HD22 LEU A 51 4.454 2.264 -7.073 1.00 0.00 H new ATOM 0 HD23 LEU A 51 4.146 3.585 -5.920 1.00 0.00 H new ATOM 753 N ASN A 52 -0.124 5.106 -7.947 1.00 0.00 N ATOM 754 CA ASN A 52 -1.138 5.436 -8.942 1.00 0.00 C ATOM 755 C ASN A 52 -1.375 6.941 -9.010 1.00 0.00 C ATOM 756 O ASN A 52 -1.656 7.498 -10.071 1.00 0.00 O ATOM 757 CB ASN A 52 -2.436 4.700 -8.592 1.00 0.00 C ATOM 758 CG ASN A 52 -2.593 3.405 -9.361 1.00 0.00 C ATOM 759 OD1 ASN A 52 -1.610 2.746 -9.706 1.00 0.00 O ATOM 760 ND2 ASN A 52 -3.831 3.031 -9.638 1.00 0.00 N ATOM 0 H ASN A 52 -0.443 5.187 -6.982 1.00 0.00 H new ATOM 0 HA ASN A 52 -0.790 5.118 -9.925 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -2.453 4.488 -7.523 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -3.286 5.349 -8.802 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -3.999 2.168 -10.155 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -4.617 3.605 -9.334 1.00 0.00 H new ATOM 767 N LYS A 53 -1.249 7.585 -7.868 1.00 0.00 N ATOM 768 CA LYS A 53 -1.381 9.022 -7.751 1.00 0.00 C ATOM 769 C LYS A 53 -0.014 9.645 -7.445 1.00 0.00 C ATOM 770 O LYS A 53 0.911 9.466 -8.260 1.00 0.00 O ATOM 771 CB LYS A 53 -2.362 9.345 -6.622 1.00 0.00 C ATOM 772 CG LYS A 53 -3.709 9.851 -7.075 1.00 0.00 C ATOM 773 CD LYS A 53 -4.437 10.489 -5.904 1.00 0.00 C ATOM 774 CE LYS A 53 -5.232 9.484 -5.094 1.00 0.00 C ATOM 775 NZ LYS A 53 -6.066 10.164 -4.067 1.00 0.00 N ATOM 776 OXT LYS A 53 0.123 10.316 -6.400 1.00 0.00 O ATOM 0 H LYS A 53 -1.049 7.118 -6.983 1.00 0.00 H new ATOM 0 HA LYS A 53 -1.755 9.433 -8.689 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -2.511 8.447 -6.022 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -1.910 10.093 -5.970 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -3.584 10.578 -7.878 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -4.300 9.029 -7.479 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -3.712 10.981 -5.255 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -5.109 11.263 -6.276 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -5.870 8.901 -5.758 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -4.552 8.783 -4.609 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -6.228 9.518 -3.268 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -5.575 11.016 -3.729 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -6.980 10.434 -4.485 1.00 0.00 H new ATOM 811 N VAL B 2 8.165 3.988 13.836 1.00 0.00 N ATOM 812 CA VAL B 2 7.859 2.855 14.703 1.00 0.00 C ATOM 813 C VAL B 2 7.824 1.554 13.894 1.00 0.00 C ATOM 814 O VAL B 2 7.638 0.466 14.437 1.00 0.00 O ATOM 815 CB VAL B 2 6.506 3.071 15.427 1.00 0.00 C ATOM 816 CG1 VAL B 2 5.346 3.026 14.441 1.00 0.00 C ATOM 817 CG2 VAL B 2 6.308 2.060 16.548 1.00 0.00 C ATOM 0 HA VAL B 2 8.646 2.778 15.454 1.00 0.00 H new ATOM 0 HB VAL B 2 6.528 4.063 15.878 1.00 0.00 H new ATOM 0 HG11 VAL B 2 4.408 3.180 14.975 1.00 0.00 H new ATOM 0 HG12 VAL B 2 5.472 3.811 13.695 1.00 0.00 H new ATOM 0 HG13 VAL B 2 5.326 2.055 13.946 1.00 0.00 H new ATOM 0 HG21 VAL B 2 5.350 2.240 17.035 1.00 0.00 H new ATOM 0 HG22 VAL B 2 6.322 1.051 16.135 1.00 0.00 H new ATOM 0 HG23 VAL B 2 7.111 2.164 17.278 1.00 0.00 H new ATOM 827 N ILE B 3 8.026 1.679 12.592 1.00 0.00 N ATOM 828 CA ILE B 3 7.995 0.524 11.710 1.00 0.00 C ATOM 829 C ILE B 3 9.170 0.568 10.741 1.00 0.00 C ATOM 830 O ILE B 3 9.527 1.632 10.234 1.00 0.00 O ATOM 831 CB ILE B 3 6.656 0.431 10.930 1.00 0.00 C ATOM 832 CG1 ILE B 3 6.541 -0.922 10.221 1.00 0.00 C ATOM 833 CG2 ILE B 3 6.520 1.572 9.925 1.00 0.00 C ATOM 834 CD1 ILE B 3 5.193 -1.152 9.571 1.00 0.00 C ATOM 0 H ILE B 3 8.213 2.566 12.124 1.00 0.00 H new ATOM 0 HA ILE B 3 8.077 -0.368 12.331 1.00 0.00 H new ATOM 0 HB ILE B 3 5.843 0.519 11.650 1.00 0.00 H new ATOM 0 HG12 ILE B 3 7.319 -0.992 9.460 1.00 0.00 H new ATOM 0 HG13 ILE B 3 6.728 -1.718 10.942 1.00 0.00 H new ATOM 0 HG21 ILE B 3 5.572 1.479 9.395 1.00 0.00 H new ATOM 0 HG22 ILE B 3 6.549 2.526 10.451 1.00 0.00 H new ATOM 0 HG23 ILE B 3 7.342 1.527 9.210 1.00 0.00 H new ATOM 0 HD11 ILE B 3 5.184 -2.129 9.088 1.00 0.00 H new ATOM 0 HD12 ILE B 3 4.412 -1.115 10.330 1.00 0.00 H new ATOM 0 HD13 ILE B 3 5.012 -0.378 8.826 1.00 0.00 H new ATOM 846 N ALA B 4 9.803 -0.577 10.536 1.00 0.00 N ATOM 847 CA ALA B 4 10.872 -0.687 9.563 1.00 0.00 C ATOM 848 C ALA B 4 10.541 -1.754 8.531 1.00 0.00 C ATOM 849 O ALA B 4 9.570 -2.494 8.692 1.00 0.00 O ATOM 850 CB ALA B 4 12.195 -0.995 10.248 1.00 0.00 C ATOM 0 H ALA B 4 9.592 -1.443 11.033 1.00 0.00 H new ATOM 0 HA ALA B 4 10.971 0.270 9.051 1.00 0.00 H new ATOM 0 HB1 ALA B 4 12.983 -1.073 9.499 1.00 0.00 H new ATOM 0 HB2 ALA B 4 12.437 -0.195 10.948 1.00 0.00 H new ATOM 0 HB3 ALA B 4 12.114 -1.938 10.789 1.00 0.00 H new ATOM 856 N THR B 5 11.346 -1.841 7.484 1.00 0.00 N ATOM 857 CA THR B 5 11.121 -2.815 6.424 1.00 0.00 C ATOM 858 C THR B 5 11.173 -4.245 6.969 1.00 0.00 C ATOM 859 O THR B 5 10.550 -5.155 6.425 1.00 0.00 O ATOM 860 CB THR B 5 12.170 -2.654 5.305 1.00 0.00 C ATOM 861 OG1 THR B 5 12.238 -1.278 4.902 1.00 0.00 O ATOM 862 CG2 THR B 5 11.832 -3.519 4.100 1.00 0.00 C ATOM 0 H THR B 5 12.164 -1.248 7.344 1.00 0.00 H new ATOM 0 HA THR B 5 10.128 -2.631 6.015 1.00 0.00 H new ATOM 0 HB THR B 5 13.135 -2.976 5.697 1.00 0.00 H new ATOM 0 HG1 THR B 5 12.906 -1.178 4.192 1.00 0.00 H new ATOM 0 HG21 THR B 5 12.591 -3.382 3.330 1.00 0.00 H new ATOM 0 HG22 THR B 5 11.804 -4.566 4.400 1.00 0.00 H new ATOM 0 HG23 THR B 5 10.858 -3.229 3.706 1.00 0.00 H new ATOM 870 N ASP B 6 11.851 -4.418 8.094 1.00 0.00 N ATOM 871 CA ASP B 6 12.110 -5.743 8.637 1.00 0.00 C ATOM 872 C ASP B 6 10.908 -6.253 9.419 1.00 0.00 C ATOM 873 O ASP B 6 10.893 -7.396 9.871 1.00 0.00 O ATOM 874 CB ASP B 6 13.339 -5.714 9.551 1.00 0.00 C ATOM 875 CG ASP B 6 14.615 -5.354 8.817 1.00 0.00 C ATOM 876 OD1 ASP B 6 14.829 -4.153 8.535 1.00 0.00 O ATOM 877 OD2 ASP B 6 15.421 -6.265 8.526 1.00 0.00 O ATOM 0 H ASP B 6 12.233 -3.654 8.651 1.00 0.00 H new ATOM 0 HA ASP B 6 12.298 -6.417 7.801 1.00 0.00 H new ATOM 0 HB2 ASP B 6 13.172 -4.994 10.352 1.00 0.00 H new ATOM 0 HB3 ASP B 6 13.459 -6.691 10.020 1.00 0.00 H new ATOM 882 N ASP B 7 9.899 -5.404 9.586 1.00 0.00 N ATOM 883 CA ASP B 7 8.675 -5.814 10.266 1.00 0.00 C ATOM 884 C ASP B 7 7.566 -6.099 9.261 1.00 0.00 C ATOM 885 O ASP B 7 6.447 -6.447 9.635 1.00 0.00 O ATOM 886 CB ASP B 7 8.208 -4.711 11.225 1.00 0.00 C ATOM 887 CG ASP B 7 9.276 -4.291 12.217 1.00 0.00 C ATOM 888 OD1 ASP B 7 9.384 -4.924 13.287 1.00 0.00 O ATOM 889 OD2 ASP B 7 10.008 -3.315 11.934 1.00 0.00 O ATOM 0 H ASP B 7 9.903 -4.436 9.263 1.00 0.00 H new ATOM 0 HA ASP B 7 8.891 -6.724 10.826 1.00 0.00 H new ATOM 0 HB2 ASP B 7 7.898 -3.842 10.645 1.00 0.00 H new ATOM 0 HB3 ASP B 7 7.331 -5.060 11.771 1.00 0.00 H new ATOM 894 N LEU B 8 7.880 -5.958 7.980 1.00 0.00 N ATOM 895 CA LEU B 8 6.911 -6.241 6.925 1.00 0.00 C ATOM 896 C LEU B 8 7.470 -7.235 5.920 1.00 0.00 C ATOM 897 O LEU B 8 6.723 -8.006 5.310 1.00 0.00 O ATOM 898 CB LEU B 8 6.503 -4.952 6.211 1.00 0.00 C ATOM 899 CG LEU B 8 5.676 -3.982 7.050 1.00 0.00 C ATOM 900 CD1 LEU B 8 5.414 -2.702 6.276 1.00 0.00 C ATOM 901 CD2 LEU B 8 4.364 -4.625 7.467 1.00 0.00 C ATOM 0 H LEU B 8 8.793 -5.651 7.645 1.00 0.00 H new ATOM 0 HA LEU B 8 6.030 -6.682 7.392 1.00 0.00 H new ATOM 0 HB2 LEU B 8 7.405 -4.440 5.875 1.00 0.00 H new ATOM 0 HB3 LEU B 8 5.934 -5.213 5.319 1.00 0.00 H new ATOM 0 HG LEU B 8 6.241 -3.735 7.948 1.00 0.00 H new ATOM 0 HD11 LEU B 8 4.823 -2.021 6.888 1.00 0.00 H new ATOM 0 HD12 LEU B 8 6.363 -2.230 6.021 1.00 0.00 H new ATOM 0 HD13 LEU B 8 4.868 -2.935 5.362 1.00 0.00 H new ATOM 0 HD21 LEU B 8 3.787 -3.919 8.065 1.00 0.00 H new ATOM 0 HD22 LEU B 8 3.795 -4.899 6.579 1.00 0.00 H new ATOM 0 HD23 LEU B 8 4.568 -5.518 8.057 1.00 0.00 H new ATOM 913 N GLU B 9 8.786 -7.243 5.783 1.00 0.00 N ATOM 914 CA GLU B 9 9.445 -8.098 4.817 1.00 0.00 C ATOM 915 C GLU B 9 10.750 -8.626 5.389 1.00 0.00 C ATOM 916 O GLU B 9 11.394 -7.975 6.213 1.00 0.00 O ATOM 917 CB GLU B 9 9.692 -7.365 3.491 1.00 0.00 C ATOM 918 CG GLU B 9 8.404 -6.992 2.774 1.00 0.00 C ATOM 919 CD GLU B 9 8.618 -6.503 1.357 1.00 0.00 C ATOM 920 OE1 GLU B 9 8.955 -7.327 0.487 1.00 0.00 O ATOM 921 OE2 GLU B 9 8.380 -5.304 1.094 1.00 0.00 O ATOM 0 H GLU B 9 9.419 -6.663 6.333 1.00 0.00 H new ATOM 0 HA GLU B 9 8.785 -8.940 4.607 1.00 0.00 H new ATOM 0 HB2 GLU B 9 10.270 -6.461 3.683 1.00 0.00 H new ATOM 0 HB3 GLU B 9 10.295 -7.997 2.839 1.00 0.00 H new ATOM 0 HG2 GLU B 9 7.745 -7.860 2.754 1.00 0.00 H new ATOM 0 HG3 GLU B 9 7.893 -6.216 3.344 1.00 0.00 H new ATOM 928 N VAL B 10 11.110 -9.817 4.968 1.00 0.00 N ATOM 929 CA VAL B 10 12.312 -10.476 5.433 1.00 0.00 C ATOM 930 C VAL B 10 13.126 -10.956 4.235 1.00 0.00 C ATOM 931 O VAL B 10 12.566 -11.401 3.229 1.00 0.00 O ATOM 932 CB VAL B 10 11.960 -11.663 6.364 1.00 0.00 C ATOM 933 CG1 VAL B 10 10.991 -12.620 5.684 1.00 0.00 C ATOM 934 CG2 VAL B 10 13.213 -12.397 6.817 1.00 0.00 C ATOM 0 H VAL B 10 10.575 -10.360 4.290 1.00 0.00 H new ATOM 0 HA VAL B 10 12.907 -9.766 6.007 1.00 0.00 H new ATOM 0 HB VAL B 10 11.471 -11.256 7.249 1.00 0.00 H new ATOM 0 HG11 VAL B 10 10.760 -13.444 6.359 1.00 0.00 H new ATOM 0 HG12 VAL B 10 10.073 -12.090 5.431 1.00 0.00 H new ATOM 0 HG13 VAL B 10 11.445 -13.012 4.774 1.00 0.00 H new ATOM 0 HG21 VAL B 10 12.934 -13.225 7.469 1.00 0.00 H new ATOM 0 HG22 VAL B 10 13.743 -12.783 5.946 1.00 0.00 H new ATOM 0 HG23 VAL B 10 13.861 -11.709 7.361 1.00 0.00 H new ATOM 944 N ALA B 11 14.441 -10.831 4.329 1.00 0.00 N ATOM 945 CA ALA B 11 15.326 -11.240 3.252 1.00 0.00 C ATOM 946 C ALA B 11 15.273 -12.750 3.037 1.00 0.00 C ATOM 947 O ALA B 11 15.242 -13.530 3.989 1.00 0.00 O ATOM 948 CB ALA B 11 16.741 -10.775 3.564 1.00 0.00 C ATOM 0 H ALA B 11 14.919 -10.448 5.144 1.00 0.00 H new ATOM 0 HA ALA B 11 14.996 -10.776 2.323 1.00 0.00 H new ATOM 0 HB1 ALA B 11 17.410 -11.079 2.759 1.00 0.00 H new ATOM 0 HB2 ALA B 11 16.755 -9.689 3.657 1.00 0.00 H new ATOM 0 HB3 ALA B 11 17.073 -11.223 4.500 1.00 0.00 H new ATOM 954 N CYS B 12 15.234 -13.142 1.762 1.00 0.00 N ATOM 955 CA CYS B 12 15.048 -14.525 1.347 1.00 0.00 C ATOM 956 C CYS B 12 16.126 -15.481 1.878 1.00 0.00 C ATOM 957 O CYS B 12 17.140 -15.052 2.414 1.00 0.00 O ATOM 958 CB CYS B 12 15.059 -14.559 -0.187 1.00 0.00 C ATOM 959 SG CYS B 12 13.625 -15.354 -0.940 1.00 0.00 S ATOM 0 H CYS B 12 15.333 -12.494 0.980 1.00 0.00 H new ATOM 0 HA CYS B 12 14.102 -14.870 1.764 1.00 0.00 H new ATOM 0 HB2 CYS B 12 15.126 -13.536 -0.558 1.00 0.00 H new ATOM 0 HB3 CYS B 12 15.959 -15.077 -0.518 1.00 0.00 H new ATOM 0 HG CYS B 12 13.363 -14.787 -2.080 1.00 0.00 H new ATOM 964 N PRO B 13 15.910 -16.801 1.718 1.00 0.00 N ATOM 965 CA PRO B 13 16.908 -17.829 2.058 1.00 0.00 C ATOM 966 C PRO B 13 18.318 -17.547 1.509 1.00 0.00 C ATOM 967 O PRO B 13 19.315 -17.805 2.186 1.00 0.00 O ATOM 968 CB PRO B 13 16.331 -19.073 1.385 1.00 0.00 C ATOM 969 CG PRO B 13 14.858 -18.897 1.450 1.00 0.00 C ATOM 970 CD PRO B 13 14.634 -17.415 1.273 1.00 0.00 C ATOM 0 HA PRO B 13 17.054 -17.899 3.136 1.00 0.00 H new ATOM 0 HB2 PRO B 13 16.673 -19.158 0.354 1.00 0.00 H new ATOM 0 HB3 PRO B 13 16.643 -19.981 1.901 1.00 0.00 H new ATOM 0 HG2 PRO B 13 14.357 -19.468 0.668 1.00 0.00 H new ATOM 0 HG3 PRO B 13 14.460 -19.245 2.403 1.00 0.00 H new ATOM 0 HD2 PRO B 13 14.412 -17.166 0.235 1.00 0.00 H new ATOM 0 HD3 PRO B 13 13.793 -17.065 1.871 1.00 0.00 H new ATOM 978 N LYS B 14 18.400 -16.983 0.300 1.00 0.00 N ATOM 979 CA LYS B 14 19.685 -16.923 -0.403 1.00 0.00 C ATOM 980 C LYS B 14 19.745 -15.907 -1.552 1.00 0.00 C ATOM 981 O LYS B 14 20.833 -15.612 -2.036 1.00 0.00 O ATOM 982 CB LYS B 14 20.071 -18.312 -0.923 1.00 0.00 C ATOM 983 CG LYS B 14 19.043 -18.915 -1.861 1.00 0.00 C ATOM 984 CD LYS B 14 19.527 -20.227 -2.476 1.00 0.00 C ATOM 985 CE LYS B 14 20.529 -20.001 -3.603 1.00 0.00 C ATOM 986 NZ LYS B 14 21.924 -19.859 -3.105 1.00 0.00 N ATOM 0 H LYS B 14 17.613 -16.571 -0.202 1.00 0.00 H new ATOM 0 HA LYS B 14 20.401 -16.574 0.341 1.00 0.00 H new ATOM 0 HB2 LYS B 14 21.028 -18.244 -1.441 1.00 0.00 H new ATOM 0 HB3 LYS B 14 20.214 -18.982 -0.075 1.00 0.00 H new ATOM 0 HG2 LYS B 14 18.115 -19.091 -1.317 1.00 0.00 H new ATOM 0 HG3 LYS B 14 18.817 -18.204 -2.656 1.00 0.00 H new ATOM 0 HD2 LYS B 14 19.986 -20.841 -1.702 1.00 0.00 H new ATOM 0 HD3 LYS B 14 18.672 -20.784 -2.859 1.00 0.00 H new ATOM 0 HE2 LYS B 14 20.479 -20.836 -4.302 1.00 0.00 H new ATOM 0 HE3 LYS B 14 20.251 -19.104 -4.157 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 22.262 -18.893 -3.289 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 21.948 -20.045 -2.082 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 22.539 -20.540 -3.595 1.00 0.00 H new ATOM 1000 N CYS B 15 18.617 -15.367 -2.021 1.00 0.00 N ATOM 1001 CA CYS B 15 18.669 -14.430 -3.149 1.00 0.00 C ATOM 1002 C CYS B 15 18.180 -13.037 -2.793 1.00 0.00 C ATOM 1003 O CYS B 15 17.486 -12.390 -3.586 1.00 0.00 O ATOM 1004 CB CYS B 15 17.748 -14.941 -4.245 1.00 0.00 C ATOM 1005 SG CYS B 15 16.040 -15.252 -3.683 1.00 0.00 S ATOM 0 H CYS B 15 17.684 -15.553 -1.653 1.00 0.00 H new ATOM 0 HA CYS B 15 19.713 -14.368 -3.455 1.00 0.00 H new ATOM 0 HB2 CYS B 15 17.727 -14.215 -5.058 1.00 0.00 H new ATOM 0 HB3 CYS B 15 18.160 -15.864 -4.653 1.00 0.00 H new ATOM 0 HG CYS B 15 15.435 -16.021 -4.539 1.00 0.00 H new ATOM 1010 N GLU B 16 18.597 -12.543 -1.663 1.00 0.00 N ATOM 1011 CA GLU B 16 18.161 -11.248 -1.191 1.00 0.00 C ATOM 1012 C GLU B 16 19.122 -10.184 -1.667 1.00 0.00 C ATOM 1013 O GLU B 16 19.285 -9.152 -1.023 1.00 0.00 O ATOM 1014 CB GLU B 16 18.117 -11.217 0.336 1.00 0.00 C ATOM 1015 CG GLU B 16 18.162 -12.582 0.987 1.00 0.00 C ATOM 1016 CD GLU B 16 19.569 -13.117 1.121 1.00 0.00 C ATOM 1017 OE1 GLU B 16 20.079 -13.676 0.138 1.00 0.00 O ATOM 1018 OE2 GLU B 16 20.167 -12.980 2.208 1.00 0.00 O ATOM 0 H GLU B 16 19.248 -13.021 -1.039 1.00 0.00 H new ATOM 0 HA GLU B 16 17.162 -11.060 -1.584 1.00 0.00 H new ATOM 0 HB2 GLU B 16 18.957 -10.626 0.700 1.00 0.00 H new ATOM 0 HB3 GLU B 16 17.207 -10.706 0.652 1.00 0.00 H new ATOM 0 HG2 GLU B 16 17.704 -12.525 1.974 1.00 0.00 H new ATOM 0 HG3 GLU B 16 17.566 -13.280 0.399 1.00 0.00 H new ATOM 1025 N ARG B 17 19.754 -10.427 -2.802 1.00 0.00 N ATOM 1026 CA ARG B 17 20.782 -9.541 -3.290 1.00 0.00 C ATOM 1027 C ARG B 17 20.740 -9.574 -4.808 1.00 0.00 C ATOM 1028 O ARG B 17 21.274 -8.694 -5.478 1.00 0.00 O ATOM 1029 CB ARG B 17 22.184 -9.907 -2.784 1.00 0.00 C ATOM 1030 CG ARG B 17 22.676 -11.291 -3.190 1.00 0.00 C ATOM 1031 CD ARG B 17 22.336 -12.331 -2.137 1.00 0.00 C ATOM 1032 NE ARG B 17 22.930 -12.002 -0.845 1.00 0.00 N ATOM 1033 CZ ARG B 17 23.121 -12.878 0.138 1.00 0.00 C ATOM 1034 NH1 ARG B 17 22.815 -14.159 -0.039 1.00 0.00 N ATOM 1035 NH2 ARG B 17 23.629 -12.470 1.295 1.00 0.00 N ATOM 0 H ARG B 17 19.569 -11.233 -3.399 1.00 0.00 H new ATOM 0 HA ARG B 17 20.584 -8.539 -2.910 1.00 0.00 H new ATOM 0 HB2 ARG B 17 22.892 -9.164 -3.152 1.00 0.00 H new ATOM 0 HB3 ARG B 17 22.190 -9.841 -1.696 1.00 0.00 H new ATOM 0 HG2 ARG B 17 22.226 -11.574 -4.142 1.00 0.00 H new ATOM 0 HG3 ARG B 17 23.755 -11.265 -3.343 1.00 0.00 H new ATOM 0 HD2 ARG B 17 21.253 -12.403 -2.032 1.00 0.00 H new ATOM 0 HD3 ARG B 17 22.691 -13.309 -2.463 1.00 0.00 H new ATOM 0 HE ARG B 17 23.218 -11.037 -0.685 1.00 0.00 H new ATOM 0 HH11 ARG B 17 22.432 -14.473 -0.931 1.00 0.00 H new ATOM 0 HH12 ARG B 17 22.963 -14.828 0.717 1.00 0.00 H new ATOM 0 HH21 ARG B 17 23.871 -11.488 1.428 1.00 0.00 H new ATOM 0 HH22 ARG B 17 23.777 -13.138 2.051 1.00 0.00 H new ATOM 1049 N ALA B 18 20.104 -10.626 -5.349 1.00 0.00 N ATOM 1050 CA ALA B 18 20.067 -10.815 -6.794 1.00 0.00 C ATOM 1051 C ALA B 18 18.660 -11.134 -7.295 1.00 0.00 C ATOM 1052 O ALA B 18 18.325 -10.844 -8.439 1.00 0.00 O ATOM 1053 CB ALA B 18 21.040 -11.908 -7.213 1.00 0.00 C ATOM 0 H ALA B 18 19.618 -11.344 -4.811 1.00 0.00 H new ATOM 0 HA ALA B 18 20.370 -9.874 -7.252 1.00 0.00 H new ATOM 0 HB1 ALA B 18 21.000 -12.036 -8.295 1.00 0.00 H new ATOM 0 HB2 ALA B 18 22.051 -11.627 -6.918 1.00 0.00 H new ATOM 0 HB3 ALA B 18 20.767 -12.844 -6.726 1.00 0.00 H new ATOM 1059 N GLY B 19 17.838 -11.737 -6.439 1.00 0.00 N ATOM 1060 CA GLY B 19 16.459 -12.008 -6.813 1.00 0.00 C ATOM 1061 C GLY B 19 16.274 -13.256 -7.679 1.00 0.00 C ATOM 1062 O GLY B 19 15.255 -13.390 -8.349 1.00 0.00 O ATOM 0 H GLY B 19 18.099 -12.041 -5.501 1.00 0.00 H new ATOM 0 HA2 GLY B 19 15.864 -12.118 -5.906 1.00 0.00 H new ATOM 0 HA3 GLY B 19 16.065 -11.146 -7.350 1.00 0.00 H new ATOM 1066 N GLU B 20 17.205 -14.206 -7.592 1.00 0.00 N ATOM 1067 CA GLU B 20 17.122 -15.442 -8.388 1.00 0.00 C ATOM 1068 C GLU B 20 17.494 -16.635 -7.549 1.00 0.00 C ATOM 1069 O GLU B 20 18.164 -16.514 -6.528 1.00 0.00 O ATOM 1070 CB GLU B 20 18.062 -15.480 -9.593 1.00 0.00 C ATOM 1071 CG GLU B 20 19.504 -15.180 -9.222 1.00 0.00 C ATOM 1072 CD GLU B 20 20.476 -15.460 -10.344 1.00 0.00 C ATOM 1073 OE1 GLU B 20 20.634 -14.598 -11.230 1.00 0.00 O ATOM 1074 OE2 GLU B 20 21.101 -16.542 -10.333 1.00 0.00 O ATOM 0 H GLU B 20 18.022 -14.149 -6.984 1.00 0.00 H new ATOM 0 HA GLU B 20 16.089 -15.467 -8.736 1.00 0.00 H new ATOM 0 HB2 GLU B 20 18.008 -16.464 -10.059 1.00 0.00 H new ATOM 0 HB3 GLU B 20 17.724 -14.757 -10.335 1.00 0.00 H new ATOM 0 HG2 GLU B 20 19.587 -14.133 -8.930 1.00 0.00 H new ATOM 0 HG3 GLU B 20 19.781 -15.776 -8.353 1.00 0.00 H new ATOM 1081 N ILE B 21 17.075 -17.783 -8.017 1.00 0.00 N ATOM 1082 CA ILE B 21 17.494 -19.042 -7.465 1.00 0.00 C ATOM 1083 C ILE B 21 17.999 -19.908 -8.594 1.00 0.00 C ATOM 1084 O ILE B 21 17.216 -20.332 -9.440 1.00 0.00 O ATOM 1085 CB ILE B 21 16.341 -19.777 -6.757 1.00 0.00 C ATOM 1086 CG1 ILE B 21 15.815 -18.952 -5.587 1.00 0.00 C ATOM 1087 CG2 ILE B 21 16.790 -21.154 -6.285 1.00 0.00 C ATOM 1088 CD1 ILE B 21 16.831 -18.711 -4.493 1.00 0.00 C ATOM 0 H ILE B 21 16.427 -17.869 -8.800 1.00 0.00 H new ATOM 0 HA ILE B 21 18.271 -18.850 -6.725 1.00 0.00 H new ATOM 0 HB ILE B 21 15.530 -19.910 -7.473 1.00 0.00 H new ATOM 0 HG12 ILE B 21 15.467 -17.990 -5.963 1.00 0.00 H new ATOM 0 HG13 ILE B 21 14.950 -19.459 -5.159 1.00 0.00 H new ATOM 0 HG21 ILE B 21 15.960 -21.656 -5.787 1.00 0.00 H new ATOM 0 HG22 ILE B 21 17.111 -21.746 -7.142 1.00 0.00 H new ATOM 0 HG23 ILE B 21 17.620 -21.047 -5.587 1.00 0.00 H new ATOM 0 HD11 ILE B 21 16.377 -18.117 -3.699 1.00 0.00 H new ATOM 0 HD12 ILE B 21 17.162 -19.667 -4.087 1.00 0.00 H new ATOM 0 HD13 ILE B 21 17.687 -18.175 -4.903 1.00 0.00 H new ATOM 1100 N GLU B 22 19.301 -20.145 -8.619 1.00 0.00 N ATOM 1101 CA GLU B 22 19.886 -21.025 -9.618 1.00 0.00 C ATOM 1102 C GLU B 22 19.648 -20.492 -11.032 1.00 0.00 C ATOM 1103 O GLU B 22 19.244 -21.233 -11.927 1.00 0.00 O ATOM 1104 CB GLU B 22 19.241 -22.399 -9.464 1.00 0.00 C ATOM 1105 CG GLU B 22 19.950 -23.522 -10.194 1.00 0.00 C ATOM 1106 CD GLU B 22 19.404 -24.883 -9.825 1.00 0.00 C ATOM 1107 OE1 GLU B 22 19.879 -25.473 -8.837 1.00 0.00 O ATOM 1108 OE2 GLU B 22 18.487 -25.370 -10.522 1.00 0.00 O ATOM 0 H GLU B 22 19.970 -19.743 -7.962 1.00 0.00 H new ATOM 0 HA GLU B 22 20.964 -21.083 -9.468 1.00 0.00 H new ATOM 0 HB2 GLU B 22 19.196 -22.646 -8.403 1.00 0.00 H new ATOM 0 HB3 GLU B 22 18.213 -22.344 -9.823 1.00 0.00 H new ATOM 0 HG2 GLU B 22 19.851 -23.373 -11.269 1.00 0.00 H new ATOM 0 HG3 GLU B 22 21.015 -23.486 -9.964 1.00 0.00 H new ATOM 1115 N GLY B 23 19.864 -19.199 -11.235 1.00 0.00 N ATOM 1116 CA GLY B 23 19.606 -18.612 -12.539 1.00 0.00 C ATOM 1117 C GLY B 23 18.134 -18.544 -12.872 1.00 0.00 C ATOM 1118 O GLY B 23 17.735 -18.064 -13.936 1.00 0.00 O ATOM 0 H GLY B 23 20.210 -18.550 -10.528 1.00 0.00 H new ATOM 0 HA2 GLY B 23 20.027 -17.607 -12.569 1.00 0.00 H new ATOM 0 HA3 GLY B 23 20.120 -19.196 -13.303 1.00 0.00 H new ATOM 1122 N THR B 24 17.340 -19.013 -11.950 1.00 0.00 N ATOM 1123 CA THR B 24 15.940 -19.281 -12.192 1.00 0.00 C ATOM 1124 C THR B 24 15.058 -18.454 -11.250 1.00 0.00 C ATOM 1125 O THR B 24 15.456 -18.166 -10.121 1.00 0.00 O ATOM 1126 CB THR B 24 15.764 -20.796 -12.000 1.00 0.00 C ATOM 1127 OG1 THR B 24 16.154 -21.487 -13.196 1.00 0.00 O ATOM 1128 CG2 THR B 24 14.357 -21.209 -11.595 1.00 0.00 C ATOM 0 H THR B 24 17.644 -19.224 -10.999 1.00 0.00 H new ATOM 0 HA THR B 24 15.632 -18.992 -13.197 1.00 0.00 H new ATOM 0 HB THR B 24 16.411 -21.075 -11.169 1.00 0.00 H new ATOM 0 HG1 THR B 24 16.042 -22.452 -13.068 1.00 0.00 H new ATOM 0 HG21 THR B 24 14.315 -22.292 -11.479 1.00 0.00 H new ATOM 0 HG22 THR B 24 14.096 -20.733 -10.650 1.00 0.00 H new ATOM 0 HG23 THR B 24 13.651 -20.898 -12.365 1.00 0.00 H new ATOM 1136 N PRO B 25 13.865 -18.020 -11.715 1.00 0.00 N ATOM 1137 CA PRO B 25 12.955 -17.186 -10.917 1.00 0.00 C ATOM 1138 C PRO B 25 12.620 -17.812 -9.562 1.00 0.00 C ATOM 1139 O PRO B 25 12.177 -18.963 -9.483 1.00 0.00 O ATOM 1140 CB PRO B 25 11.701 -17.064 -11.798 1.00 0.00 C ATOM 1141 CG PRO B 25 11.822 -18.181 -12.776 1.00 0.00 C ATOM 1142 CD PRO B 25 13.295 -18.313 -13.038 1.00 0.00 C ATOM 0 HA PRO B 25 13.401 -16.223 -10.670 1.00 0.00 H new ATOM 0 HB2 PRO B 25 10.790 -17.152 -11.206 1.00 0.00 H new ATOM 0 HB3 PRO B 25 11.662 -16.098 -12.302 1.00 0.00 H new ATOM 0 HG2 PRO B 25 11.409 -19.105 -12.372 1.00 0.00 H new ATOM 0 HG3 PRO B 25 11.276 -17.962 -13.694 1.00 0.00 H new ATOM 0 HD2 PRO B 25 13.560 -19.312 -13.385 1.00 0.00 H new ATOM 0 HD3 PRO B 25 13.640 -17.610 -13.796 1.00 0.00 H new ATOM 1150 N CYS B 26 12.843 -17.032 -8.505 1.00 0.00 N ATOM 1151 CA CYS B 26 12.733 -17.503 -7.130 1.00 0.00 C ATOM 1152 C CYS B 26 11.278 -17.691 -6.667 1.00 0.00 C ATOM 1153 O CYS B 26 10.436 -16.823 -6.900 1.00 0.00 O ATOM 1154 CB CYS B 26 13.454 -16.513 -6.220 1.00 0.00 C ATOM 1155 SG CYS B 26 13.448 -16.956 -4.450 1.00 0.00 S ATOM 0 H CYS B 26 13.107 -16.050 -8.582 1.00 0.00 H new ATOM 0 HA CYS B 26 13.195 -18.489 -7.077 1.00 0.00 H new ATOM 0 HB2 CYS B 26 14.488 -16.421 -6.554 1.00 0.00 H new ATOM 0 HB3 CYS B 26 12.993 -15.532 -6.336 1.00 0.00 H new ATOM 0 HG CYS B 26 14.054 -16.029 -3.769 1.00 0.00 H new ATOM 1160 N PRO B 27 11.016 -18.825 -5.967 1.00 0.00 N ATOM 1161 CA PRO B 27 9.704 -19.249 -5.436 1.00 0.00 C ATOM 1162 C PRO B 27 8.730 -18.130 -5.057 1.00 0.00 C ATOM 1163 O PRO B 27 7.590 -18.102 -5.513 1.00 0.00 O ATOM 1164 CB PRO B 27 10.122 -19.996 -4.169 1.00 0.00 C ATOM 1165 CG PRO B 27 11.437 -20.626 -4.489 1.00 0.00 C ATOM 1166 CD PRO B 27 12.029 -19.856 -5.659 1.00 0.00 C ATOM 0 HA PRO B 27 9.150 -19.807 -6.191 1.00 0.00 H new ATOM 0 HB2 PRO B 27 10.210 -19.314 -3.323 1.00 0.00 H new ATOM 0 HB3 PRO B 27 9.383 -20.749 -3.896 1.00 0.00 H new ATOM 0 HG2 PRO B 27 12.102 -20.588 -3.627 1.00 0.00 H new ATOM 0 HG3 PRO B 27 11.308 -21.677 -4.746 1.00 0.00 H new ATOM 0 HD2 PRO B 27 12.987 -19.407 -5.396 1.00 0.00 H new ATOM 0 HD3 PRO B 27 12.207 -20.507 -6.515 1.00 0.00 H new ATOM 1174 N ALA B 28 9.200 -17.206 -4.228 1.00 0.00 N ATOM 1175 CA ALA B 28 8.314 -16.240 -3.586 1.00 0.00 C ATOM 1176 C ALA B 28 8.759 -14.801 -3.849 1.00 0.00 C ATOM 1177 O ALA B 28 8.054 -13.851 -3.511 1.00 0.00 O ATOM 1178 CB ALA B 28 8.241 -16.506 -2.089 1.00 0.00 C ATOM 0 H ALA B 28 10.185 -17.104 -3.984 1.00 0.00 H new ATOM 0 HA ALA B 28 7.322 -16.362 -4.020 1.00 0.00 H new ATOM 0 HB1 ALA B 28 7.577 -15.779 -1.622 1.00 0.00 H new ATOM 0 HB2 ALA B 28 7.857 -17.511 -1.916 1.00 0.00 H new ATOM 0 HB3 ALA B 28 9.237 -16.419 -1.655 1.00 0.00 H new ATOM 1184 N CYS B 29 9.934 -14.631 -4.441 1.00 0.00 N ATOM 1185 CA CYS B 29 10.417 -13.293 -4.769 1.00 0.00 C ATOM 1186 C CYS B 29 10.947 -13.266 -6.190 1.00 0.00 C ATOM 1187 O CYS B 29 12.083 -13.670 -6.456 1.00 0.00 O ATOM 1188 CB CYS B 29 11.489 -12.809 -3.786 1.00 0.00 C ATOM 1189 SG CYS B 29 13.009 -13.817 -3.801 1.00 0.00 S ATOM 0 H CYS B 29 10.564 -15.390 -4.702 1.00 0.00 H new ATOM 0 HA CYS B 29 9.573 -12.608 -4.686 1.00 0.00 H new ATOM 0 HB2 CYS B 29 11.746 -11.777 -4.023 1.00 0.00 H new ATOM 0 HB3 CYS B 29 11.073 -12.811 -2.779 1.00 0.00 H new ATOM 0 HG CYS B 29 12.714 -15.043 -4.119 1.00 0.00 H new ATOM 1194 N SER B 30 10.115 -12.799 -7.099 1.00 0.00 N ATOM 1195 CA SER B 30 10.439 -12.772 -8.513 1.00 0.00 C ATOM 1196 C SER B 30 11.390 -11.618 -8.866 1.00 0.00 C ATOM 1197 O SER B 30 11.058 -10.756 -9.677 1.00 0.00 O ATOM 1198 CB SER B 30 9.139 -12.658 -9.304 1.00 0.00 C ATOM 1199 OG SER B 30 8.219 -13.657 -8.892 1.00 0.00 O ATOM 0 H SER B 30 9.192 -12.426 -6.878 1.00 0.00 H new ATOM 0 HA SER B 30 10.960 -13.694 -8.772 1.00 0.00 H new ATOM 0 HB2 SER B 30 8.702 -11.670 -9.157 1.00 0.00 H new ATOM 0 HB3 SER B 30 9.344 -12.761 -10.370 1.00 0.00 H new ATOM 0 HG SER B 30 7.390 -13.570 -9.407 1.00 0.00 H new ATOM 1205 N GLY B 31 12.563 -11.594 -8.234 1.00 0.00 N ATOM 1206 CA GLY B 31 13.567 -10.604 -8.583 1.00 0.00 C ATOM 1207 C GLY B 31 13.411 -9.360 -7.754 1.00 0.00 C ATOM 1208 O GLY B 31 13.402 -8.244 -8.271 1.00 0.00 O ATOM 0 H GLY B 31 12.834 -12.239 -7.491 1.00 0.00 H new ATOM 0 HA2 GLY B 31 14.562 -11.022 -8.433 1.00 0.00 H new ATOM 0 HA3 GLY B 31 13.483 -10.353 -9.640 1.00 0.00 H new ATOM 1212 N LYS B 32 13.280 -9.554 -6.451 1.00 0.00 N ATOM 1213 CA LYS B 32 12.973 -8.475 -5.536 1.00 0.00 C ATOM 1214 C LYS B 32 14.021 -8.443 -4.432 1.00 0.00 C ATOM 1215 O LYS B 32 14.447 -7.381 -3.991 1.00 0.00 O ATOM 1216 CB LYS B 32 11.591 -8.720 -4.937 1.00 0.00 C ATOM 1217 CG LYS B 32 10.596 -9.233 -5.966 1.00 0.00 C ATOM 1218 CD LYS B 32 9.421 -9.933 -5.320 1.00 0.00 C ATOM 1219 CE LYS B 32 8.543 -8.961 -4.575 1.00 0.00 C ATOM 1220 NZ LYS B 32 7.975 -7.930 -5.498 1.00 0.00 N ATOM 0 H LYS B 32 13.384 -10.464 -6.002 1.00 0.00 H new ATOM 0 HA LYS B 32 12.979 -7.519 -6.060 1.00 0.00 H new ATOM 0 HB2 LYS B 32 11.673 -9.441 -4.124 1.00 0.00 H new ATOM 0 HB3 LYS B 32 11.216 -7.793 -4.504 1.00 0.00 H new ATOM 0 HG2 LYS B 32 10.235 -8.399 -6.568 1.00 0.00 H new ATOM 0 HG3 LYS B 32 11.099 -9.921 -6.645 1.00 0.00 H new ATOM 0 HD2 LYS B 32 8.835 -10.443 -6.084 1.00 0.00 H new ATOM 0 HD3 LYS B 32 9.784 -10.698 -4.633 1.00 0.00 H new ATOM 0 HE2 LYS B 32 7.733 -9.501 -4.085 1.00 0.00 H new ATOM 0 HE3 LYS B 32 9.121 -8.472 -3.791 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 7.224 -7.403 -5.009 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 8.727 -7.272 -5.789 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 7.580 -8.397 -6.339 1.00 0.00 H new ATOM 1234 N GLY B 33 14.413 -9.636 -3.976 1.00 0.00 N ATOM 1235 CA GLY B 33 15.410 -9.761 -2.957 1.00 0.00 C ATOM 1236 C GLY B 33 14.796 -10.269 -1.676 1.00 0.00 C ATOM 1237 O GLY B 33 15.337 -11.162 -1.028 1.00 0.00 O ATOM 0 H GLY B 33 14.040 -10.524 -4.312 1.00 0.00 H new ATOM 0 HA2 GLY B 33 16.193 -10.444 -3.288 1.00 0.00 H new ATOM 0 HA3 GLY B 33 15.883 -8.795 -2.782 1.00 0.00 H new ATOM 1241 N VAL B 34 13.613 -9.775 -1.350 1.00 0.00 N ATOM 1242 CA VAL B 34 12.985 -10.117 -0.081 1.00 0.00 C ATOM 1243 C VAL B 34 11.603 -10.732 -0.272 1.00 0.00 C ATOM 1244 O VAL B 34 11.052 -10.737 -1.379 1.00 0.00 O ATOM 1245 CB VAL B 34 12.847 -8.868 0.820 1.00 0.00 C ATOM 1246 CG1 VAL B 34 14.206 -8.285 1.168 1.00 0.00 C ATOM 1247 CG2 VAL B 34 11.982 -7.815 0.146 1.00 0.00 C ATOM 0 H VAL B 34 13.071 -9.142 -1.939 1.00 0.00 H new ATOM 0 HA VAL B 34 13.634 -10.852 0.395 1.00 0.00 H new ATOM 0 HB VAL B 34 12.365 -9.180 1.746 1.00 0.00 H new ATOM 0 HG11 VAL B 34 14.074 -7.408 1.802 1.00 0.00 H new ATOM 0 HG12 VAL B 34 14.797 -9.031 1.699 1.00 0.00 H new ATOM 0 HG13 VAL B 34 14.723 -7.996 0.253 1.00 0.00 H new ATOM 0 HG21 VAL B 34 11.897 -6.944 0.796 1.00 0.00 H new ATOM 0 HG22 VAL B 34 12.438 -7.520 -0.799 1.00 0.00 H new ATOM 0 HG23 VAL B 34 10.990 -8.225 -0.043 1.00 0.00 H new ATOM 1257 N ILE B 35 11.079 -11.280 0.817 1.00 0.00 N ATOM 1258 CA ILE B 35 9.727 -11.820 0.860 1.00 0.00 C ATOM 1259 C ILE B 35 8.986 -11.295 2.089 1.00 0.00 C ATOM 1260 O ILE B 35 9.601 -10.796 3.027 1.00 0.00 O ATOM 1261 CB ILE B 35 9.735 -13.362 0.893 1.00 0.00 C ATOM 1262 CG1 ILE B 35 10.704 -13.864 1.966 1.00 0.00 C ATOM 1263 CG2 ILE B 35 10.105 -13.922 -0.472 1.00 0.00 C ATOM 1264 CD1 ILE B 35 10.711 -15.367 2.135 1.00 0.00 C ATOM 0 H ILE B 35 11.583 -11.363 1.700 1.00 0.00 H new ATOM 0 HA ILE B 35 9.216 -11.495 -0.046 1.00 0.00 H new ATOM 0 HB ILE B 35 8.733 -13.711 1.143 1.00 0.00 H new ATOM 0 HG12 ILE B 35 11.711 -13.532 1.715 1.00 0.00 H new ATOM 0 HG13 ILE B 35 10.445 -13.403 2.919 1.00 0.00 H new ATOM 0 HG21 ILE B 35 10.106 -15.011 -0.430 1.00 0.00 H new ATOM 0 HG22 ILE B 35 9.378 -13.588 -1.212 1.00 0.00 H new ATOM 0 HG23 ILE B 35 11.097 -13.569 -0.753 1.00 0.00 H new ATOM 0 HD11 ILE B 35 11.423 -15.642 2.913 1.00 0.00 H new ATOM 0 HD12 ILE B 35 9.715 -15.706 2.418 1.00 0.00 H new ATOM 0 HD13 ILE B 35 11.001 -15.837 1.195 1.00 0.00 H new ATOM 1276 N LEU B 36 7.669 -11.425 2.081 1.00 0.00 N ATOM 1277 CA LEU B 36 6.832 -10.816 3.114 1.00 0.00 C ATOM 1278 C LEU B 36 6.646 -11.705 4.336 1.00 0.00 C ATOM 1279 O LEU B 36 6.820 -12.922 4.279 1.00 0.00 O ATOM 1280 CB LEU B 36 5.450 -10.486 2.550 1.00 0.00 C ATOM 1281 CG LEU B 36 5.454 -9.649 1.277 1.00 0.00 C ATOM 1282 CD1 LEU B 36 5.350 -10.535 0.043 1.00 0.00 C ATOM 1283 CD2 LEU B 36 4.331 -8.636 1.319 1.00 0.00 C ATOM 0 H LEU B 36 7.152 -11.946 1.373 1.00 0.00 H new ATOM 0 HA LEU B 36 7.355 -9.913 3.428 1.00 0.00 H new ATOM 0 HB2 LEU B 36 4.924 -11.420 2.351 1.00 0.00 H new ATOM 0 HB3 LEU B 36 4.880 -9.956 3.313 1.00 0.00 H new ATOM 0 HG LEU B 36 6.400 -9.112 1.215 1.00 0.00 H new ATOM 0 HD11 LEU B 36 5.355 -9.914 -0.853 1.00 0.00 H new ATOM 0 HD12 LEU B 36 6.198 -11.220 0.014 1.00 0.00 H new ATOM 0 HD13 LEU B 36 4.423 -11.107 0.083 1.00 0.00 H new ATOM 0 HD21 LEU B 36 4.342 -8.042 0.405 1.00 0.00 H new ATOM 0 HD22 LEU B 36 3.376 -9.155 1.403 1.00 0.00 H new ATOM 0 HD23 LEU B 36 4.465 -7.980 2.179 1.00 0.00 H new ATOM 1295 N THR B 37 6.276 -11.061 5.437 1.00 0.00 N ATOM 1296 CA THR B 37 5.829 -11.750 6.636 1.00 0.00 C ATOM 1297 C THR B 37 4.317 -11.566 6.754 1.00 0.00 C ATOM 1298 O THR B 37 3.731 -10.862 5.938 1.00 0.00 O ATOM 1299 CB THR B 37 6.530 -11.210 7.909 1.00 0.00 C ATOM 1300 OG1 THR B 37 6.091 -11.934 9.066 1.00 0.00 O ATOM 1301 CG2 THR B 37 6.256 -9.726 8.105 1.00 0.00 C ATOM 0 H THR B 37 6.278 -10.044 5.521 1.00 0.00 H new ATOM 0 HA THR B 37 6.087 -12.806 6.554 1.00 0.00 H new ATOM 0 HB THR B 37 7.603 -11.349 7.778 1.00 0.00 H new ATOM 0 HG1 THR B 37 6.130 -12.896 8.884 1.00 0.00 H new ATOM 0 HG21 THR B 37 6.762 -9.379 9.006 1.00 0.00 H new ATOM 0 HG22 THR B 37 6.627 -9.171 7.244 1.00 0.00 H new ATOM 0 HG23 THR B 37 5.183 -9.564 8.206 1.00 0.00 H new ATOM 1309 N ALA B 38 3.695 -12.176 7.756 1.00 0.00 N ATOM 1310 CA ALA B 38 2.236 -12.160 7.891 1.00 0.00 C ATOM 1311 C ALA B 38 1.667 -10.747 7.863 1.00 0.00 C ATOM 1312 O ALA B 38 0.682 -10.489 7.168 1.00 0.00 O ATOM 1313 CB ALA B 38 1.815 -12.874 9.160 1.00 0.00 C ATOM 0 H ALA B 38 4.177 -12.691 8.492 1.00 0.00 H new ATOM 0 HA ALA B 38 1.828 -12.688 7.029 1.00 0.00 H new ATOM 0 HB1 ALA B 38 0.729 -12.853 9.246 1.00 0.00 H new ATOM 0 HB2 ALA B 38 2.157 -13.908 9.126 1.00 0.00 H new ATOM 0 HB3 ALA B 38 2.256 -12.374 10.022 1.00 0.00 H new ATOM 1319 N GLN B 39 2.271 -9.835 8.619 1.00 0.00 N ATOM 1320 CA GLN B 39 1.844 -8.440 8.598 1.00 0.00 C ATOM 1321 C GLN B 39 1.925 -7.876 7.183 1.00 0.00 C ATOM 1322 O GLN B 39 0.999 -7.216 6.712 1.00 0.00 O ATOM 1323 CB GLN B 39 2.698 -7.594 9.540 1.00 0.00 C ATOM 1324 CG GLN B 39 2.096 -6.224 9.802 1.00 0.00 C ATOM 1325 CD GLN B 39 2.883 -5.404 10.801 1.00 0.00 C ATOM 1326 OE1 GLN B 39 3.510 -5.941 11.712 1.00 0.00 O ATOM 1327 NE2 GLN B 39 2.848 -4.092 10.633 1.00 0.00 N ATOM 0 H GLN B 39 3.049 -10.034 9.247 1.00 0.00 H new ATOM 0 HA GLN B 39 0.809 -8.403 8.937 1.00 0.00 H new ATOM 0 HB2 GLN B 39 2.819 -8.121 10.487 1.00 0.00 H new ATOM 0 HB3 GLN B 39 3.694 -7.474 9.113 1.00 0.00 H new ATOM 0 HG2 GLN B 39 2.034 -5.676 8.862 1.00 0.00 H new ATOM 0 HG3 GLN B 39 1.076 -6.347 10.167 1.00 0.00 H new ATOM 0 HE21 GLN B 39 2.314 -3.691 9.862 1.00 0.00 H new ATOM 0 HE22 GLN B 39 3.355 -3.482 11.274 1.00 0.00 H new ATOM 1336 N GLY B 40 3.030 -8.163 6.505 1.00 0.00 N ATOM 1337 CA GLY B 40 3.207 -7.705 5.144 1.00 0.00 C ATOM 1338 C GLY B 40 2.253 -8.390 4.189 1.00 0.00 C ATOM 1339 O GLY B 40 1.844 -7.814 3.187 1.00 0.00 O ATOM 0 H GLY B 40 3.808 -8.707 6.877 1.00 0.00 H new ATOM 0 HA2 GLY B 40 3.052 -6.627 5.101 1.00 0.00 H new ATOM 0 HA3 GLY B 40 4.233 -7.892 4.829 1.00 0.00 H new ATOM 1343 N TYR B 41 1.878 -9.616 4.514 1.00 0.00 N ATOM 1344 CA TYR B 41 0.924 -10.357 3.710 1.00 0.00 C ATOM 1345 C TYR B 41 -0.464 -9.746 3.806 1.00 0.00 C ATOM 1346 O TYR B 41 -1.218 -9.749 2.831 1.00 0.00 O ATOM 1347 CB TYR B 41 0.879 -11.817 4.172 1.00 0.00 C ATOM 1348 CG TYR B 41 1.884 -12.722 3.492 1.00 0.00 C ATOM 1349 CD1 TYR B 41 1.746 -13.061 2.153 1.00 0.00 C ATOM 1350 CD2 TYR B 41 2.957 -13.253 4.194 1.00 0.00 C ATOM 1351 CE1 TYR B 41 2.649 -13.902 1.533 1.00 0.00 C ATOM 1352 CE2 TYR B 41 3.868 -14.090 3.580 1.00 0.00 C ATOM 1353 CZ TYR B 41 3.708 -14.411 2.250 1.00 0.00 C ATOM 1354 OH TYR B 41 4.609 -15.253 1.636 1.00 0.00 O ATOM 0 H TYR B 41 2.222 -10.119 5.332 1.00 0.00 H new ATOM 0 HA TYR B 41 1.247 -10.311 2.670 1.00 0.00 H new ATOM 0 HB2 TYR B 41 1.049 -11.850 5.248 1.00 0.00 H new ATOM 0 HB3 TYR B 41 -0.122 -12.210 3.996 1.00 0.00 H new ATOM 0 HD1 TYR B 41 0.918 -12.660 1.587 1.00 0.00 H new ATOM 0 HD2 TYR B 41 3.082 -13.008 5.238 1.00 0.00 H new ATOM 0 HE1 TYR B 41 2.525 -14.159 0.491 1.00 0.00 H new ATOM 0 HE2 TYR B 41 4.701 -14.490 4.139 1.00 0.00 H new ATOM 0 HH TYR B 41 5.297 -15.522 2.280 1.00 0.00 H new ATOM 1364 N THR B 42 -0.797 -9.200 4.959 1.00 0.00 N ATOM 1365 CA THR B 42 -2.062 -8.503 5.129 1.00 0.00 C ATOM 1366 C THR B 42 -2.046 -7.173 4.382 1.00 0.00 C ATOM 1367 O THR B 42 -3.057 -6.734 3.827 1.00 0.00 O ATOM 1368 CB THR B 42 -2.334 -8.237 6.616 1.00 0.00 C ATOM 1369 OG1 THR B 42 -2.117 -9.438 7.360 1.00 0.00 O ATOM 1370 CG2 THR B 42 -3.755 -7.743 6.837 1.00 0.00 C ATOM 0 H THR B 42 -0.211 -9.224 5.794 1.00 0.00 H new ATOM 0 HA THR B 42 -2.850 -9.137 4.723 1.00 0.00 H new ATOM 0 HB THR B 42 -1.651 -7.460 6.958 1.00 0.00 H new ATOM 0 HG1 THR B 42 -2.443 -9.318 8.276 1.00 0.00 H new ATOM 0 HG21 THR B 42 -3.917 -7.564 7.900 1.00 0.00 H new ATOM 0 HG22 THR B 42 -3.908 -6.816 6.285 1.00 0.00 H new ATOM 0 HG23 THR B 42 -4.461 -8.495 6.485 1.00 0.00 H new ATOM 1378 N LEU B 43 -0.873 -6.564 4.332 1.00 0.00 N ATOM 1379 CA LEU B 43 -0.728 -5.241 3.758 1.00 0.00 C ATOM 1380 C LEU B 43 -0.514 -5.325 2.254 1.00 0.00 C ATOM 1381 O LEU B 43 -0.702 -4.342 1.549 1.00 0.00 O ATOM 1382 CB LEU B 43 0.443 -4.499 4.422 1.00 0.00 C ATOM 1383 CG LEU B 43 0.080 -3.534 5.569 1.00 0.00 C ATOM 1384 CD1 LEU B 43 -0.802 -4.218 6.603 1.00 0.00 C ATOM 1385 CD2 LEU B 43 1.347 -3.012 6.227 1.00 0.00 C ATOM 0 H LEU B 43 -0.005 -6.968 4.684 1.00 0.00 H new ATOM 0 HA LEU B 43 -1.647 -4.685 3.942 1.00 0.00 H new ATOM 0 HB2 LEU B 43 1.143 -5.240 4.808 1.00 0.00 H new ATOM 0 HB3 LEU B 43 0.969 -3.933 3.653 1.00 0.00 H new ATOM 0 HG LEU B 43 -0.479 -2.698 5.148 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -1.042 -3.514 7.400 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -1.723 -4.557 6.129 1.00 0.00 H new ATOM 0 HD13 LEU B 43 -0.274 -5.074 7.023 1.00 0.00 H new ATOM 0 HD21 LEU B 43 1.083 -2.331 7.036 1.00 0.00 H new ATOM 0 HD22 LEU B 43 1.919 -3.848 6.629 1.00 0.00 H new ATOM 0 HD23 LEU B 43 1.949 -2.482 5.489 1.00 0.00 H new ATOM 1397 N LEU B 44 -0.149 -6.502 1.747 1.00 0.00 N ATOM 1398 CA LEU B 44 0.074 -6.654 0.317 1.00 0.00 C ATOM 1399 C LEU B 44 -1.251 -6.857 -0.403 1.00 0.00 C ATOM 1400 O LEU B 44 -1.503 -6.233 -1.427 1.00 0.00 O ATOM 1401 CB LEU B 44 1.068 -7.805 0.021 1.00 0.00 C ATOM 1402 CG LEU B 44 0.491 -9.224 -0.180 1.00 0.00 C ATOM 1403 CD1 LEU B 44 -0.094 -9.408 -1.579 1.00 0.00 C ATOM 1404 CD2 LEU B 44 1.567 -10.269 0.043 1.00 0.00 C ATOM 0 H LEU B 44 -0.004 -7.349 2.297 1.00 0.00 H new ATOM 0 HA LEU B 44 0.528 -5.738 -0.061 1.00 0.00 H new ATOM 0 HB2 LEU B 44 1.628 -7.541 -0.876 1.00 0.00 H new ATOM 0 HB3 LEU B 44 1.784 -7.848 0.842 1.00 0.00 H new ATOM 0 HG LEU B 44 -0.309 -9.348 0.550 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -0.489 -10.419 -1.678 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -0.897 -8.688 -1.735 1.00 0.00 H new ATOM 0 HD13 LEU B 44 0.686 -9.248 -2.323 1.00 0.00 H new ATOM 0 HD21 LEU B 44 1.144 -11.263 -0.102 1.00 0.00 H new ATOM 0 HD22 LEU B 44 2.379 -10.112 -0.667 1.00 0.00 H new ATOM 0 HD23 LEU B 44 1.952 -10.184 1.059 1.00 0.00 H new ATOM 1416 N ASP B 45 -2.109 -7.714 0.143 1.00 0.00 N ATOM 1417 CA ASP B 45 -3.360 -8.056 -0.526 1.00 0.00 C ATOM 1418 C ASP B 45 -4.332 -6.892 -0.463 1.00 0.00 C ATOM 1419 O ASP B 45 -5.226 -6.762 -1.300 1.00 0.00 O ATOM 1420 CB ASP B 45 -3.987 -9.301 0.099 1.00 0.00 C ATOM 1421 CG ASP B 45 -5.085 -9.877 -0.770 1.00 0.00 C ATOM 1422 OD1 ASP B 45 -4.763 -10.406 -1.852 1.00 0.00 O ATOM 1423 OD2 ASP B 45 -6.272 -9.803 -0.382 1.00 0.00 O ATOM 0 H ASP B 45 -1.963 -8.180 1.038 1.00 0.00 H new ATOM 0 HA ASP B 45 -3.137 -8.270 -1.571 1.00 0.00 H new ATOM 0 HB2 ASP B 45 -3.216 -10.055 0.257 1.00 0.00 H new ATOM 0 HB3 ASP B 45 -4.393 -9.050 1.079 1.00 0.00 H new ATOM 1428 N PHE B 46 -4.113 -6.017 0.505 1.00 0.00 N ATOM 1429 CA PHE B 46 -4.877 -4.788 0.609 1.00 0.00 C ATOM 1430 C PHE B 46 -4.435 -3.809 -0.455 1.00 0.00 C ATOM 1431 O PHE B 46 -5.258 -3.201 -1.135 1.00 0.00 O ATOM 1432 CB PHE B 46 -4.622 -4.182 1.989 1.00 0.00 C ATOM 1433 CG PHE B 46 -5.333 -2.890 2.258 1.00 0.00 C ATOM 1434 CD1 PHE B 46 -6.594 -2.889 2.824 1.00 0.00 C ATOM 1435 CD2 PHE B 46 -4.732 -1.678 1.961 1.00 0.00 C ATOM 1436 CE1 PHE B 46 -7.247 -1.704 3.085 1.00 0.00 C ATOM 1437 CE2 PHE B 46 -5.380 -0.489 2.222 1.00 0.00 C ATOM 1438 CZ PHE B 46 -6.639 -0.504 2.784 1.00 0.00 C ATOM 0 H PHE B 46 -3.408 -6.138 1.233 1.00 0.00 H new ATOM 0 HA PHE B 46 -5.937 -5.000 0.472 1.00 0.00 H new ATOM 0 HB2 PHE B 46 -4.919 -4.907 2.747 1.00 0.00 H new ATOM 0 HB3 PHE B 46 -3.550 -4.020 2.105 1.00 0.00 H new ATOM 0 HD1 PHE B 46 -7.073 -3.827 3.064 1.00 0.00 H new ATOM 0 HD2 PHE B 46 -3.746 -1.664 1.521 1.00 0.00 H new ATOM 0 HE1 PHE B 46 -8.233 -1.715 3.525 1.00 0.00 H new ATOM 0 HE2 PHE B 46 -4.903 0.451 1.987 1.00 0.00 H new ATOM 0 HZ PHE B 46 -7.149 0.426 2.989 1.00 0.00 H new ATOM 1448 N ILE B 47 -3.138 -3.689 -0.649 1.00 0.00 N ATOM 1449 CA ILE B 47 -2.654 -2.716 -1.593 1.00 0.00 C ATOM 1450 C ILE B 47 -2.810 -3.239 -3.017 1.00 0.00 C ATOM 1451 O ILE B 47 -2.990 -2.462 -3.954 1.00 0.00 O ATOM 1452 CB ILE B 47 -1.203 -2.275 -1.282 1.00 0.00 C ATOM 1453 CG1 ILE B 47 -0.209 -3.446 -1.336 1.00 0.00 C ATOM 1454 CG2 ILE B 47 -1.173 -1.625 0.090 1.00 0.00 C ATOM 1455 CD1 ILE B 47 0.440 -3.641 -2.685 1.00 0.00 C ATOM 0 H ILE B 47 -2.420 -4.239 -0.177 1.00 0.00 H new ATOM 0 HA ILE B 47 -3.264 -1.818 -1.499 1.00 0.00 H new ATOM 0 HB ILE B 47 -0.892 -1.565 -2.048 1.00 0.00 H new ATOM 0 HG12 ILE B 47 0.569 -3.283 -0.590 1.00 0.00 H new ATOM 0 HG13 ILE B 47 -0.729 -4.363 -1.059 1.00 0.00 H new ATOM 0 HG21 ILE B 47 -0.156 -1.310 0.321 1.00 0.00 H new ATOM 0 HG22 ILE B 47 -1.832 -0.757 0.096 1.00 0.00 H new ATOM 0 HG23 ILE B 47 -1.510 -2.341 0.839 1.00 0.00 H new ATOM 0 HD11 ILE B 47 1.127 -4.486 -2.640 1.00 0.00 H new ATOM 0 HD12 ILE B 47 -0.328 -3.837 -3.433 1.00 0.00 H new ATOM 0 HD13 ILE B 47 0.990 -2.740 -2.958 1.00 0.00 H new ATOM 1467 N GLN B 48 -2.801 -4.567 -3.155 1.00 0.00 N ATOM 1468 CA GLN B 48 -3.227 -5.218 -4.382 1.00 0.00 C ATOM 1469 C GLN B 48 -4.603 -4.713 -4.757 1.00 0.00 C ATOM 1470 O GLN B 48 -4.782 -4.054 -5.764 1.00 0.00 O ATOM 1471 CB GLN B 48 -3.320 -6.734 -4.190 1.00 0.00 C ATOM 1472 CG GLN B 48 -1.991 -7.471 -4.150 1.00 0.00 C ATOM 1473 CD GLN B 48 -1.463 -7.789 -5.533 1.00 0.00 C ATOM 1474 OE1 GLN B 48 -2.231 -7.933 -6.486 1.00 0.00 O ATOM 1475 NE2 GLN B 48 -0.152 -7.924 -5.652 1.00 0.00 N ATOM 0 H GLN B 48 -2.500 -5.210 -2.423 1.00 0.00 H new ATOM 0 HA GLN B 48 -2.497 -4.993 -5.160 1.00 0.00 H new ATOM 0 HB2 GLN B 48 -3.854 -6.933 -3.261 1.00 0.00 H new ATOM 0 HB3 GLN B 48 -3.922 -7.149 -4.999 1.00 0.00 H new ATOM 0 HG2 GLN B 48 -1.259 -6.865 -3.616 1.00 0.00 H new ATOM 0 HG3 GLN B 48 -2.110 -8.397 -3.588 1.00 0.00 H new ATOM 0 HE21 GLN B 48 0.450 -7.797 -4.838 1.00 0.00 H new ATOM 0 HE22 GLN B 48 0.257 -8.155 -6.557 1.00 0.00 H new ATOM 1484 N LYS B 49 -5.539 -4.936 -3.854 1.00 0.00 N ATOM 1485 CA LYS B 49 -6.958 -4.800 -4.133 1.00 0.00 C ATOM 1486 C LYS B 49 -7.418 -3.344 -4.107 1.00 0.00 C ATOM 1487 O LYS B 49 -8.598 -3.065 -4.265 1.00 0.00 O ATOM 1488 CB LYS B 49 -7.734 -5.676 -3.130 1.00 0.00 C ATOM 1489 CG LYS B 49 -9.242 -5.739 -3.342 1.00 0.00 C ATOM 1490 CD LYS B 49 -9.967 -6.160 -2.070 1.00 0.00 C ATOM 1491 CE LYS B 49 -9.453 -7.485 -1.516 1.00 0.00 C ATOM 1492 NZ LYS B 49 -9.861 -8.650 -2.347 1.00 0.00 N ATOM 0 H LYS B 49 -5.335 -5.220 -2.896 1.00 0.00 H new ATOM 0 HA LYS B 49 -7.161 -5.144 -5.147 1.00 0.00 H new ATOM 0 HB2 LYS B 49 -7.336 -6.690 -3.176 1.00 0.00 H new ATOM 0 HB3 LYS B 49 -7.542 -5.303 -2.124 1.00 0.00 H new ATOM 0 HG2 LYS B 49 -9.606 -4.763 -3.664 1.00 0.00 H new ATOM 0 HG3 LYS B 49 -9.469 -6.444 -4.142 1.00 0.00 H new ATOM 0 HD2 LYS B 49 -9.849 -5.384 -1.314 1.00 0.00 H new ATOM 0 HD3 LYS B 49 -11.034 -6.245 -2.275 1.00 0.00 H new ATOM 0 HE2 LYS B 49 -8.365 -7.451 -1.454 1.00 0.00 H new ATOM 0 HE3 LYS B 49 -9.826 -7.619 -0.501 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 -9.486 -9.524 -1.927 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 -10.899 -8.702 -2.386 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 -9.483 -8.539 -3.310 1.00 0.00 H new ATOM 1506 N HIS B 50 -6.517 -2.392 -3.880 1.00 0.00 N ATOM 1507 CA HIS B 50 -6.964 -1.023 -4.104 1.00 0.00 C ATOM 1508 C HIS B 50 -6.252 -0.283 -5.232 1.00 0.00 C ATOM 1509 O HIS B 50 -6.641 0.840 -5.538 1.00 0.00 O ATOM 1510 CB HIS B 50 -6.872 -0.253 -2.787 1.00 0.00 C ATOM 1511 CG HIS B 50 -7.722 -0.894 -1.738 1.00 0.00 C ATOM 1512 ND1 HIS B 50 -9.057 -1.150 -1.928 1.00 0.00 N ATOM 1513 CD2 HIS B 50 -7.401 -1.451 -0.555 1.00 0.00 C ATOM 1514 CE1 HIS B 50 -9.517 -1.843 -0.912 1.00 0.00 C ATOM 1515 NE2 HIS B 50 -8.533 -2.047 -0.060 1.00 0.00 N ATOM 0 H HIS B 50 -5.555 -2.522 -3.568 1.00 0.00 H new ATOM 0 HA HIS B 50 -7.997 -1.084 -4.446 1.00 0.00 H new ATOM 0 HB2 HIS B 50 -5.835 -0.220 -2.451 1.00 0.00 H new ATOM 0 HB3 HIS B 50 -7.191 0.778 -2.940 1.00 0.00 H new ATOM 0 HD1 HIS B 50 -9.606 -0.849 -2.733 1.00 0.00 H new ATOM 0 HD2 HIS B 50 -6.430 -1.432 -0.082 1.00 0.00 H new ATOM 0 HE1 HIS B 50 -10.533 -2.188 -0.794 1.00 0.00 H new ATOM 1524 N LEU B 51 -5.255 -0.891 -5.878 1.00 0.00 N ATOM 1525 CA LEU B 51 -4.713 -0.306 -7.120 1.00 0.00 C ATOM 1526 C LEU B 51 -4.694 -1.317 -8.262 1.00 0.00 C ATOM 1527 O LEU B 51 -4.941 -0.971 -9.417 1.00 0.00 O ATOM 1528 CB LEU B 51 -3.293 0.249 -6.943 1.00 0.00 C ATOM 1529 CG LEU B 51 -3.127 1.353 -5.899 1.00 0.00 C ATOM 1530 CD1 LEU B 51 -1.775 2.034 -6.032 1.00 0.00 C ATOM 1531 CD2 LEU B 51 -4.232 2.375 -6.019 1.00 0.00 C ATOM 0 H LEU B 51 -4.814 -1.761 -5.580 1.00 0.00 H new ATOM 0 HA LEU B 51 -5.385 0.516 -7.365 1.00 0.00 H new ATOM 0 HB2 LEU B 51 -2.633 -0.577 -6.677 1.00 0.00 H new ATOM 0 HB3 LEU B 51 -2.952 0.632 -7.905 1.00 0.00 H new ATOM 0 HG LEU B 51 -3.184 0.887 -4.915 1.00 0.00 H new ATOM 0 HD11 LEU B 51 -1.685 2.815 -5.277 1.00 0.00 H new ATOM 0 HD12 LEU B 51 -0.982 1.299 -5.891 1.00 0.00 H new ATOM 0 HD13 LEU B 51 -1.687 2.477 -7.024 1.00 0.00 H new ATOM 0 HD21 LEU B 51 -4.093 3.151 -5.266 1.00 0.00 H new ATOM 0 HD22 LEU B 51 -4.206 2.824 -7.012 1.00 0.00 H new ATOM 0 HD23 LEU B 51 -5.195 1.889 -5.866 1.00 0.00 H new ATOM 1543 N ASN B 52 -4.409 -2.563 -7.935 1.00 0.00 N ATOM 1544 CA ASN B 52 -4.201 -3.598 -8.939 1.00 0.00 C ATOM 1545 C ASN B 52 -5.391 -4.550 -9.004 1.00 0.00 C ATOM 1546 O ASN B 52 -5.740 -5.062 -10.068 1.00 0.00 O ATOM 1547 CB ASN B 52 -2.910 -4.360 -8.620 1.00 0.00 C ATOM 1548 CG ASN B 52 -1.728 -3.845 -9.419 1.00 0.00 C ATOM 1549 OD1 ASN B 52 -1.674 -2.671 -9.781 1.00 0.00 O ATOM 1550 ND2 ASN B 52 -0.778 -4.719 -9.707 1.00 0.00 N ATOM 0 H ASN B 52 -4.315 -2.889 -6.973 1.00 0.00 H new ATOM 0 HA ASN B 52 -4.109 -3.127 -9.918 1.00 0.00 H new ATOM 0 HB2 ASN B 52 -2.692 -4.273 -7.556 1.00 0.00 H new ATOM 0 HB3 ASN B 52 -3.054 -5.420 -8.830 1.00 0.00 H new ATOM 0 HD21 ASN B 52 0.036 -4.428 -10.248 1.00 0.00 H new ATOM 0 HD22 ASN B 52 -0.860 -5.684 -9.388 1.00 0.00 H new ATOM 1557 N LYS B 53 -6.004 -4.772 -7.861 1.00 0.00 N ATOM 1558 CA LYS B 53 -7.193 -5.589 -7.739 1.00 0.00 C ATOM 1559 C LYS B 53 -8.393 -4.696 -7.409 1.00 0.00 C ATOM 1560 O LYS B 53 -8.652 -3.745 -8.175 1.00 0.00 O ATOM 1561 CB LYS B 53 -6.990 -6.616 -6.621 1.00 0.00 C ATOM 1562 CG LYS B 53 -6.798 -8.038 -7.087 1.00 0.00 C ATOM 1563 CD LYS B 53 -6.951 -8.993 -5.913 1.00 0.00 C ATOM 1564 CE LYS B 53 -5.657 -9.173 -5.140 1.00 0.00 C ATOM 1565 NZ LYS B 53 -5.745 -10.324 -4.204 1.00 0.00 N ATOM 1566 OXT LYS B 53 -9.071 -4.943 -6.390 1.00 0.00 O ATOM 0 H LYS B 53 -5.684 -4.383 -6.974 1.00 0.00 H new ATOM 0 HA LYS B 53 -7.379 -6.109 -8.679 1.00 0.00 H new ATOM 0 HB2 LYS B 53 -6.121 -6.322 -6.032 1.00 0.00 H new ATOM 0 HB3 LYS B 53 -7.853 -6.581 -5.956 1.00 0.00 H new ATOM 0 HG2 LYS B 53 -7.528 -8.278 -7.860 1.00 0.00 H new ATOM 0 HG3 LYS B 53 -5.811 -8.153 -7.534 1.00 0.00 H new ATOM 0 HD2 LYS B 53 -7.723 -8.618 -5.241 1.00 0.00 H new ATOM 0 HD3 LYS B 53 -7.290 -9.962 -6.279 1.00 0.00 H new ATOM 0 HE2 LYS B 53 -4.833 -9.330 -5.836 1.00 0.00 H new ATOM 0 HE3 LYS B 53 -5.434 -8.264 -4.582 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 -5.293 -10.073 -3.302 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 -6.744 -10.560 -4.037 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 -5.260 -11.146 -4.618 1.00 0.00 H new ATOM 1601 N VAL C 2 -7.411 4.831 13.975 1.00 0.00 N ATOM 1602 CA VAL C 2 -6.272 5.123 14.840 1.00 0.00 C ATOM 1603 C VAL C 2 -5.137 5.761 14.032 1.00 0.00 C ATOM 1604 O VAL C 2 -4.110 6.174 14.575 1.00 0.00 O ATOM 1605 CB VAL C 2 -5.774 3.831 15.536 1.00 0.00 C ATOM 1606 CG1 VAL C 2 -5.168 2.863 14.527 1.00 0.00 C ATOM 1607 CG2 VAL C 2 -4.786 4.145 16.652 1.00 0.00 C ATOM 0 HA VAL C 2 -6.594 5.828 15.606 1.00 0.00 H new ATOM 0 HB VAL C 2 -6.640 3.348 15.988 1.00 0.00 H new ATOM 0 HG11 VAL C 2 -4.827 1.966 15.043 1.00 0.00 H new ATOM 0 HG12 VAL C 2 -5.920 2.592 13.786 1.00 0.00 H new ATOM 0 HG13 VAL C 2 -4.323 3.338 14.029 1.00 0.00 H new ATOM 0 HG21 VAL C 2 -4.457 3.216 17.119 1.00 0.00 H new ATOM 0 HG22 VAL C 2 -3.924 4.668 16.238 1.00 0.00 H new ATOM 0 HG23 VAL C 2 -5.269 4.775 17.399 1.00 0.00 H new ATOM 1617 N ILE C 3 -5.343 5.863 12.731 1.00 0.00 N ATOM 1618 CA ILE C 3 -4.335 6.428 11.852 1.00 0.00 C ATOM 1619 C ILE C 3 -4.967 7.441 10.907 1.00 0.00 C ATOM 1620 O ILE C 3 -6.065 7.220 10.394 1.00 0.00 O ATOM 1621 CB ILE C 3 -3.596 5.327 11.045 1.00 0.00 C ATOM 1622 CG1 ILE C 3 -2.377 5.918 10.333 1.00 0.00 C ATOM 1623 CG2 ILE C 3 -4.532 4.657 10.039 1.00 0.00 C ATOM 1624 CD1 ILE C 3 -1.503 4.878 9.663 1.00 0.00 C ATOM 0 H ILE C 3 -6.197 5.563 12.261 1.00 0.00 H new ATOM 0 HA ILE C 3 -3.597 6.933 12.476 1.00 0.00 H new ATOM 0 HB ILE C 3 -3.257 4.564 11.746 1.00 0.00 H new ATOM 0 HG12 ILE C 3 -2.716 6.633 9.583 1.00 0.00 H new ATOM 0 HG13 ILE C 3 -1.778 6.473 11.055 1.00 0.00 H new ATOM 0 HG21 ILE C 3 -3.986 3.891 9.489 1.00 0.00 H new ATOM 0 HG22 ILE C 3 -5.367 4.198 10.569 1.00 0.00 H new ATOM 0 HG23 ILE C 3 -4.911 5.404 9.341 1.00 0.00 H new ATOM 0 HD11 ILE C 3 -0.659 5.369 9.179 1.00 0.00 H new ATOM 0 HD12 ILE C 3 -1.134 4.176 10.411 1.00 0.00 H new ATOM 0 HD13 ILE C 3 -2.086 4.339 8.916 1.00 0.00 H new ATOM 1636 N ALA C 4 -4.303 8.571 10.730 1.00 0.00 N ATOM 1637 CA ALA C 4 -4.755 9.571 9.781 1.00 0.00 C ATOM 1638 C ALA C 4 -3.681 9.839 8.740 1.00 0.00 C ATOM 1639 O ALA C 4 -2.547 9.375 8.884 1.00 0.00 O ATOM 1640 CB ALA C 4 -5.142 10.855 10.497 1.00 0.00 C ATOM 0 H ALA C 4 -3.450 8.818 11.231 1.00 0.00 H new ATOM 0 HA ALA C 4 -5.639 9.187 9.272 1.00 0.00 H new ATOM 0 HB1 ALA C 4 -5.478 11.592 9.767 1.00 0.00 H new ATOM 0 HB2 ALA C 4 -5.947 10.650 11.202 1.00 0.00 H new ATOM 0 HB3 ALA C 4 -4.279 11.246 11.036 1.00 0.00 H new ATOM 1646 N THR C 5 -4.026 10.587 7.705 1.00 0.00 N ATOM 1647 CA THR C 5 -3.083 10.911 6.643 1.00 0.00 C ATOM 1648 C THR C 5 -1.862 11.651 7.197 1.00 0.00 C ATOM 1649 O THR C 5 -0.764 11.568 6.646 1.00 0.00 O ATOM 1650 CB THR C 5 -3.762 11.778 5.566 1.00 0.00 C ATOM 1651 OG1 THR C 5 -5.024 11.199 5.200 1.00 0.00 O ATOM 1652 CG2 THR C 5 -2.883 11.905 4.331 1.00 0.00 C ATOM 0 H THR C 5 -4.957 10.984 7.576 1.00 0.00 H new ATOM 0 HA THR C 5 -2.752 9.973 6.197 1.00 0.00 H new ATOM 0 HB THR C 5 -3.920 12.774 5.981 1.00 0.00 H new ATOM 0 HG1 THR C 5 -5.453 11.755 4.516 1.00 0.00 H new ATOM 0 HG21 THR C 5 -3.387 12.522 3.587 1.00 0.00 H new ATOM 0 HG22 THR C 5 -1.935 12.369 4.605 1.00 0.00 H new ATOM 0 HG23 THR C 5 -2.696 10.915 3.914 1.00 0.00 H new ATOM 1660 N ASP C 6 -2.043 12.300 8.341 1.00 0.00 N ATOM 1661 CA ASP C 6 -1.022 13.174 8.902 1.00 0.00 C ATOM 1662 C ASP C 6 0.031 12.371 9.657 1.00 0.00 C ATOM 1663 O ASP C 6 1.037 12.918 10.112 1.00 0.00 O ATOM 1664 CB ASP C 6 -1.663 14.189 9.856 1.00 0.00 C ATOM 1665 CG ASP C 6 -2.657 15.110 9.174 1.00 0.00 C ATOM 1666 OD1 ASP C 6 -3.807 14.681 8.926 1.00 0.00 O ATOM 1667 OD2 ASP C 6 -2.303 16.276 8.900 1.00 0.00 O ATOM 0 H ASP C 6 -2.893 12.236 8.901 1.00 0.00 H new ATOM 0 HA ASP C 6 -0.539 13.698 8.077 1.00 0.00 H new ATOM 0 HB2 ASP C 6 -2.168 13.653 10.660 1.00 0.00 H new ATOM 0 HB3 ASP C 6 -0.879 14.790 10.317 1.00 0.00 H new ATOM 1672 N ASP C 7 -0.197 11.068 9.795 1.00 0.00 N ATOM 1673 CA ASP C 7 0.778 10.202 10.451 1.00 0.00 C ATOM 1674 C ASP C 7 1.587 9.425 9.421 1.00 0.00 C ATOM 1675 O ASP C 7 2.473 8.648 9.773 1.00 0.00 O ATOM 1676 CB ASP C 7 0.073 9.199 11.380 1.00 0.00 C ATOM 1677 CG ASP C 7 -0.849 9.849 12.392 1.00 0.00 C ATOM 1678 OD1 ASP C 7 -0.349 10.491 13.336 1.00 0.00 O ATOM 1679 OD2 ASP C 7 -2.085 9.698 12.262 1.00 0.00 O ATOM 0 H ASP C 7 -1.037 10.593 9.466 1.00 0.00 H new ATOM 0 HA ASP C 7 1.443 10.838 11.034 1.00 0.00 H new ATOM 0 HB2 ASP C 7 -0.503 8.499 10.774 1.00 0.00 H new ATOM 0 HB3 ASP C 7 0.827 8.617 11.910 1.00 0.00 H new ATOM 1684 N LEU C 8 1.287 9.643 8.149 1.00 0.00 N ATOM 1685 CA LEU C 8 2.009 8.973 7.073 1.00 0.00 C ATOM 1686 C LEU C 8 2.580 9.976 6.083 1.00 0.00 C ATOM 1687 O LEU C 8 3.624 9.734 5.469 1.00 0.00 O ATOM 1688 CB LEU C 8 1.095 7.989 6.345 1.00 0.00 C ATOM 1689 CG LEU C 8 0.671 6.771 7.163 1.00 0.00 C ATOM 1690 CD1 LEU C 8 -0.308 5.917 6.377 1.00 0.00 C ATOM 1691 CD2 LEU C 8 1.885 5.950 7.561 1.00 0.00 C ATOM 0 H LEU C 8 0.551 10.276 7.835 1.00 0.00 H new ATOM 0 HA LEU C 8 2.837 8.425 7.523 1.00 0.00 H new ATOM 0 HB2 LEU C 8 0.199 8.520 6.022 1.00 0.00 H new ATOM 0 HB3 LEU C 8 1.603 7.644 5.445 1.00 0.00 H new ATOM 0 HG LEU C 8 0.176 7.121 8.069 1.00 0.00 H new ATOM 0 HD11 LEU C 8 -0.599 5.054 6.975 1.00 0.00 H new ATOM 0 HD12 LEU C 8 -1.193 6.506 6.136 1.00 0.00 H new ATOM 0 HD13 LEU C 8 0.164 5.577 5.455 1.00 0.00 H new ATOM 0 HD21 LEU C 8 1.565 5.086 8.143 1.00 0.00 H new ATOM 0 HD22 LEU C 8 2.405 5.611 6.665 1.00 0.00 H new ATOM 0 HD23 LEU C 8 2.558 6.563 8.161 1.00 0.00 H new ATOM 1703 N GLU C 9 1.919 11.117 5.965 1.00 0.00 N ATOM 1704 CA GLU C 9 2.323 12.135 5.012 1.00 0.00 C ATOM 1705 C GLU C 9 2.118 13.520 5.599 1.00 0.00 C ATOM 1706 O GLU C 9 1.211 13.746 6.400 1.00 0.00 O ATOM 1707 CB GLU C 9 1.569 11.996 3.683 1.00 0.00 C ATOM 1708 CG GLU C 9 1.901 10.708 2.947 1.00 0.00 C ATOM 1709 CD GLU C 9 1.390 10.674 1.525 1.00 0.00 C ATOM 1710 OE1 GLU C 9 1.901 11.439 0.688 1.00 0.00 O ATOM 1711 OE2 GLU C 9 0.519 9.831 1.222 1.00 0.00 O ATOM 0 H GLU C 9 1.098 11.360 6.520 1.00 0.00 H new ATOM 0 HA GLU C 9 3.384 11.994 4.805 1.00 0.00 H new ATOM 0 HB2 GLU C 9 0.496 12.033 3.874 1.00 0.00 H new ATOM 0 HB3 GLU C 9 1.809 12.846 3.044 1.00 0.00 H new ATOM 0 HG2 GLU C 9 2.983 10.573 2.939 1.00 0.00 H new ATOM 0 HG3 GLU C 9 1.479 9.866 3.496 1.00 0.00 H new ATOM 1718 N VAL C 10 2.979 14.431 5.205 1.00 0.00 N ATOM 1719 CA VAL C 10 2.953 15.791 5.697 1.00 0.00 C ATOM 1720 C VAL C 10 2.944 16.758 4.518 1.00 0.00 C ATOM 1721 O VAL C 10 3.612 16.527 3.506 1.00 0.00 O ATOM 1722 CB VAL C 10 4.167 16.063 6.622 1.00 0.00 C ATOM 1723 CG1 VAL C 10 5.475 15.707 5.931 1.00 0.00 C ATOM 1724 CG2 VAL C 10 4.188 17.510 7.095 1.00 0.00 C ATOM 0 H VAL C 10 3.722 14.249 4.530 1.00 0.00 H new ATOM 0 HA VAL C 10 2.048 15.940 6.285 1.00 0.00 H new ATOM 0 HB VAL C 10 4.060 15.423 7.498 1.00 0.00 H new ATOM 0 HG11 VAL C 10 6.309 15.908 6.604 1.00 0.00 H new ATOM 0 HG12 VAL C 10 5.470 14.650 5.665 1.00 0.00 H new ATOM 0 HG13 VAL C 10 5.585 16.307 5.028 1.00 0.00 H new ATOM 0 HG21 VAL C 10 5.051 17.669 7.742 1.00 0.00 H new ATOM 0 HG22 VAL C 10 4.253 18.174 6.233 1.00 0.00 H new ATOM 0 HG23 VAL C 10 3.275 17.725 7.650 1.00 0.00 H new ATOM 1734 N ALA C 11 2.156 17.816 4.633 1.00 0.00 N ATOM 1735 CA ALA C 11 2.044 18.803 3.574 1.00 0.00 C ATOM 1736 C ALA C 11 3.362 19.533 3.365 1.00 0.00 C ATOM 1737 O ALA C 11 4.048 19.886 4.325 1.00 0.00 O ATOM 1738 CB ALA C 11 0.933 19.782 3.921 1.00 0.00 C ATOM 0 H ALA C 11 1.583 18.012 5.454 1.00 0.00 H new ATOM 0 HA ALA C 11 1.801 18.297 2.639 1.00 0.00 H new ATOM 0 HB1 ALA C 11 0.844 20.526 3.130 1.00 0.00 H new ATOM 0 HB2 ALA C 11 -0.009 19.243 4.020 1.00 0.00 H new ATOM 0 HB3 ALA C 11 1.167 20.280 4.862 1.00 0.00 H new ATOM 1744 N CYS C 12 3.709 19.735 2.095 1.00 0.00 N ATOM 1745 CA CYS C 12 4.990 20.294 1.689 1.00 0.00 C ATOM 1746 C CYS C 12 5.290 21.695 2.249 1.00 0.00 C ATOM 1747 O CYS C 12 4.412 22.349 2.800 1.00 0.00 O ATOM 1748 CB CYS C 12 5.036 20.341 0.172 1.00 0.00 C ATOM 1749 SG CYS C 12 5.909 18.936 -0.516 1.00 0.00 S ATOM 0 H CYS C 12 3.097 19.511 1.311 1.00 0.00 H new ATOM 0 HA CYS C 12 5.757 19.641 2.106 1.00 0.00 H new ATOM 0 HB2 CYS C 12 4.020 20.364 -0.221 1.00 0.00 H new ATOM 0 HB3 CYS C 12 5.523 21.262 -0.148 1.00 0.00 H new ATOM 0 HG CYS C 12 5.833 18.971 -1.813 1.00 0.00 H new ATOM 1754 N PRO C 13 6.551 22.171 2.109 1.00 0.00 N ATOM 1755 CA PRO C 13 6.938 23.549 2.464 1.00 0.00 C ATOM 1756 C PRO C 13 5.982 24.618 1.920 1.00 0.00 C ATOM 1757 O PRO C 13 5.670 25.596 2.603 1.00 0.00 O ATOM 1758 CB PRO C 13 8.299 23.690 1.783 1.00 0.00 C ATOM 1759 CG PRO C 13 8.889 22.328 1.836 1.00 0.00 C ATOM 1760 CD PRO C 13 7.724 21.380 1.662 1.00 0.00 C ATOM 0 HA PRO C 13 6.933 23.700 3.544 1.00 0.00 H new ATOM 0 HB2 PRO C 13 8.194 24.036 0.755 1.00 0.00 H new ATOM 0 HB3 PRO C 13 8.928 24.415 2.300 1.00 0.00 H new ATOM 0 HG2 PRO C 13 9.630 22.189 1.048 1.00 0.00 H new ATOM 0 HG3 PRO C 13 9.397 22.156 2.785 1.00 0.00 H new ATOM 0 HD2 PRO C 13 7.619 21.062 0.625 1.00 0.00 H new ATOM 0 HD3 PRO C 13 7.850 20.478 2.261 1.00 0.00 H new ATOM 1768 N LYS C 14 5.491 24.399 0.698 1.00 0.00 N ATOM 1769 CA LYS C 14 4.772 25.458 -0.014 1.00 0.00 C ATOM 1770 C LYS C 14 3.901 24.968 -1.181 1.00 0.00 C ATOM 1771 O LYS C 14 3.106 25.747 -1.704 1.00 0.00 O ATOM 1772 CB LYS C 14 5.750 26.524 -0.521 1.00 0.00 C ATOM 1773 CG LYS C 14 6.812 25.980 -1.463 1.00 0.00 C ATOM 1774 CD LYS C 14 7.673 27.087 -2.081 1.00 0.00 C ATOM 1775 CE LYS C 14 6.940 27.849 -3.182 1.00 0.00 C ATOM 1776 NZ LYS C 14 6.046 28.916 -2.654 1.00 0.00 N ATOM 0 H LYS C 14 5.575 23.519 0.190 1.00 0.00 H new ATOM 0 HA LYS C 14 4.088 25.880 0.722 1.00 0.00 H new ATOM 0 HB2 LYS C 14 5.189 27.305 -1.033 1.00 0.00 H new ATOM 0 HB3 LYS C 14 6.240 26.991 0.334 1.00 0.00 H new ATOM 0 HG2 LYS C 14 7.454 25.286 -0.920 1.00 0.00 H new ATOM 0 HG3 LYS C 14 6.330 25.412 -2.259 1.00 0.00 H new ATOM 0 HD2 LYS C 14 7.977 27.785 -1.301 1.00 0.00 H new ATOM 0 HD3 LYS C 14 8.584 26.649 -2.490 1.00 0.00 H new ATOM 0 HE2 LYS C 14 7.671 28.296 -3.856 1.00 0.00 H new ATOM 0 HE3 LYS C 14 6.350 27.147 -3.771 1.00 0.00 H new ATOM 0 HZ1 LYS C 14 6.270 29.819 -3.120 1.00 0.00 H new ATOM 0 HZ2 LYS C 14 5.055 28.665 -2.845 1.00 0.00 H new ATOM 0 HZ3 LYS C 14 6.187 29.011 -1.628 1.00 0.00 H new ATOM 1790 N CYS C 15 4.010 23.706 -1.616 1.00 0.00 N ATOM 1791 CA CYS C 15 3.173 23.282 -2.749 1.00 0.00 C ATOM 1792 C CYS C 15 2.154 22.218 -2.399 1.00 0.00 C ATOM 1793 O CYS C 15 1.856 21.344 -3.216 1.00 0.00 O ATOM 1794 CB CYS C 15 4.055 22.688 -3.841 1.00 0.00 C ATOM 1795 SG CYS C 15 5.139 21.339 -3.263 1.00 0.00 S ATOM 0 H CYS C 15 4.631 22.995 -1.229 1.00 0.00 H new ATOM 0 HA CYS C 15 2.643 24.180 -3.067 1.00 0.00 H new ATOM 0 HB2 CYS C 15 3.420 22.312 -4.643 1.00 0.00 H new ATOM 0 HB3 CYS C 15 4.672 23.479 -4.267 1.00 0.00 H new ATOM 0 HG CYS C 15 4.730 20.210 -3.762 1.00 0.00 H new ATOM 1800 N GLU C 16 1.536 22.356 -1.262 1.00 0.00 N ATOM 1801 CA GLU C 16 0.604 21.362 -0.788 1.00 0.00 C ATOM 1802 C GLU C 16 -0.795 21.688 -1.247 1.00 0.00 C ATOM 1803 O GLU C 16 -1.772 21.324 -0.600 1.00 0.00 O ATOM 1804 CB GLU C 16 0.617 21.299 0.739 1.00 0.00 C ATOM 1805 CG GLU C 16 1.795 22.002 1.386 1.00 0.00 C ATOM 1806 CD GLU C 16 1.586 23.492 1.530 1.00 0.00 C ATOM 1807 OE1 GLU C 16 1.814 24.214 0.549 1.00 0.00 O ATOM 1808 OE2 GLU C 16 1.202 23.948 2.625 1.00 0.00 O ATOM 0 H GLU C 16 1.659 23.153 -0.638 1.00 0.00 H new ATOM 0 HA GLU C 16 0.909 20.398 -1.196 1.00 0.00 H new ATOM 0 HB2 GLU C 16 -0.306 21.740 1.116 1.00 0.00 H new ATOM 0 HB3 GLU C 16 0.620 20.253 1.047 1.00 0.00 H new ATOM 0 HG2 GLU C 16 1.974 21.569 2.370 1.00 0.00 H new ATOM 0 HG3 GLU C 16 2.690 21.822 0.791 1.00 0.00 H new ATOM 1815 N ARG C 17 -0.907 22.358 -2.383 1.00 0.00 N ATOM 1816 CA ARG C 17 -2.193 22.792 -2.868 1.00 0.00 C ATOM 1817 C ARG C 17 -2.141 22.764 -4.391 1.00 0.00 C ATOM 1818 O ARG C 17 -3.170 22.729 -5.062 1.00 0.00 O ATOM 1819 CB ARG C 17 -2.582 24.188 -2.363 1.00 0.00 C ATOM 1820 CG ARG C 17 -1.625 25.306 -2.756 1.00 0.00 C ATOM 1821 CD ARG C 17 -0.536 25.502 -1.715 1.00 0.00 C ATOM 1822 NE ARG C 17 -1.096 25.825 -0.407 1.00 0.00 N ATOM 1823 CZ ARG C 17 -0.425 26.438 0.562 1.00 0.00 C ATOM 1824 NH1 ARG C 17 0.832 26.821 0.371 1.00 0.00 N ATOM 1825 NH2 ARG C 17 -1.012 26.664 1.728 1.00 0.00 N ATOM 0 H ARG C 17 -0.120 22.609 -2.981 1.00 0.00 H new ATOM 0 HA ARG C 17 -2.961 22.119 -2.487 1.00 0.00 H new ATOM 0 HB2 ARG C 17 -3.575 24.431 -2.741 1.00 0.00 H new ATOM 0 HB3 ARG C 17 -2.654 24.157 -1.276 1.00 0.00 H new ATOM 0 HG2 ARG C 17 -1.171 25.075 -3.719 1.00 0.00 H new ATOM 0 HG3 ARG C 17 -2.181 26.235 -2.881 1.00 0.00 H new ATOM 0 HD2 ARG C 17 0.065 24.595 -1.641 1.00 0.00 H new ATOM 0 HD3 ARG C 17 0.133 26.302 -2.033 1.00 0.00 H new ATOM 0 HE ARG C 17 -2.065 25.563 -0.225 1.00 0.00 H new ATOM 0 HH11 ARG C 17 1.288 26.645 -0.524 1.00 0.00 H new ATOM 0 HH12 ARG C 17 1.341 27.291 1.119 1.00 0.00 H new ATOM 0 HH21 ARG C 17 -1.976 26.368 1.880 1.00 0.00 H new ATOM 0 HH22 ARG C 17 -0.500 27.134 2.474 1.00 0.00 H new ATOM 1839 N ALA C 18 -0.910 22.771 -4.935 1.00 0.00 N ATOM 1840 CA ALA C 18 -0.726 22.860 -6.380 1.00 0.00 C ATOM 1841 C ALA C 18 0.258 21.815 -6.905 1.00 0.00 C ATOM 1842 O ALA C 18 0.181 21.406 -8.060 1.00 0.00 O ATOM 1843 CB ALA C 18 -0.271 24.259 -6.772 1.00 0.00 C ATOM 0 H ALA C 18 -0.045 22.717 -4.398 1.00 0.00 H new ATOM 0 HA ALA C 18 -1.692 22.654 -6.840 1.00 0.00 H new ATOM 0 HB1 ALA C 18 -0.138 24.309 -7.853 1.00 0.00 H new ATOM 0 HB2 ALA C 18 -1.023 24.986 -6.465 1.00 0.00 H new ATOM 0 HB3 ALA C 18 0.675 24.485 -6.279 1.00 0.00 H new ATOM 1849 N GLY C 19 1.190 21.387 -6.056 1.00 0.00 N ATOM 1850 CA GLY C 19 2.116 20.340 -6.448 1.00 0.00 C ATOM 1851 C GLY C 19 3.274 20.827 -7.318 1.00 0.00 C ATOM 1852 O GLY C 19 3.877 20.035 -8.036 1.00 0.00 O ATOM 0 H GLY C 19 1.319 21.745 -5.110 1.00 0.00 H new ATOM 0 HA2 GLY C 19 2.521 19.873 -5.550 1.00 0.00 H new ATOM 0 HA3 GLY C 19 1.568 19.569 -6.989 1.00 0.00 H new ATOM 1856 N GLU C 20 3.635 22.105 -7.200 1.00 0.00 N ATOM 1857 CA GLU C 20 4.743 22.667 -7.988 1.00 0.00 C ATOM 1858 C GLU C 20 5.598 23.564 -7.136 1.00 0.00 C ATOM 1859 O GLU C 20 5.177 24.042 -6.085 1.00 0.00 O ATOM 1860 CB GLU C 20 4.305 23.527 -9.177 1.00 0.00 C ATOM 1861 CG GLU C 20 3.339 24.632 -8.786 1.00 0.00 C ATOM 1862 CD GLU C 20 3.134 25.644 -9.887 1.00 0.00 C ATOM 1863 OE1 GLU C 20 2.258 25.428 -10.742 1.00 0.00 O ATOM 1864 OE2 GLU C 20 3.851 26.671 -9.896 1.00 0.00 O ATOM 0 H GLU C 20 3.183 22.770 -6.572 1.00 0.00 H new ATOM 0 HA GLU C 20 5.275 21.790 -8.356 1.00 0.00 H new ATOM 0 HB2 GLU C 20 5.186 23.970 -9.642 1.00 0.00 H new ATOM 0 HB3 GLU C 20 3.835 22.889 -9.926 1.00 0.00 H new ATOM 0 HG2 GLU C 20 2.378 24.191 -8.520 1.00 0.00 H new ATOM 0 HG3 GLU C 20 3.714 25.139 -7.897 1.00 0.00 H new ATOM 1871 N ILE C 21 6.790 23.799 -7.623 1.00 0.00 N ATOM 1872 CA ILE C 21 7.670 24.792 -7.072 1.00 0.00 C ATOM 1873 C ILE C 21 8.150 25.674 -8.198 1.00 0.00 C ATOM 1874 O ILE C 21 8.900 25.218 -9.056 1.00 0.00 O ATOM 1875 CB ILE C 21 8.891 24.159 -6.382 1.00 0.00 C ATOM 1876 CG1 ILE C 21 8.448 23.262 -5.230 1.00 0.00 C ATOM 1877 CG2 ILE C 21 9.850 25.236 -5.891 1.00 0.00 C ATOM 1878 CD1 ILE C 21 7.713 23.990 -4.127 1.00 0.00 C ATOM 0 H ILE C 21 7.179 23.299 -8.423 1.00 0.00 H new ATOM 0 HA ILE C 21 7.121 25.362 -6.322 1.00 0.00 H new ATOM 0 HB ILE C 21 9.418 23.544 -7.111 1.00 0.00 H new ATOM 0 HG12 ILE C 21 7.804 22.475 -5.623 1.00 0.00 H new ATOM 0 HG13 ILE C 21 9.325 22.773 -4.806 1.00 0.00 H new ATOM 0 HG21 ILE C 21 10.706 24.767 -5.406 1.00 0.00 H new ATOM 0 HG22 ILE C 21 10.193 25.831 -6.737 1.00 0.00 H new ATOM 0 HG23 ILE C 21 9.338 25.882 -5.178 1.00 0.00 H new ATOM 0 HD11 ILE C 21 7.433 23.282 -3.347 1.00 0.00 H new ATOM 0 HD12 ILE C 21 8.360 24.758 -3.704 1.00 0.00 H new ATOM 0 HD13 ILE C 21 6.815 24.456 -4.534 1.00 0.00 H new ATOM 1890 N GLU C 22 7.693 26.917 -8.209 1.00 0.00 N ATOM 1891 CA GLU C 22 8.156 27.880 -9.196 1.00 0.00 C ATOM 1892 C GLU C 22 7.817 27.430 -10.616 1.00 0.00 C ATOM 1893 O GLU C 22 8.672 27.440 -11.498 1.00 0.00 O ATOM 1894 CB GLU C 22 9.666 28.007 -9.035 1.00 0.00 C ATOM 1895 CG GLU C 22 10.294 29.183 -9.755 1.00 0.00 C ATOM 1896 CD GLU C 22 11.754 29.351 -9.394 1.00 0.00 C ATOM 1897 OE1 GLU C 22 12.045 29.985 -8.355 1.00 0.00 O ATOM 1898 OE2 GLU C 22 12.616 28.831 -10.130 1.00 0.00 O ATOM 0 H GLU C 22 7.006 27.281 -7.549 1.00 0.00 H new ATOM 0 HA GLU C 22 7.661 28.838 -9.037 1.00 0.00 H new ATOM 0 HB2 GLU C 22 9.897 28.086 -7.973 1.00 0.00 H new ATOM 0 HB3 GLU C 22 10.132 27.090 -9.395 1.00 0.00 H new ATOM 0 HG2 GLU C 22 10.200 29.042 -10.832 1.00 0.00 H new ATOM 0 HG3 GLU C 22 9.751 30.094 -9.505 1.00 0.00 H new ATOM 1905 N GLY C 23 6.582 26.996 -10.840 1.00 0.00 N ATOM 1906 CA GLY C 23 6.210 26.525 -12.163 1.00 0.00 C ATOM 1907 C GLY C 23 6.884 25.223 -12.525 1.00 0.00 C ATOM 1908 O GLY C 23 6.707 24.686 -13.619 1.00 0.00 O ATOM 0 H GLY C 23 5.840 26.961 -10.141 1.00 0.00 H new ATOM 0 HA2 GLY C 23 5.129 26.395 -12.208 1.00 0.00 H new ATOM 0 HA3 GLY C 23 6.471 27.283 -12.902 1.00 0.00 H new ATOM 1912 N THR C 24 7.657 24.732 -11.591 1.00 0.00 N ATOM 1913 CA THR C 24 8.588 23.658 -11.845 1.00 0.00 C ATOM 1914 C THR C 24 8.307 22.457 -10.938 1.00 0.00 C ATOM 1915 O THR C 24 7.834 22.627 -9.811 1.00 0.00 O ATOM 1916 CB THR C 24 9.988 24.257 -11.623 1.00 0.00 C ATOM 1917 OG1 THR C 24 10.384 24.996 -12.784 1.00 0.00 O ATOM 1918 CG2 THR C 24 11.053 23.229 -11.268 1.00 0.00 C ATOM 0 H THR C 24 7.660 25.066 -10.627 1.00 0.00 H new ATOM 0 HA THR C 24 8.497 23.270 -12.860 1.00 0.00 H new ATOM 0 HB THR C 24 9.908 24.915 -10.758 1.00 0.00 H new ATOM 0 HG1 THR C 24 10.031 25.909 -12.727 1.00 0.00 H new ATOM 0 HG21 THR C 24 12.010 23.731 -11.128 1.00 0.00 H new ATOM 0 HG22 THR C 24 10.773 22.718 -10.347 1.00 0.00 H new ATOM 0 HG23 THR C 24 11.139 22.501 -12.075 1.00 0.00 H new ATOM 1926 N PRO C 25 8.547 21.221 -11.430 1.00 0.00 N ATOM 1927 CA PRO C 25 8.303 19.995 -10.657 1.00 0.00 C ATOM 1928 C PRO C 25 9.030 20.018 -9.314 1.00 0.00 C ATOM 1929 O PRO C 25 10.223 20.320 -9.235 1.00 0.00 O ATOM 1930 CB PRO C 25 8.844 18.875 -11.556 1.00 0.00 C ATOM 1931 CG PRO C 25 9.727 19.571 -12.534 1.00 0.00 C ATOM 1932 CD PRO C 25 9.078 20.905 -12.766 1.00 0.00 C ATOM 0 HA PRO C 25 7.249 19.868 -10.411 1.00 0.00 H new ATOM 0 HB2 PRO C 25 9.398 18.136 -10.978 1.00 0.00 H new ATOM 0 HB3 PRO C 25 8.035 18.345 -12.059 1.00 0.00 H new ATOM 0 HG2 PRO C 25 10.737 19.687 -12.140 1.00 0.00 H new ATOM 0 HG3 PRO C 25 9.810 19.006 -13.462 1.00 0.00 H new ATOM 0 HD2 PRO C 25 9.793 21.653 -13.109 1.00 0.00 H new ATOM 0 HD3 PRO C 25 8.289 20.851 -13.517 1.00 0.00 H new ATOM 1940 N CYS C 26 8.280 19.705 -8.275 1.00 0.00 N ATOM 1941 CA CYS C 26 8.752 19.853 -6.909 1.00 0.00 C ATOM 1942 C CYS C 26 9.666 18.703 -6.451 1.00 0.00 C ATOM 1943 O CYS C 26 9.381 17.540 -6.719 1.00 0.00 O ATOM 1944 CB CYS C 26 7.554 19.944 -5.980 1.00 0.00 C ATOM 1945 SG CYS C 26 8.012 20.224 -4.256 1.00 0.00 S ATOM 0 H CYS C 26 7.330 19.342 -8.352 1.00 0.00 H new ATOM 0 HA CYS C 26 9.351 20.763 -6.873 1.00 0.00 H new ATOM 0 HB2 CYS C 26 6.905 20.754 -6.313 1.00 0.00 H new ATOM 0 HB3 CYS C 26 6.976 19.022 -6.051 1.00 0.00 H new ATOM 0 HG CYS C 26 6.945 20.195 -3.513 1.00 0.00 H new ATOM 1950 N PRO C 27 10.758 19.058 -5.721 1.00 0.00 N ATOM 1951 CA PRO C 27 11.778 18.131 -5.186 1.00 0.00 C ATOM 1952 C PRO C 27 11.293 16.718 -4.846 1.00 0.00 C ATOM 1953 O PRO C 27 11.846 15.727 -5.327 1.00 0.00 O ATOM 1954 CB PRO C 27 12.186 18.851 -3.900 1.00 0.00 C ATOM 1955 CG PRO C 27 12.058 20.311 -4.190 1.00 0.00 C ATOM 1956 CD PRO C 27 11.111 20.449 -5.370 1.00 0.00 C ATOM 0 HA PRO C 27 12.558 17.946 -5.925 1.00 0.00 H new ATOM 0 HB2 PRO C 27 11.544 18.560 -3.069 1.00 0.00 H new ATOM 0 HB3 PRO C 27 13.208 18.597 -3.617 1.00 0.00 H new ATOM 0 HG2 PRO C 27 11.672 20.844 -3.321 1.00 0.00 H new ATOM 0 HG3 PRO C 27 13.031 20.744 -4.423 1.00 0.00 H new ATOM 0 HD2 PRO C 27 10.227 21.029 -5.105 1.00 0.00 H new ATOM 0 HD3 PRO C 27 11.589 20.961 -6.205 1.00 0.00 H new ATOM 1964 N ALA C 28 10.248 16.636 -4.035 1.00 0.00 N ATOM 1965 CA ALA C 28 9.853 15.371 -3.425 1.00 0.00 C ATOM 1966 C ALA C 28 8.390 15.041 -3.708 1.00 0.00 C ATOM 1967 O ALA C 28 7.915 13.952 -3.393 1.00 0.00 O ATOM 1968 CB ALA C 28 10.105 15.429 -1.926 1.00 0.00 C ATOM 0 H ALA C 28 9.658 17.429 -3.783 1.00 0.00 H new ATOM 0 HA ALA C 28 10.455 14.576 -3.865 1.00 0.00 H new ATOM 0 HB1 ALA C 28 9.810 14.484 -1.471 1.00 0.00 H new ATOM 0 HB2 ALA C 28 11.165 15.605 -1.742 1.00 0.00 H new ATOM 0 HB3 ALA C 28 9.521 16.240 -1.490 1.00 0.00 H new ATOM 1974 N CYS C 29 7.676 15.986 -4.292 1.00 0.00 N ATOM 1975 CA CYS C 29 6.262 15.800 -4.574 1.00 0.00 C ATOM 1976 C CYS C 29 5.966 16.213 -6.019 1.00 0.00 C ATOM 1977 O CYS C 29 5.765 17.391 -6.309 1.00 0.00 O ATOM 1978 CB CYS C 29 5.419 16.608 -3.559 1.00 0.00 C ATOM 1979 SG CYS C 29 5.502 18.413 -3.761 1.00 0.00 S ATOM 0 H CYS C 29 8.050 16.890 -4.581 1.00 0.00 H new ATOM 0 HA CYS C 29 5.994 14.749 -4.467 1.00 0.00 H new ATOM 0 HB2 CYS C 29 4.378 16.295 -3.642 1.00 0.00 H new ATOM 0 HB3 CYS C 29 5.748 16.354 -2.551 1.00 0.00 H new ATOM 0 HG CYS C 29 6.737 18.772 -3.948 1.00 0.00 H new ATOM 1984 N SER C 30 5.972 15.248 -6.933 1.00 0.00 N ATOM 1985 CA SER C 30 5.770 15.541 -8.349 1.00 0.00 C ATOM 1986 C SER C 30 4.296 15.795 -8.676 1.00 0.00 C ATOM 1987 O SER C 30 3.704 15.100 -9.500 1.00 0.00 O ATOM 1988 CB SER C 30 6.311 14.394 -9.208 1.00 0.00 C ATOM 1989 OG SER C 30 7.666 14.115 -8.898 1.00 0.00 O ATOM 0 H SER C 30 6.114 14.260 -6.721 1.00 0.00 H new ATOM 0 HA SER C 30 6.319 16.454 -8.577 1.00 0.00 H new ATOM 0 HB2 SER C 30 5.707 13.501 -9.048 1.00 0.00 H new ATOM 0 HB3 SER C 30 6.223 14.654 -10.263 1.00 0.00 H new ATOM 0 HG SER C 30 7.985 13.378 -9.460 1.00 0.00 H new ATOM 1995 N GLY C 31 3.706 16.780 -8.007 1.00 0.00 N ATOM 1996 CA GLY C 31 2.353 17.178 -8.321 1.00 0.00 C ATOM 1997 C GLY C 31 1.357 16.405 -7.503 1.00 0.00 C ATOM 1998 O GLY C 31 0.417 15.817 -8.035 1.00 0.00 O ATOM 0 H GLY C 31 4.144 17.308 -7.253 1.00 0.00 H new ATOM 0 HA2 GLY C 31 2.232 18.245 -8.134 1.00 0.00 H new ATOM 0 HA3 GLY C 31 2.160 17.017 -9.382 1.00 0.00 H new ATOM 2002 N LYS C 32 1.572 16.397 -6.198 1.00 0.00 N ATOM 2003 CA LYS C 32 0.789 15.577 -5.295 1.00 0.00 C ATOM 2004 C LYS C 32 0.237 16.451 -4.181 1.00 0.00 C ATOM 2005 O LYS C 32 -0.907 16.304 -3.762 1.00 0.00 O ATOM 2006 CB LYS C 32 1.699 14.501 -4.711 1.00 0.00 C ATOM 2007 CG LYS C 32 2.615 13.892 -5.758 1.00 0.00 C ATOM 2008 CD LYS C 32 3.818 13.219 -5.135 1.00 0.00 C ATOM 2009 CE LYS C 32 3.428 11.957 -4.402 1.00 0.00 C ATOM 2010 NZ LYS C 32 2.836 10.951 -5.330 1.00 0.00 N ATOM 0 H LYS C 32 2.291 16.956 -5.739 1.00 0.00 H new ATOM 0 HA LYS C 32 -0.041 15.110 -5.824 1.00 0.00 H new ATOM 0 HB2 LYS C 32 2.301 14.932 -3.911 1.00 0.00 H new ATOM 0 HB3 LYS C 32 1.089 13.716 -4.264 1.00 0.00 H new ATOM 0 HG2 LYS C 32 2.058 13.165 -6.348 1.00 0.00 H new ATOM 0 HG3 LYS C 32 2.950 14.670 -6.444 1.00 0.00 H new ATOM 0 HD2 LYS C 32 4.545 12.980 -5.911 1.00 0.00 H new ATOM 0 HD3 LYS C 32 4.304 13.907 -4.444 1.00 0.00 H new ATOM 0 HE2 LYS C 32 4.305 11.532 -3.913 1.00 0.00 H new ATOM 0 HE3 LYS C 32 2.711 12.197 -3.617 1.00 0.00 H new ATOM 0 HZ1 LYS C 32 2.751 10.036 -4.842 1.00 0.00 H new ATOM 0 HZ2 LYS C 32 1.894 11.271 -5.633 1.00 0.00 H new ATOM 0 HZ3 LYS C 32 3.450 10.843 -6.163 1.00 0.00 H new ATOM 2024 N GLY C 33 1.084 17.362 -3.696 1.00 0.00 N ATOM 2025 CA GLY C 33 0.703 18.267 -2.654 1.00 0.00 C ATOM 2026 C GLY C 33 1.465 17.966 -1.386 1.00 0.00 C ATOM 2027 O GLY C 33 1.954 18.872 -0.717 1.00 0.00 O ATOM 0 H GLY C 33 2.043 17.478 -4.024 1.00 0.00 H new ATOM 0 HA2 GLY C 33 0.897 19.293 -2.967 1.00 0.00 H new ATOM 0 HA3 GLY C 33 -0.368 18.187 -2.469 1.00 0.00 H new ATOM 2031 N VAL C 34 1.643 16.688 -1.089 1.00 0.00 N ATOM 2032 CA VAL C 34 2.261 16.296 0.171 1.00 0.00 C ATOM 2033 C VAL C 34 3.485 15.410 -0.037 1.00 0.00 C ATOM 2034 O VAL C 34 3.760 14.951 -1.152 1.00 0.00 O ATOM 2035 CB VAL C 34 1.253 15.538 1.068 1.00 0.00 C ATOM 2036 CG1 VAL C 34 0.070 16.418 1.440 1.00 0.00 C ATOM 2037 CG2 VAL C 34 0.765 14.277 0.375 1.00 0.00 C ATOM 0 H VAL C 34 1.373 15.912 -1.694 1.00 0.00 H new ATOM 0 HA VAL C 34 2.576 17.220 0.657 1.00 0.00 H new ATOM 0 HB VAL C 34 1.772 15.261 1.985 1.00 0.00 H new ATOM 0 HG11 VAL C 34 -0.618 15.855 2.070 1.00 0.00 H new ATOM 0 HG12 VAL C 34 0.425 17.294 1.983 1.00 0.00 H new ATOM 0 HG13 VAL C 34 -0.445 16.737 0.534 1.00 0.00 H new ATOM 0 HG21 VAL C 34 0.057 13.758 1.021 1.00 0.00 H new ATOM 0 HG22 VAL C 34 0.274 14.543 -0.561 1.00 0.00 H new ATOM 0 HG23 VAL C 34 1.613 13.625 0.167 1.00 0.00 H new ATOM 2047 N ILE C 35 4.223 15.213 1.047 1.00 0.00 N ATOM 2048 CA ILE C 35 5.365 14.307 1.072 1.00 0.00 C ATOM 2049 C ILE C 35 5.287 13.385 2.288 1.00 0.00 C ATOM 2050 O ILE C 35 4.545 13.647 3.228 1.00 0.00 O ATOM 2051 CB ILE C 35 6.699 15.079 1.105 1.00 0.00 C ATOM 2052 CG1 ILE C 35 6.650 16.189 2.162 1.00 0.00 C ATOM 2053 CG2 ILE C 35 7.010 15.653 -0.267 1.00 0.00 C ATOM 2054 CD1 ILE C 35 7.964 16.916 2.352 1.00 0.00 C ATOM 0 H ILE C 35 4.046 15.678 1.937 1.00 0.00 H new ATOM 0 HA ILE C 35 5.330 13.714 0.158 1.00 0.00 H new ATOM 0 HB ILE C 35 7.497 14.387 1.376 1.00 0.00 H new ATOM 0 HG12 ILE C 35 5.884 16.912 1.880 1.00 0.00 H new ATOM 0 HG13 ILE C 35 6.345 15.756 3.115 1.00 0.00 H new ATOM 0 HG21 ILE C 35 7.955 16.195 -0.229 1.00 0.00 H new ATOM 0 HG22 ILE C 35 7.086 14.842 -0.992 1.00 0.00 H new ATOM 0 HG23 ILE C 35 6.213 16.333 -0.566 1.00 0.00 H new ATOM 0 HD11 ILE C 35 7.847 17.685 3.115 1.00 0.00 H new ATOM 0 HD12 ILE C 35 8.730 16.207 2.666 1.00 0.00 H new ATOM 0 HD13 ILE C 35 8.262 17.380 1.412 1.00 0.00 H new ATOM 2066 N LEU C 36 6.068 12.315 2.263 1.00 0.00 N ATOM 2067 CA LEU C 36 5.968 11.271 3.282 1.00 0.00 C ATOM 2068 C LEU C 36 6.836 11.537 4.505 1.00 0.00 C ATOM 2069 O LEU C 36 7.792 12.310 4.464 1.00 0.00 O ATOM 2070 CB LEU C 36 6.371 9.919 2.689 1.00 0.00 C ATOM 2071 CG LEU C 36 5.637 9.528 1.412 1.00 0.00 C ATOM 2072 CD1 LEU C 36 6.447 9.907 0.180 1.00 0.00 C ATOM 2073 CD2 LEU C 36 5.324 8.048 1.427 1.00 0.00 C ATOM 0 H LEU C 36 6.778 12.144 1.551 1.00 0.00 H new ATOM 0 HA LEU C 36 4.928 11.265 3.607 1.00 0.00 H new ATOM 0 HB2 LEU C 36 7.441 9.934 2.484 1.00 0.00 H new ATOM 0 HB3 LEU C 36 6.201 9.146 3.438 1.00 0.00 H new ATOM 0 HG LEU C 36 4.697 10.079 1.367 1.00 0.00 H new ATOM 0 HD11 LEU C 36 5.901 9.617 -0.718 1.00 0.00 H new ATOM 0 HD12 LEU C 36 6.614 10.984 0.171 1.00 0.00 H new ATOM 0 HD13 LEU C 36 7.407 9.391 0.203 1.00 0.00 H new ATOM 0 HD21 LEU C 36 4.799 7.778 0.511 1.00 0.00 H new ATOM 0 HD22 LEU C 36 6.252 7.480 1.495 1.00 0.00 H new ATOM 0 HD23 LEU C 36 4.695 7.818 2.287 1.00 0.00 H new ATOM 2085 N THR C 37 6.475 10.868 5.594 1.00 0.00 N ATOM 2086 CA THR C 37 7.303 10.803 6.787 1.00 0.00 C ATOM 2087 C THR C 37 7.904 9.402 6.872 1.00 0.00 C ATOM 2088 O THR C 37 7.577 8.558 6.043 1.00 0.00 O ATOM 2089 CB THR C 37 6.490 11.114 8.070 1.00 0.00 C ATOM 2090 OG1 THR C 37 7.341 11.073 9.222 1.00 0.00 O ATOM 2091 CG2 THR C 37 5.346 10.127 8.251 1.00 0.00 C ATOM 0 H THR C 37 5.597 10.355 5.672 1.00 0.00 H new ATOM 0 HA THR C 37 8.088 11.556 6.717 1.00 0.00 H new ATOM 0 HB THR C 37 6.072 12.115 7.961 1.00 0.00 H new ATOM 0 HG1 THR C 37 6.815 11.273 10.024 1.00 0.00 H new ATOM 0 HG21 THR C 37 4.795 10.371 9.159 1.00 0.00 H new ATOM 0 HG22 THR C 37 4.676 10.185 7.393 1.00 0.00 H new ATOM 0 HG23 THR C 37 5.747 9.116 8.331 1.00 0.00 H new ATOM 2099 N ALA C 38 8.757 9.150 7.857 1.00 0.00 N ATOM 2100 CA ALA C 38 9.470 7.873 7.963 1.00 0.00 C ATOM 2101 C ALA C 38 8.529 6.676 7.912 1.00 0.00 C ATOM 2102 O ALA C 38 8.788 5.714 7.189 1.00 0.00 O ATOM 2103 CB ALA C 38 10.299 7.831 9.231 1.00 0.00 C ATOM 0 H ALA C 38 8.976 9.814 8.600 1.00 0.00 H new ATOM 0 HA ALA C 38 10.129 7.805 7.098 1.00 0.00 H new ATOM 0 HB1 ALA C 38 10.821 6.876 9.293 1.00 0.00 H new ATOM 0 HB2 ALA C 38 11.027 8.642 9.217 1.00 0.00 H new ATOM 0 HB3 ALA C 38 9.646 7.944 10.096 1.00 0.00 H new ATOM 2109 N GLN C 39 7.447 6.727 8.682 1.00 0.00 N ATOM 2110 CA GLN C 39 6.452 5.661 8.652 1.00 0.00 C ATOM 2111 C GLN C 39 5.911 5.474 7.238 1.00 0.00 C ATOM 2112 O GLN C 39 5.787 4.350 6.750 1.00 0.00 O ATOM 2113 CB GLN C 39 5.302 5.964 9.608 1.00 0.00 C ATOM 2114 CG GLN C 39 4.423 4.754 9.873 1.00 0.00 C ATOM 2115 CD GLN C 39 3.307 5.031 10.855 1.00 0.00 C ATOM 2116 OE1 GLN C 39 3.435 5.870 11.747 1.00 0.00 O ATOM 2117 NE2 GLN C 39 2.206 4.316 10.699 1.00 0.00 N ATOM 0 H GLN C 39 7.238 7.487 9.329 1.00 0.00 H new ATOM 0 HA GLN C 39 6.939 4.740 8.972 1.00 0.00 H new ATOM 0 HB2 GLN C 39 5.707 6.327 10.553 1.00 0.00 H new ATOM 0 HB3 GLN C 39 4.692 6.767 9.193 1.00 0.00 H new ATOM 0 HG2 GLN C 39 3.993 4.412 8.931 1.00 0.00 H new ATOM 0 HG3 GLN C 39 5.041 3.941 10.255 1.00 0.00 H new ATOM 0 HE21 GLN C 39 2.145 3.632 9.945 1.00 0.00 H new ATOM 0 HE22 GLN C 39 1.418 4.449 11.333 1.00 0.00 H new ATOM 2126 N GLY C 40 5.613 6.587 6.577 1.00 0.00 N ATOM 2127 CA GLY C 40 5.120 6.537 5.218 1.00 0.00 C ATOM 2128 C GLY C 40 6.186 6.073 4.246 1.00 0.00 C ATOM 2129 O GLY C 40 5.885 5.445 3.236 1.00 0.00 O ATOM 0 H GLY C 40 5.706 7.527 6.963 1.00 0.00 H new ATOM 0 HA2 GLY C 40 4.264 5.864 5.167 1.00 0.00 H new ATOM 0 HA3 GLY C 40 4.766 7.525 4.924 1.00 0.00 H new ATOM 2133 N TYR C 41 7.438 6.359 4.567 1.00 0.00 N ATOM 2134 CA TYR C 41 8.552 5.917 3.744 1.00 0.00 C ATOM 2135 C TYR C 41 8.721 4.408 3.816 1.00 0.00 C ATOM 2136 O TYR C 41 9.091 3.773 2.828 1.00 0.00 O ATOM 2137 CB TYR C 41 9.841 6.608 4.202 1.00 0.00 C ATOM 2138 CG TYR C 41 10.100 7.949 3.547 1.00 0.00 C ATOM 2139 CD1 TYR C 41 10.459 8.031 2.209 1.00 0.00 C ATOM 2140 CD2 TYR C 41 9.997 9.130 4.269 1.00 0.00 C ATOM 2141 CE1 TYR C 41 10.703 9.252 1.607 1.00 0.00 C ATOM 2142 CE2 TYR C 41 10.238 10.353 3.676 1.00 0.00 C ATOM 2143 CZ TYR C 41 10.592 10.410 2.346 1.00 0.00 C ATOM 2144 OH TYR C 41 10.829 11.630 1.750 1.00 0.00 O ATOM 0 H TYR C 41 7.708 6.895 5.392 1.00 0.00 H new ATOM 0 HA TYR C 41 8.341 6.187 2.709 1.00 0.00 H new ATOM 0 HB2 TYR C 41 9.800 6.747 5.282 1.00 0.00 H new ATOM 0 HB3 TYR C 41 10.685 5.949 3.997 1.00 0.00 H new ATOM 0 HD1 TYR C 41 10.549 7.125 1.628 1.00 0.00 H new ATOM 0 HD2 TYR C 41 9.723 9.091 5.313 1.00 0.00 H new ATOM 0 HE1 TYR C 41 10.979 9.298 0.564 1.00 0.00 H new ATOM 0 HE2 TYR C 41 10.149 11.262 4.253 1.00 0.00 H new ATOM 0 HH TYR C 41 10.707 12.345 2.409 1.00 0.00 H new ATOM 2154 N THR C 42 8.419 3.827 4.963 1.00 0.00 N ATOM 2155 CA THR C 42 8.450 2.381 5.107 1.00 0.00 C ATOM 2156 C THR C 42 7.282 1.741 4.362 1.00 0.00 C ATOM 2157 O THR C 42 7.403 0.658 3.785 1.00 0.00 O ATOM 2158 CB THR C 42 8.373 1.985 6.589 1.00 0.00 C ATOM 2159 OG1 THR C 42 9.320 2.754 7.335 1.00 0.00 O ATOM 2160 CG2 THR C 42 8.652 0.502 6.776 1.00 0.00 C ATOM 0 H THR C 42 8.150 4.332 5.807 1.00 0.00 H new ATOM 0 HA THR C 42 9.389 2.025 4.683 1.00 0.00 H new ATOM 0 HB THR C 42 7.364 2.187 6.949 1.00 0.00 H new ATOM 0 HG1 THR C 42 9.383 2.401 8.247 1.00 0.00 H new ATOM 0 HG21 THR C 42 8.591 0.251 7.835 1.00 0.00 H new ATOM 0 HG22 THR C 42 7.915 -0.080 6.222 1.00 0.00 H new ATOM 0 HG23 THR C 42 9.651 0.270 6.405 1.00 0.00 H new ATOM 2168 N LEU C 43 6.166 2.452 4.336 1.00 0.00 N ATOM 2169 CA LEU C 43 4.942 1.923 3.763 1.00 0.00 C ATOM 2170 C LEU C 43 4.896 2.174 2.260 1.00 0.00 C ATOM 2171 O LEU C 43 4.137 1.527 1.551 1.00 0.00 O ATOM 2172 CB LEU C 43 3.716 2.551 4.448 1.00 0.00 C ATOM 2173 CG LEU C 43 3.074 1.734 5.588 1.00 0.00 C ATOM 2174 CD1 LEU C 43 4.117 1.298 6.606 1.00 0.00 C ATOM 2175 CD2 LEU C 43 1.992 2.555 6.269 1.00 0.00 C ATOM 0 H LEU C 43 6.084 3.399 4.706 1.00 0.00 H new ATOM 0 HA LEU C 43 4.923 0.846 3.931 1.00 0.00 H new ATOM 0 HB2 LEU C 43 4.008 3.523 4.846 1.00 0.00 H new ATOM 0 HB3 LEU C 43 2.956 2.733 3.688 1.00 0.00 H new ATOM 0 HG LEU C 43 2.628 0.838 5.155 1.00 0.00 H new ATOM 0 HD11 LEU C 43 3.635 0.724 7.398 1.00 0.00 H new ATOM 0 HD12 LEU C 43 4.868 0.679 6.115 1.00 0.00 H new ATOM 0 HD13 LEU C 43 4.596 2.178 7.036 1.00 0.00 H new ATOM 0 HD21 LEU C 43 1.544 1.971 7.073 1.00 0.00 H new ATOM 0 HD22 LEU C 43 2.430 3.464 6.682 1.00 0.00 H new ATOM 0 HD23 LEU C 43 1.225 2.820 5.542 1.00 0.00 H new ATOM 2187 N LEU C 44 5.727 3.090 1.762 1.00 0.00 N ATOM 2188 CA LEU C 44 5.732 3.386 0.338 1.00 0.00 C ATOM 2189 C LEU C 44 6.564 2.353 -0.411 1.00 0.00 C ATOM 2190 O LEU C 44 6.136 1.839 -1.438 1.00 0.00 O ATOM 2191 CB LEU C 44 6.231 4.828 0.064 1.00 0.00 C ATOM 2192 CG LEU C 44 7.747 5.044 -0.148 1.00 0.00 C ATOM 2193 CD1 LEU C 44 8.187 4.652 -1.557 1.00 0.00 C ATOM 2194 CD2 LEU C 44 8.112 6.495 0.096 1.00 0.00 C ATOM 0 H LEU C 44 6.393 3.629 2.316 1.00 0.00 H new ATOM 0 HA LEU C 44 4.708 3.329 -0.030 1.00 0.00 H new ATOM 0 HB2 LEU C 44 5.714 5.197 -0.822 1.00 0.00 H new ATOM 0 HB3 LEU C 44 5.918 5.454 0.900 1.00 0.00 H new ATOM 0 HG LEU C 44 8.264 4.403 0.566 1.00 0.00 H new ATOM 0 HD11 LEU C 44 9.259 4.819 -1.663 1.00 0.00 H new ATOM 0 HD12 LEU C 44 7.966 3.598 -1.727 1.00 0.00 H new ATOM 0 HD13 LEU C 44 7.651 5.258 -2.287 1.00 0.00 H new ATOM 0 HD21 LEU C 44 9.183 6.632 -0.057 1.00 0.00 H new ATOM 0 HD22 LEU C 44 7.562 7.130 -0.598 1.00 0.00 H new ATOM 0 HD23 LEU C 44 7.854 6.768 1.119 1.00 0.00 H new ATOM 2206 N ASP C 45 7.743 2.034 0.112 1.00 0.00 N ATOM 2207 CA ASP C 45 8.656 1.137 -0.584 1.00 0.00 C ATOM 2208 C ASP C 45 8.150 -0.294 -0.521 1.00 0.00 C ATOM 2209 O ASP C 45 8.505 -1.135 -1.349 1.00 0.00 O ATOM 2210 CB ASP C 45 10.063 1.230 0.003 1.00 0.00 C ATOM 2211 CG ASP C 45 11.103 0.652 -0.932 1.00 0.00 C ATOM 2212 OD1 ASP C 45 11.454 1.334 -1.916 1.00 0.00 O ATOM 2213 OD2 ASP C 45 11.569 -0.478 -0.694 1.00 0.00 O ATOM 0 H ASP C 45 8.086 2.380 1.008 1.00 0.00 H new ATOM 0 HA ASP C 45 8.701 1.444 -1.629 1.00 0.00 H new ATOM 0 HB2 ASP C 45 10.301 2.273 0.211 1.00 0.00 H new ATOM 0 HB3 ASP C 45 10.095 0.700 0.955 1.00 0.00 H new ATOM 2218 N PHE C 46 7.285 -0.557 0.445 1.00 0.00 N ATOM 2219 CA PHE C 46 6.608 -1.835 0.535 1.00 0.00 C ATOM 2220 C PHE C 46 5.533 -1.930 -0.524 1.00 0.00 C ATOM 2221 O PHE C 46 5.421 -2.937 -1.219 1.00 0.00 O ATOM 2222 CB PHE C 46 5.965 -1.942 1.918 1.00 0.00 C ATOM 2223 CG PHE C 46 5.200 -3.205 2.171 1.00 0.00 C ATOM 2224 CD1 PHE C 46 5.830 -4.309 2.712 1.00 0.00 C ATOM 2225 CD2 PHE C 46 3.848 -3.283 1.881 1.00 0.00 C ATOM 2226 CE1 PHE C 46 5.129 -5.469 2.960 1.00 0.00 C ATOM 2227 CE2 PHE C 46 3.140 -4.439 2.127 1.00 0.00 C ATOM 2228 CZ PHE C 46 3.783 -5.533 2.666 1.00 0.00 C ATOM 0 H PHE C 46 7.036 0.104 1.181 1.00 0.00 H new ATOM 0 HA PHE C 46 7.324 -2.642 0.382 1.00 0.00 H new ATOM 0 HB2 PHE C 46 6.747 -1.853 2.672 1.00 0.00 H new ATOM 0 HB3 PHE C 46 5.292 -1.095 2.055 1.00 0.00 H new ATOM 0 HD1 PHE C 46 6.884 -4.262 2.943 1.00 0.00 H new ATOM 0 HD2 PHE C 46 3.343 -2.428 1.457 1.00 0.00 H new ATOM 0 HE1 PHE C 46 5.632 -6.326 3.383 1.00 0.00 H new ATOM 0 HE2 PHE C 46 2.086 -4.488 1.899 1.00 0.00 H new ATOM 0 HZ PHE C 46 3.232 -6.442 2.858 1.00 0.00 H new ATOM 2238 N ILE C 47 4.776 -0.867 -0.697 1.00 0.00 N ATOM 2239 CA ILE C 47 3.688 -0.921 -1.638 1.00 0.00 C ATOM 2240 C ILE C 47 4.212 -0.771 -3.063 1.00 0.00 C ATOM 2241 O ILE C 47 3.629 -1.309 -4.002 1.00 0.00 O ATOM 2242 CB ILE C 47 2.580 0.106 -1.303 1.00 0.00 C ATOM 2243 CG1 ILE C 47 3.092 1.555 -1.333 1.00 0.00 C ATOM 2244 CG2 ILE C 47 2.011 -0.217 0.069 1.00 0.00 C ATOM 2245 CD1 ILE C 47 2.923 2.240 -2.668 1.00 0.00 C ATOM 0 H ILE C 47 4.892 0.022 -0.210 1.00 0.00 H new ATOM 0 HA ILE C 47 3.218 -1.901 -1.560 1.00 0.00 H new ATOM 0 HB ILE C 47 1.806 0.030 -2.067 1.00 0.00 H new ATOM 0 HG12 ILE C 47 2.566 2.131 -0.572 1.00 0.00 H new ATOM 0 HG13 ILE C 47 4.148 1.562 -1.064 1.00 0.00 H new ATOM 0 HG21 ILE C 47 1.229 0.500 0.317 1.00 0.00 H new ATOM 0 HG22 ILE C 47 1.592 -1.223 0.061 1.00 0.00 H new ATOM 0 HG23 ILE C 47 2.804 -0.160 0.814 1.00 0.00 H new ATOM 0 HD11 ILE C 47 3.308 3.258 -2.606 1.00 0.00 H new ATOM 0 HD12 ILE C 47 3.473 1.690 -3.432 1.00 0.00 H new ATOM 0 HD13 ILE C 47 1.866 2.268 -2.931 1.00 0.00 H new ATOM 2257 N GLN C 48 5.354 -0.094 -3.197 1.00 0.00 N ATOM 2258 CA GLN C 48 6.123 -0.116 -4.434 1.00 0.00 C ATOM 2259 C GLN C 48 6.374 -1.556 -4.832 1.00 0.00 C ATOM 2260 O GLN C 48 5.885 -2.027 -5.841 1.00 0.00 O ATOM 2261 CB GLN C 48 7.480 0.567 -4.245 1.00 0.00 C ATOM 2262 CG GLN C 48 7.443 2.088 -4.177 1.00 0.00 C ATOM 2263 CD GLN C 48 7.437 2.737 -5.549 1.00 0.00 C ATOM 2264 OE1 GLN C 48 7.955 2.177 -6.517 1.00 0.00 O ATOM 2265 NE2 GLN C 48 6.875 3.931 -5.641 1.00 0.00 N ATOM 0 H GLN C 48 5.765 0.477 -2.458 1.00 0.00 H new ATOM 0 HA GLN C 48 5.557 0.413 -5.201 1.00 0.00 H new ATOM 0 HB2 GLN C 48 7.932 0.190 -3.328 1.00 0.00 H new ATOM 0 HB3 GLN C 48 8.133 0.273 -5.067 1.00 0.00 H new ATOM 0 HG2 GLN C 48 6.555 2.401 -3.628 1.00 0.00 H new ATOM 0 HG3 GLN C 48 8.307 2.443 -3.616 1.00 0.00 H new ATOM 0 HE21 GLN C 48 6.456 4.362 -4.817 1.00 0.00 H new ATOM 0 HE22 GLN C 48 6.860 4.420 -6.536 1.00 0.00 H new ATOM 2274 N LYS C 49 7.039 -2.268 -3.944 1.00 0.00 N ATOM 2275 CA LYS C 49 7.625 -3.564 -4.244 1.00 0.00 C ATOM 2276 C LYS C 49 6.593 -4.691 -4.224 1.00 0.00 C ATOM 2277 O LYS C 49 6.938 -5.856 -4.395 1.00 0.00 O ATOM 2278 CB LYS C 49 8.780 -3.812 -3.255 1.00 0.00 C ATOM 2279 CG LYS C 49 9.572 -5.092 -3.483 1.00 0.00 C ATOM 2280 CD LYS C 49 10.318 -5.519 -2.224 1.00 0.00 C ATOM 2281 CE LYS C 49 11.241 -4.427 -1.696 1.00 0.00 C ATOM 2282 NZ LYS C 49 12.422 -4.210 -2.573 1.00 0.00 N ATOM 0 H LYS C 49 7.191 -1.962 -2.983 1.00 0.00 H new ATOM 0 HA LYS C 49 8.014 -3.556 -5.262 1.00 0.00 H new ATOM 0 HB2 LYS C 49 9.466 -2.967 -3.305 1.00 0.00 H new ATOM 0 HB3 LYS C 49 8.372 -3.832 -2.244 1.00 0.00 H new ATOM 0 HG2 LYS C 49 8.896 -5.889 -3.795 1.00 0.00 H new ATOM 0 HG3 LYS C 49 10.283 -4.941 -4.295 1.00 0.00 H new ATOM 0 HD2 LYS C 49 9.597 -5.787 -1.451 1.00 0.00 H new ATOM 0 HD3 LYS C 49 10.903 -6.413 -2.438 1.00 0.00 H new ATOM 0 HE2 LYS C 49 10.683 -3.495 -1.606 1.00 0.00 H new ATOM 0 HE3 LYS C 49 11.579 -4.694 -0.695 1.00 0.00 H new ATOM 0 HZ1 LYS C 49 13.019 -3.459 -2.172 1.00 0.00 H new ATOM 0 HZ2 LYS C 49 12.972 -5.090 -2.639 1.00 0.00 H new ATOM 0 HZ3 LYS C 49 12.103 -3.929 -3.522 1.00 0.00 H new ATOM 2296 N HIS C 50 5.322 -4.394 -3.982 1.00 0.00 N ATOM 2297 CA HIS C 50 4.362 -5.464 -4.211 1.00 0.00 C ATOM 2298 C HIS C 50 3.359 -5.199 -5.330 1.00 0.00 C ATOM 2299 O HIS C 50 2.581 -6.093 -5.648 1.00 0.00 O ATOM 2300 CB HIS C 50 3.659 -5.787 -2.892 1.00 0.00 C ATOM 2301 CG HIS C 50 4.647 -6.216 -1.854 1.00 0.00 C ATOM 2302 ND1 HIS C 50 5.529 -7.249 -2.059 1.00 0.00 N ATOM 2303 CD2 HIS C 50 4.982 -5.673 -0.667 1.00 0.00 C ATOM 2304 CE1 HIS C 50 6.368 -7.315 -1.050 1.00 0.00 C ATOM 2305 NE2 HIS C 50 6.062 -6.367 -0.187 1.00 0.00 N ATOM 0 H HIS C 50 4.954 -3.501 -3.655 1.00 0.00 H new ATOM 0 HA HIS C 50 4.927 -6.326 -4.565 1.00 0.00 H new ATOM 0 HB2 HIS C 50 3.114 -4.911 -2.541 1.00 0.00 H new ATOM 0 HB3 HIS C 50 2.925 -6.577 -3.050 1.00 0.00 H new ATOM 0 HD1 HIS C 50 5.532 -7.869 -2.869 1.00 0.00 H new ATOM 0 HD2 HIS C 50 4.490 -4.843 -0.183 1.00 0.00 H new ATOM 0 HE1 HIS C 50 7.173 -8.027 -0.945 1.00 0.00 H new ATOM 2314 N LEU C 51 3.385 -4.023 -5.959 1.00 0.00 N ATOM 2315 CA LEU C 51 2.606 -3.830 -7.196 1.00 0.00 C ATOM 2316 C LEU C 51 3.471 -3.290 -8.333 1.00 0.00 C ATOM 2317 O LEU C 51 3.306 -3.679 -9.490 1.00 0.00 O ATOM 2318 CB LEU C 51 1.408 -2.888 -7.003 1.00 0.00 C ATOM 2319 CG LEU C 51 0.374 -3.315 -5.958 1.00 0.00 C ATOM 2320 CD1 LEU C 51 -0.897 -2.487 -6.072 1.00 0.00 C ATOM 2321 CD2 LEU C 51 0.043 -4.782 -6.096 1.00 0.00 C ATOM 0 H LEU C 51 3.917 -3.210 -5.650 1.00 0.00 H new ATOM 0 HA LEU C 51 2.233 -4.820 -7.457 1.00 0.00 H new ATOM 0 HB2 LEU C 51 1.787 -1.904 -6.728 1.00 0.00 H new ATOM 0 HB3 LEU C 51 0.901 -2.778 -7.962 1.00 0.00 H new ATOM 0 HG LEU C 51 0.813 -3.143 -4.975 1.00 0.00 H new ATOM 0 HD11 LEU C 51 -1.613 -2.813 -5.317 1.00 0.00 H new ATOM 0 HD12 LEU C 51 -0.661 -1.434 -5.917 1.00 0.00 H new ATOM 0 HD13 LEU C 51 -1.330 -2.620 -7.064 1.00 0.00 H new ATOM 0 HD21 LEU C 51 -0.694 -5.061 -5.343 1.00 0.00 H new ATOM 0 HD22 LEU C 51 -0.364 -4.971 -7.089 1.00 0.00 H new ATOM 0 HD23 LEU C 51 0.948 -5.374 -5.956 1.00 0.00 H new ATOM 2333 N ASN C 52 4.396 -2.408 -7.999 1.00 0.00 N ATOM 2334 CA ASN C 52 5.171 -1.679 -9.000 1.00 0.00 C ATOM 2335 C ASN C 52 6.605 -2.202 -9.087 1.00 0.00 C ATOM 2336 O ASN C 52 7.230 -2.176 -10.148 1.00 0.00 O ATOM 2337 CB ASN C 52 5.155 -0.185 -8.655 1.00 0.00 C ATOM 2338 CG ASN C 52 4.081 0.574 -9.412 1.00 0.00 C ATOM 2339 OD1 ASN C 52 3.033 0.023 -9.746 1.00 0.00 O ATOM 2340 ND2 ASN C 52 4.332 1.846 -9.688 1.00 0.00 N ATOM 0 H ASN C 52 4.634 -2.175 -7.035 1.00 0.00 H new ATOM 0 HA ASN C 52 4.716 -1.832 -9.979 1.00 0.00 H new ATOM 0 HB2 ASN C 52 4.994 -0.064 -7.584 1.00 0.00 H new ATOM 0 HB3 ASN C 52 6.129 0.248 -8.882 1.00 0.00 H new ATOM 0 HD21 ASN C 52 3.644 2.403 -10.194 1.00 0.00 H new ATOM 0 HD22 ASN C 52 5.213 2.267 -9.394 1.00 0.00 H new ATOM 2347 N LYS C 53 7.110 -2.674 -7.963 1.00 0.00 N ATOM 2348 CA LYS C 53 8.428 -3.268 -7.875 1.00 0.00 C ATOM 2349 C LYS C 53 8.308 -4.775 -7.626 1.00 0.00 C ATOM 2350 O LYS C 53 7.879 -5.494 -8.550 1.00 0.00 O ATOM 2351 CB LYS C 53 9.207 -2.615 -6.731 1.00 0.00 C ATOM 2352 CG LYS C 53 10.328 -1.705 -7.174 1.00 0.00 C ATOM 2353 CD LYS C 53 11.255 -1.420 -6.002 1.00 0.00 C ATOM 2354 CE LYS C 53 10.797 -0.235 -5.173 1.00 0.00 C ATOM 2355 NZ LYS C 53 11.826 0.141 -4.167 1.00 0.00 N ATOM 2356 OXT LYS C 53 8.658 -5.238 -6.522 1.00 0.00 O ATOM 0 H LYS C 53 6.609 -2.655 -7.075 1.00 0.00 H new ATOM 0 HA LYS C 53 8.958 -3.106 -8.814 1.00 0.00 H new ATOM 0 HB2 LYS C 53 8.513 -2.042 -6.116 1.00 0.00 H new ATOM 0 HB3 LYS C 53 9.622 -3.399 -6.097 1.00 0.00 H new ATOM 0 HG2 LYS C 53 10.887 -2.170 -7.986 1.00 0.00 H new ATOM 0 HG3 LYS C 53 9.919 -0.772 -7.561 1.00 0.00 H new ATOM 0 HD2 LYS C 53 11.313 -2.303 -5.366 1.00 0.00 H new ATOM 0 HD3 LYS C 53 12.261 -1.230 -6.377 1.00 0.00 H new ATOM 0 HE2 LYS C 53 10.595 0.614 -5.826 1.00 0.00 H new ATOM 0 HE3 LYS C 53 9.862 -0.479 -4.669 1.00 0.00 H new ATOM 0 HZ1 LYS C 53 11.403 0.771 -3.456 1.00 0.00 H new ATOM 0 HZ2 LYS C 53 12.185 -0.716 -3.700 1.00 0.00 H new ATOM 0 HZ3 LYS C 53 12.611 0.632 -4.640 1.00 0.00 H new