USER MOD reduce.3.24.130724 H: found=0, std=0, add=1056, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 1056 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 Single : A 6 ASN : amide:sc= -6.3! C(o=-6.3!,f=-5.1!) USER MOD Single : A 10 THR OG1 : rot -120:sc= -0.587 USER MOD Single : A 13 TYR OH : rot 131:sc= -0.891! USER MOD Single : A 14 ASN : amide:sc= -5.36! C(o=-5.4!,f=-3.6!) USER MOD Single : A 16 THR OG1 : rot -78:sc= 0.604 USER MOD Single : A 17 ASN : amide:sc= -0.972 K(o=-0.97,f=-3.3!) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 23 GLN : amide:sc= -0.0157 K(o=-0.016,f=-0.83) USER MOD Single : A 27 SER OG : rot 180:sc= -1.34 USER MOD Single : A 28 TYR OH : rot 90:sc= 0.232 USER MOD Single : A 32 THR OG1 : rot 180:sc= -0.0431 USER MOD Single : A 33 SER OG : rot 140:sc= 0.11 USER MOD Single : A 34 SER OG : rot 180:sc= 0.0253 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 THR OG1 : rot -91:sc= -0.372 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 GLN : amide:sc= -1.88! C(o=-1.9!,f=-2.9!) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 GLN : amide:sc= -0.145 K(o=-0.15,f=-2.8!) USER MOD Single : A 63 SER OG : rot 100:sc= 1.09 USER MOD Single : A 64 MET CE :methyl 163:sc= -1.86! (180deg=-2.73!) USER MOD Single : A 66 HIS : no HD1:sc= -4.09! C(o=-4.1!,f=-2.5!) USER MOD Single : B 6 ASN : amide:sc= -6.46! C(o=-6.5!,f=-5.2!) USER MOD Single : B 10 THR OG1 : rot 180:sc= -0.598 USER MOD Single : B 13 TYR OH : rot 131:sc= -0.868! USER MOD Single : B 14 ASN : amide:sc= -5.3! C(o=-5.3!,f=-3.7!) USER MOD Single : B 16 THR OG1 : rot -80:sc= 0.604 USER MOD Single : B 17 ASN : amide:sc= -1.04 K(o=-1,f=-3.2!) USER MOD Single : B 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 21 SER OG : rot 180:sc= 0 USER MOD Single : B 23 GLN : amide:sc= -0.0169 K(o=-0.017,f=-0.87) USER MOD Single : B 27 SER OG : rot 180:sc= -1.36 USER MOD Single : B 28 TYR OH : rot 90:sc= 0.234 USER MOD Single : B 32 THR OG1 : rot 180:sc= -0.0615 USER MOD Single : B 33 SER OG : rot 140:sc= 0.111 USER MOD Single : B 34 SER OG : rot 180:sc= 0.027 USER MOD Single : B 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 45 THR OG1 : rot -91:sc= -0.454 USER MOD Single : B 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 57 GLN : amide:sc= -1.88! C(o=-1.9!,f=-3.1!) USER MOD Single : B 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 61 GLN : amide:sc= -0.141 K(o=-0.14,f=-2.8!) USER MOD Single : B 63 SER OG : rot 97:sc= 1.03 USER MOD Single : B 64 MET CE :methyl 161:sc= -1.87! (180deg=-2.65!) USER MOD Single : B 66 HIS : no HD1:sc= -4.06! C(o=-4.1!,f=-2.5!) USER MOD ----------------------------------------------------------------- ATOM 46 N ALA A 4 65.023 -15.216 -6.543 1.00 0.00 N ATOM 47 CA ALA A 4 64.663 -13.784 -6.345 1.00 0.00 C ATOM 48 C ALA A 4 65.628 -13.155 -5.342 1.00 0.00 C ATOM 49 O ALA A 4 65.227 -12.649 -4.313 1.00 0.00 O ATOM 50 CB ALA A 4 63.234 -13.683 -5.810 1.00 0.00 C ATOM 0 HA ALA A 4 64.729 -13.257 -7.297 1.00 0.00 H new ATOM 0 HB1 ALA A 4 62.973 -12.635 -5.666 1.00 0.00 H new ATOM 0 HB2 ALA A 4 62.545 -14.134 -6.525 1.00 0.00 H new ATOM 0 HB3 ALA A 4 63.164 -14.209 -4.858 1.00 0.00 H new ATOM 56 N ILE A 5 66.899 -13.186 -5.631 1.00 0.00 N ATOM 57 CA ILE A 5 67.890 -12.592 -4.694 1.00 0.00 C ATOM 58 C ILE A 5 68.156 -11.136 -5.080 1.00 0.00 C ATOM 59 O ILE A 5 68.681 -10.366 -4.302 1.00 0.00 O ATOM 60 CB ILE A 5 69.191 -13.386 -4.760 1.00 0.00 C ATOM 61 CG1 ILE A 5 68.965 -14.783 -4.184 1.00 0.00 C ATOM 62 CG2 ILE A 5 70.260 -12.671 -3.946 1.00 0.00 C ATOM 63 CD1 ILE A 5 69.600 -15.822 -5.106 1.00 0.00 C ATOM 0 H ILE A 5 67.294 -13.598 -6.477 1.00 0.00 H new ATOM 0 HA ILE A 5 67.495 -12.627 -3.679 1.00 0.00 H new ATOM 0 HB ILE A 5 69.515 -13.468 -5.797 1.00 0.00 H new ATOM 0 HG12 ILE A 5 69.400 -14.852 -3.187 1.00 0.00 H new ATOM 0 HG13 ILE A 5 67.897 -14.977 -4.080 1.00 0.00 H new ATOM 0 HG21 ILE A 5 71.191 -13.236 -3.991 1.00 0.00 H new ATOM 0 HG22 ILE A 5 70.421 -11.673 -4.354 1.00 0.00 H new ATOM 0 HG23 ILE A 5 69.935 -12.591 -2.909 1.00 0.00 H new ATOM 0 HD11 ILE A 5 69.439 -16.819 -4.696 1.00 0.00 H new ATOM 0 HD12 ILE A 5 69.144 -15.758 -6.094 1.00 0.00 H new ATOM 0 HD13 ILE A 5 70.670 -15.631 -5.187 1.00 0.00 H new ATOM 75 N ASN A 6 67.772 -10.747 -6.255 1.00 0.00 N ATOM 76 CA ASN A 6 67.971 -9.330 -6.662 1.00 0.00 C ATOM 77 C ASN A 6 66.742 -8.557 -6.231 1.00 0.00 C ATOM 78 O ASN A 6 66.022 -8.029 -7.036 1.00 0.00 O ATOM 79 CB ASN A 6 68.149 -9.186 -8.199 1.00 0.00 C ATOM 80 CG ASN A 6 68.030 -10.543 -8.914 1.00 0.00 C ATOM 81 OD1 ASN A 6 69.008 -11.077 -9.397 1.00 0.00 O ATOM 82 ND2 ASN A 6 66.862 -11.130 -8.985 1.00 0.00 N ATOM 0 H ASN A 6 67.329 -11.344 -6.953 1.00 0.00 H new ATOM 0 HA ASN A 6 68.877 -8.949 -6.192 1.00 0.00 H new ATOM 0 HB2 ASN A 6 67.397 -8.501 -8.590 1.00 0.00 H new ATOM 0 HB3 ASN A 6 69.123 -8.746 -8.413 1.00 0.00 H new ATOM 0 HD21 ASN A 6 66.774 -12.036 -9.446 1.00 0.00 H new ATOM 0 HD22 ASN A 6 66.040 -10.682 -8.579 1.00 0.00 H new ATOM 89 N ALA A 7 66.457 -8.552 -4.967 1.00 0.00 N ATOM 90 CA ALA A 7 65.231 -7.868 -4.490 1.00 0.00 C ATOM 91 C ALA A 7 65.572 -6.531 -3.816 1.00 0.00 C ATOM 92 O ALA A 7 66.458 -6.476 -2.986 1.00 0.00 O ATOM 93 CB ALA A 7 64.534 -8.752 -3.459 1.00 0.00 C ATOM 0 H ALA A 7 67.021 -8.993 -4.240 1.00 0.00 H new ATOM 0 HA ALA A 7 64.588 -7.684 -5.351 1.00 0.00 H new ATOM 0 HB1 ALA A 7 63.631 -8.255 -3.104 1.00 0.00 H new ATOM 0 HB2 ALA A 7 64.267 -9.704 -3.917 1.00 0.00 H new ATOM 0 HB3 ALA A 7 65.205 -8.929 -2.618 1.00 0.00 H new ATOM 99 N PRO A 8 64.793 -5.503 -4.124 1.00 0.00 N ATOM 100 CA PRO A 8 64.950 -4.213 -3.471 1.00 0.00 C ATOM 101 C PRO A 8 64.578 -4.390 -2.012 1.00 0.00 C ATOM 102 O PRO A 8 63.416 -4.469 -1.660 1.00 0.00 O ATOM 103 CB PRO A 8 63.957 -3.281 -4.161 1.00 0.00 C ATOM 104 CG PRO A 8 63.180 -4.133 -5.208 1.00 0.00 C ATOM 105 CD PRO A 8 63.736 -5.563 -5.138 1.00 0.00 C ATOM 0 HA PRO A 8 65.963 -3.816 -3.533 1.00 0.00 H new ATOM 0 HB2 PRO A 8 63.271 -2.843 -3.435 1.00 0.00 H new ATOM 0 HB3 PRO A 8 64.477 -2.455 -4.646 1.00 0.00 H new ATOM 0 HG2 PRO A 8 62.112 -4.125 -4.993 1.00 0.00 H new ATOM 0 HG3 PRO A 8 63.306 -3.720 -6.209 1.00 0.00 H new ATOM 0 HD2 PRO A 8 62.960 -6.276 -4.859 1.00 0.00 H new ATOM 0 HD3 PRO A 8 64.131 -5.882 -6.103 1.00 0.00 H new ATOM 113 N VAL A 9 65.539 -4.529 -1.180 1.00 0.00 N ATOM 114 CA VAL A 9 65.254 -4.791 0.244 1.00 0.00 C ATOM 115 C VAL A 9 65.122 -3.467 1.007 1.00 0.00 C ATOM 116 O VAL A 9 66.074 -2.727 1.162 1.00 0.00 O ATOM 117 CB VAL A 9 66.403 -5.608 0.806 1.00 0.00 C ATOM 118 CG1 VAL A 9 67.685 -4.807 0.671 1.00 0.00 C ATOM 119 CG2 VAL A 9 66.143 -5.936 2.267 1.00 0.00 C ATOM 0 H VAL A 9 66.529 -4.473 -1.421 1.00 0.00 H new ATOM 0 HA VAL A 9 64.316 -5.336 0.350 1.00 0.00 H new ATOM 0 HB VAL A 9 66.495 -6.543 0.254 1.00 0.00 H new ATOM 0 HG11 VAL A 9 68.518 -5.384 1.072 1.00 0.00 H new ATOM 0 HG12 VAL A 9 67.868 -4.588 -0.381 1.00 0.00 H new ATOM 0 HG13 VAL A 9 67.591 -3.873 1.225 1.00 0.00 H new ATOM 0 HG21 VAL A 9 66.973 -6.522 2.662 1.00 0.00 H new ATOM 0 HG22 VAL A 9 66.049 -5.011 2.836 1.00 0.00 H new ATOM 0 HG23 VAL A 9 65.220 -6.510 2.352 1.00 0.00 H new ATOM 129 N THR A 10 63.953 -3.163 1.490 1.00 0.00 N ATOM 130 CA THR A 10 63.776 -1.893 2.240 1.00 0.00 C ATOM 131 C THR A 10 64.331 -2.057 3.651 1.00 0.00 C ATOM 132 O THR A 10 63.769 -2.752 4.474 1.00 0.00 O ATOM 133 CB THR A 10 62.292 -1.538 2.314 1.00 0.00 C ATOM 134 OG1 THR A 10 61.726 -1.587 1.012 1.00 0.00 O ATOM 135 CG2 THR A 10 62.142 -0.129 2.886 1.00 0.00 C ATOM 0 H THR A 10 63.115 -3.737 1.398 1.00 0.00 H new ATOM 0 HA THR A 10 64.311 -1.094 1.727 1.00 0.00 H new ATOM 0 HB THR A 10 61.775 -2.251 2.957 1.00 0.00 H new ATOM 0 HG1 THR A 10 61.363 -0.707 0.780 1.00 0.00 H new ATOM 0 HG21 THR A 10 61.085 0.131 2.941 1.00 0.00 H new ATOM 0 HG22 THR A 10 62.577 -0.094 3.885 1.00 0.00 H new ATOM 0 HG23 THR A 10 62.657 0.582 2.240 1.00 0.00 H new ATOM 143 N CYS A 11 65.433 -1.423 3.940 1.00 0.00 N ATOM 144 CA CYS A 11 66.021 -1.548 5.306 1.00 0.00 C ATOM 145 C CYS A 11 66.283 -0.160 5.888 1.00 0.00 C ATOM 146 O CYS A 11 65.746 0.830 5.433 1.00 0.00 O ATOM 147 CB CYS A 11 67.341 -2.318 5.239 1.00 0.00 C ATOM 148 SG CYS A 11 67.117 -3.818 4.260 1.00 0.00 S ATOM 0 H CYS A 11 65.951 -0.826 3.295 1.00 0.00 H new ATOM 0 HA CYS A 11 65.317 -2.085 5.941 1.00 0.00 H new ATOM 0 HB2 CYS A 11 68.116 -1.694 4.794 1.00 0.00 H new ATOM 0 HB3 CYS A 11 67.676 -2.574 6.244 1.00 0.00 H new ATOM 153 N CYS A 12 67.116 -0.084 6.889 1.00 0.00 N ATOM 154 CA CYS A 12 67.433 1.235 7.506 1.00 0.00 C ATOM 155 C CYS A 12 68.948 1.327 7.725 1.00 0.00 C ATOM 156 O CYS A 12 69.693 0.446 7.345 1.00 0.00 O ATOM 157 CB CYS A 12 66.735 1.353 8.865 1.00 0.00 C ATOM 158 SG CYS A 12 65.023 0.793 8.729 1.00 0.00 S ATOM 0 H CYS A 12 67.593 -0.882 7.308 1.00 0.00 H new ATOM 0 HA CYS A 12 67.091 2.034 6.848 1.00 0.00 H new ATOM 0 HB2 CYS A 12 67.264 0.756 9.608 1.00 0.00 H new ATOM 0 HB3 CYS A 12 66.762 2.387 9.209 1.00 0.00 H new ATOM 163 N TYR A 13 69.401 2.363 8.372 1.00 0.00 N ATOM 164 CA TYR A 13 70.863 2.487 8.661 1.00 0.00 C ATOM 165 C TYR A 13 71.043 3.016 10.087 1.00 0.00 C ATOM 166 O TYR A 13 71.896 2.567 10.825 1.00 0.00 O ATOM 167 CB TYR A 13 71.517 3.460 7.670 1.00 0.00 C ATOM 168 CG TYR A 13 71.560 2.840 6.289 1.00 0.00 C ATOM 169 CD1 TYR A 13 71.837 1.459 6.132 1.00 0.00 C ATOM 170 CD2 TYR A 13 71.316 3.641 5.153 1.00 0.00 C ATOM 171 CE1 TYR A 13 71.863 0.887 4.844 1.00 0.00 C ATOM 172 CE2 TYR A 13 71.346 3.065 3.864 1.00 0.00 C ATOM 173 CZ TYR A 13 71.616 1.688 3.711 1.00 0.00 C ATOM 174 OH TYR A 13 71.634 1.124 2.453 1.00 0.00 O ATOM 0 H TYR A 13 68.825 3.132 8.715 1.00 0.00 H new ATOM 0 HA TYR A 13 71.336 1.510 8.560 1.00 0.00 H new ATOM 0 HB2 TYR A 13 70.956 4.394 7.641 1.00 0.00 H new ATOM 0 HB3 TYR A 13 72.527 3.704 8.000 1.00 0.00 H new ATOM 0 HD1 TYR A 13 72.028 0.845 6.999 1.00 0.00 H new ATOM 0 HD2 TYR A 13 71.106 4.694 5.269 1.00 0.00 H new ATOM 0 HE1 TYR A 13 72.072 -0.166 4.725 1.00 0.00 H new ATOM 0 HE2 TYR A 13 71.162 3.679 2.994 1.00 0.00 H new ATOM 0 HH TYR A 13 70.830 1.393 1.962 1.00 0.00 H new ATOM 184 N ASN A 14 70.229 3.956 10.482 1.00 0.00 N ATOM 185 CA ASN A 14 70.328 4.504 11.860 1.00 0.00 C ATOM 186 C ASN A 14 68.985 4.316 12.555 1.00 0.00 C ATOM 187 O ASN A 14 68.115 3.628 12.058 1.00 0.00 O ATOM 188 CB ASN A 14 70.676 5.991 11.795 1.00 0.00 C ATOM 189 CG ASN A 14 72.020 6.163 11.086 1.00 0.00 C ATOM 190 OD1 ASN A 14 73.062 5.977 11.682 1.00 0.00 O ATOM 191 ND2 ASN A 14 72.039 6.511 9.831 1.00 0.00 N ATOM 0 H ASN A 14 69.496 4.369 9.905 1.00 0.00 H new ATOM 0 HA ASN A 14 71.108 3.984 12.416 1.00 0.00 H new ATOM 0 HB2 ASN A 14 69.897 6.536 11.261 1.00 0.00 H new ATOM 0 HB3 ASN A 14 70.726 6.409 12.800 1.00 0.00 H new ATOM 0 HD21 ASN A 14 72.930 6.628 9.348 1.00 0.00 H new ATOM 0 HD22 ASN A 14 71.163 6.667 9.332 1.00 0.00 H new ATOM 198 N PHE A 15 68.802 4.904 13.700 1.00 0.00 N ATOM 199 CA PHE A 15 67.506 4.726 14.408 1.00 0.00 C ATOM 200 C PHE A 15 67.205 5.936 15.296 1.00 0.00 C ATOM 201 O PHE A 15 67.922 6.225 16.231 1.00 0.00 O ATOM 202 CB PHE A 15 67.573 3.468 15.277 1.00 0.00 C ATOM 203 CG PHE A 15 67.933 2.280 14.418 1.00 0.00 C ATOM 204 CD1 PHE A 15 66.968 1.713 13.555 1.00 0.00 C ATOM 205 CD2 PHE A 15 69.234 1.731 14.480 1.00 0.00 C ATOM 206 CE1 PHE A 15 67.305 0.599 12.754 1.00 0.00 C ATOM 207 CE2 PHE A 15 69.571 0.618 13.679 1.00 0.00 C ATOM 208 CZ PHE A 15 68.605 0.051 12.816 1.00 0.00 C ATOM 0 H PHE A 15 69.485 5.495 14.174 1.00 0.00 H new ATOM 0 HA PHE A 15 66.713 4.629 13.666 1.00 0.00 H new ATOM 0 HB2 PHE A 15 68.314 3.597 16.066 1.00 0.00 H new ATOM 0 HB3 PHE A 15 66.613 3.299 15.766 1.00 0.00 H new ATOM 0 HD1 PHE A 15 65.973 2.131 13.508 1.00 0.00 H new ATOM 0 HD2 PHE A 15 69.971 2.163 15.141 1.00 0.00 H new ATOM 0 HE1 PHE A 15 66.568 0.166 12.094 1.00 0.00 H new ATOM 0 HE2 PHE A 15 70.566 0.200 13.725 1.00 0.00 H new ATOM 0 HZ PHE A 15 68.861 -0.801 12.204 1.00 0.00 H new ATOM 218 N THR A 16 66.116 6.627 15.030 1.00 0.00 N ATOM 219 CA THR A 16 65.736 7.801 15.896 1.00 0.00 C ATOM 220 C THR A 16 65.802 7.369 17.362 1.00 0.00 C ATOM 221 O THR A 16 64.895 6.753 17.873 1.00 0.00 O ATOM 222 CB THR A 16 64.294 8.283 15.573 1.00 0.00 C ATOM 223 OG1 THR A 16 63.684 8.787 16.755 1.00 0.00 O ATOM 224 CG2 THR A 16 63.454 7.123 15.030 1.00 0.00 C ATOM 0 H THR A 16 65.478 6.433 14.258 1.00 0.00 H new ATOM 0 HA THR A 16 66.427 8.622 15.704 1.00 0.00 H new ATOM 0 HB THR A 16 64.349 9.068 14.819 1.00 0.00 H new ATOM 0 HG1 THR A 16 63.384 8.039 17.313 1.00 0.00 H new ATOM 0 HG21 THR A 16 62.447 7.476 14.808 1.00 0.00 H new ATOM 0 HG22 THR A 16 63.912 6.737 14.119 1.00 0.00 H new ATOM 0 HG23 THR A 16 63.405 6.329 15.776 1.00 0.00 H new ATOM 232 N ASN A 17 66.876 7.660 18.035 1.00 0.00 N ATOM 233 CA ASN A 17 66.984 7.234 19.455 1.00 0.00 C ATOM 234 C ASN A 17 66.434 8.327 20.372 1.00 0.00 C ATOM 235 O ASN A 17 66.516 8.231 21.580 1.00 0.00 O ATOM 236 CB ASN A 17 68.451 6.964 19.797 1.00 0.00 C ATOM 237 CG ASN A 17 68.553 6.435 21.229 1.00 0.00 C ATOM 238 OD1 ASN A 17 67.580 5.967 21.786 1.00 0.00 O ATOM 239 ND2 ASN A 17 69.698 6.488 21.851 1.00 0.00 N ATOM 0 H ASN A 17 67.679 8.171 17.667 1.00 0.00 H new ATOM 0 HA ASN A 17 66.403 6.323 19.601 1.00 0.00 H new ATOM 0 HB2 ASN A 17 68.870 6.239 19.100 1.00 0.00 H new ATOM 0 HB3 ASN A 17 69.034 7.879 19.694 1.00 0.00 H new ATOM 0 HD21 ASN A 17 69.777 6.136 22.805 1.00 0.00 H new ATOM 0 HD22 ASN A 17 70.515 6.881 21.383 1.00 0.00 H new ATOM 246 N ARG A 18 65.851 9.352 19.816 1.00 0.00 N ATOM 247 CA ARG A 18 65.276 10.422 20.669 1.00 0.00 C ATOM 248 C ARG A 18 63.794 10.138 20.875 1.00 0.00 C ATOM 249 O ARG A 18 63.078 9.838 19.940 1.00 0.00 O ATOM 250 CB ARG A 18 65.448 11.777 19.982 1.00 0.00 C ATOM 251 CG ARG A 18 66.860 12.305 20.242 1.00 0.00 C ATOM 252 CD ARG A 18 67.457 12.832 18.936 1.00 0.00 C ATOM 253 NE ARG A 18 67.629 14.320 19.025 1.00 0.00 N ATOM 254 CZ ARG A 18 68.227 14.871 20.057 1.00 0.00 C ATOM 255 NH1 ARG A 18 68.838 14.115 20.928 1.00 0.00 N ATOM 256 NH2 ARG A 18 68.155 16.163 20.259 1.00 0.00 N ATOM 0 H ARG A 18 65.749 9.493 18.811 1.00 0.00 H new ATOM 0 HA ARG A 18 65.788 10.445 21.631 1.00 0.00 H new ATOM 0 HB2 ARG A 18 65.277 11.678 18.910 1.00 0.00 H new ATOM 0 HB3 ARG A 18 64.709 12.484 20.358 1.00 0.00 H new ATOM 0 HG2 ARG A 18 66.831 13.100 20.987 1.00 0.00 H new ATOM 0 HG3 ARG A 18 67.488 11.511 20.647 1.00 0.00 H new ATOM 0 HD2 ARG A 18 68.419 12.355 18.746 1.00 0.00 H new ATOM 0 HD3 ARG A 18 66.805 12.581 18.099 1.00 0.00 H new ATOM 0 HE ARG A 18 67.276 14.912 18.273 1.00 0.00 H new ATOM 0 HH11 ARG A 18 68.849 13.102 20.805 1.00 0.00 H new ATOM 0 HH12 ARG A 18 69.304 14.537 21.731 1.00 0.00 H new ATOM 0 HH21 ARG A 18 67.631 16.752 19.612 1.00 0.00 H new ATOM 0 HH22 ARG A 18 68.623 16.580 21.063 1.00 0.00 H new ATOM 270 N LYS A 19 63.325 10.211 22.088 1.00 0.00 N ATOM 271 CA LYS A 19 61.885 9.928 22.344 1.00 0.00 C ATOM 272 C LYS A 19 61.025 10.817 21.448 1.00 0.00 C ATOM 273 O LYS A 19 60.705 11.940 21.787 1.00 0.00 O ATOM 274 CB LYS A 19 61.561 10.208 23.813 1.00 0.00 C ATOM 275 CG LYS A 19 62.478 9.369 24.706 1.00 0.00 C ATOM 276 CD LYS A 19 61.772 9.075 26.031 1.00 0.00 C ATOM 277 CE LYS A 19 62.328 7.782 26.630 1.00 0.00 C ATOM 278 NZ LYS A 19 62.952 8.074 27.952 1.00 0.00 N ATOM 0 H LYS A 19 63.874 10.454 22.912 1.00 0.00 H new ATOM 0 HA LYS A 19 61.675 8.882 22.123 1.00 0.00 H new ATOM 0 HB2 LYS A 19 61.694 11.268 24.030 1.00 0.00 H new ATOM 0 HB3 LYS A 19 60.518 9.969 24.018 1.00 0.00 H new ATOM 0 HG2 LYS A 19 62.737 8.436 24.205 1.00 0.00 H new ATOM 0 HG3 LYS A 19 63.411 9.902 24.889 1.00 0.00 H new ATOM 0 HD2 LYS A 19 61.919 9.902 26.725 1.00 0.00 H new ATOM 0 HD3 LYS A 19 60.698 8.981 25.870 1.00 0.00 H new ATOM 0 HE2 LYS A 19 61.529 7.050 26.747 1.00 0.00 H new ATOM 0 HE3 LYS A 19 63.065 7.344 25.957 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 63.330 7.195 28.359 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 63.725 8.758 27.827 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 62.237 8.473 28.593 1.00 0.00 H new ATOM 292 N ILE A 20 60.655 10.321 20.304 1.00 0.00 N ATOM 293 CA ILE A 20 59.828 11.116 19.378 1.00 0.00 C ATOM 294 C ILE A 20 58.377 11.046 19.831 1.00 0.00 C ATOM 295 O ILE A 20 57.823 9.985 20.042 1.00 0.00 O ATOM 296 CB ILE A 20 59.987 10.555 17.948 1.00 0.00 C ATOM 297 CG1 ILE A 20 61.180 11.245 17.277 1.00 0.00 C ATOM 298 CG2 ILE A 20 58.716 10.805 17.114 1.00 0.00 C ATOM 299 CD1 ILE A 20 61.179 10.925 15.786 1.00 0.00 C ATOM 0 H ILE A 20 60.896 9.387 19.973 1.00 0.00 H new ATOM 0 HA ILE A 20 60.146 12.158 19.378 1.00 0.00 H new ATOM 0 HB ILE A 20 60.152 9.479 18.007 1.00 0.00 H new ATOM 0 HG12 ILE A 20 61.123 12.323 17.429 1.00 0.00 H new ATOM 0 HG13 ILE A 20 62.112 10.908 17.732 1.00 0.00 H new ATOM 0 HG21 ILE A 20 58.853 10.401 16.111 1.00 0.00 H new ATOM 0 HG22 ILE A 20 57.866 10.315 17.590 1.00 0.00 H new ATOM 0 HG23 ILE A 20 58.528 11.877 17.050 1.00 0.00 H new ATOM 0 HD11 ILE A 20 62.027 11.415 15.308 1.00 0.00 H new ATOM 0 HD12 ILE A 20 61.257 9.847 15.645 1.00 0.00 H new ATOM 0 HD13 ILE A 20 60.253 11.284 15.338 1.00 0.00 H new ATOM 311 N SER A 21 57.766 12.171 19.976 1.00 0.00 N ATOM 312 CA SER A 21 56.342 12.217 20.409 1.00 0.00 C ATOM 313 C SER A 21 55.514 11.222 19.588 1.00 0.00 C ATOM 314 O SER A 21 55.519 11.249 18.374 1.00 0.00 O ATOM 315 CB SER A 21 55.804 13.625 20.183 1.00 0.00 C ATOM 316 OG SER A 21 54.844 13.932 21.186 1.00 0.00 O ATOM 0 H SER A 21 58.193 13.083 19.812 1.00 0.00 H new ATOM 0 HA SER A 21 56.274 11.953 21.464 1.00 0.00 H new ATOM 0 HB2 SER A 21 56.620 14.347 20.213 1.00 0.00 H new ATOM 0 HB3 SER A 21 55.350 13.698 19.195 1.00 0.00 H new ATOM 0 HG SER A 21 54.499 14.838 21.042 1.00 0.00 H new ATOM 322 N VAL A 22 54.794 10.350 20.243 1.00 0.00 N ATOM 323 CA VAL A 22 53.960 9.369 19.503 1.00 0.00 C ATOM 324 C VAL A 22 53.015 10.117 18.557 1.00 0.00 C ATOM 325 O VAL A 22 52.506 9.561 17.603 1.00 0.00 O ATOM 326 CB VAL A 22 53.141 8.543 20.497 1.00 0.00 C ATOM 327 CG1 VAL A 22 52.256 9.475 21.328 1.00 0.00 C ATOM 328 CG2 VAL A 22 52.259 7.552 19.732 1.00 0.00 C ATOM 0 H VAL A 22 54.750 10.278 21.259 1.00 0.00 H new ATOM 0 HA VAL A 22 54.603 8.706 18.925 1.00 0.00 H new ATOM 0 HB VAL A 22 53.815 7.997 21.157 1.00 0.00 H new ATOM 0 HG11 VAL A 22 51.672 8.887 22.036 1.00 0.00 H new ATOM 0 HG12 VAL A 22 52.882 10.182 21.872 1.00 0.00 H new ATOM 0 HG13 VAL A 22 51.582 10.021 20.668 1.00 0.00 H new ATOM 0 HG21 VAL A 22 51.675 6.963 20.440 1.00 0.00 H new ATOM 0 HG22 VAL A 22 51.585 8.099 19.072 1.00 0.00 H new ATOM 0 HG23 VAL A 22 52.888 6.888 19.139 1.00 0.00 H new ATOM 338 N GLN A 23 52.781 11.378 18.811 1.00 0.00 N ATOM 339 CA GLN A 23 51.893 12.161 17.944 1.00 0.00 C ATOM 340 C GLN A 23 52.563 12.330 16.588 1.00 0.00 C ATOM 341 O GLN A 23 51.951 12.175 15.550 1.00 0.00 O ATOM 342 CB GLN A 23 51.634 13.534 18.610 1.00 0.00 C ATOM 343 CG GLN A 23 52.149 14.694 17.734 1.00 0.00 C ATOM 344 CD GLN A 23 51.727 16.029 18.350 1.00 0.00 C ATOM 345 OE1 GLN A 23 50.624 16.162 18.842 1.00 0.00 O ATOM 346 NE2 GLN A 23 52.564 17.030 18.344 1.00 0.00 N ATOM 0 H GLN A 23 53.179 11.893 19.596 1.00 0.00 H new ATOM 0 HA GLN A 23 50.938 11.656 17.802 1.00 0.00 H new ATOM 0 HB2 GLN A 23 50.566 13.658 18.788 1.00 0.00 H new ATOM 0 HB3 GLN A 23 52.125 13.566 19.583 1.00 0.00 H new ATOM 0 HG2 GLN A 23 53.235 14.647 17.652 1.00 0.00 H new ATOM 0 HG3 GLN A 23 51.749 14.606 16.724 1.00 0.00 H new ATOM 0 HE21 GLN A 23 53.490 16.918 17.931 1.00 0.00 H new ATOM 0 HE22 GLN A 23 52.292 17.924 18.752 1.00 0.00 H new ATOM 355 N ARG A 24 53.820 12.665 16.594 1.00 0.00 N ATOM 356 CA ARG A 24 54.532 12.865 15.320 1.00 0.00 C ATOM 357 C ARG A 24 54.446 11.605 14.492 1.00 0.00 C ATOM 358 O ARG A 24 54.448 11.641 13.282 1.00 0.00 O ATOM 359 CB ARG A 24 56.003 13.180 15.593 1.00 0.00 C ATOM 360 CG ARG A 24 56.106 14.377 16.526 1.00 0.00 C ATOM 361 CD ARG A 24 56.322 15.644 15.703 1.00 0.00 C ATOM 362 NE ARG A 24 57.751 16.068 15.808 1.00 0.00 N ATOM 363 CZ ARG A 24 58.119 17.274 15.433 1.00 0.00 C ATOM 364 NH1 ARG A 24 57.237 18.128 14.970 1.00 0.00 N ATOM 365 NH2 ARG A 24 59.373 17.624 15.523 1.00 0.00 N ATOM 0 H ARG A 24 54.381 12.808 17.434 1.00 0.00 H new ATOM 0 HA ARG A 24 54.074 13.695 14.782 1.00 0.00 H new ATOM 0 HB2 ARG A 24 56.493 12.315 16.040 1.00 0.00 H new ATOM 0 HB3 ARG A 24 56.520 13.391 14.657 1.00 0.00 H new ATOM 0 HG2 ARG A 24 55.197 14.467 17.121 1.00 0.00 H new ATOM 0 HG3 ARG A 24 56.932 14.238 17.224 1.00 0.00 H new ATOM 0 HD2 ARG A 24 56.061 15.462 14.660 1.00 0.00 H new ATOM 0 HD3 ARG A 24 55.668 16.439 16.061 1.00 0.00 H new ATOM 0 HE ARG A 24 58.446 15.417 16.173 1.00 0.00 H new ATOM 0 HH11 ARG A 24 56.256 17.859 14.898 1.00 0.00 H new ATOM 0 HH12 ARG A 24 57.533 19.061 14.682 1.00 0.00 H new ATOM 0 HH21 ARG A 24 60.062 16.964 15.883 1.00 0.00 H new ATOM 0 HH22 ARG A 24 59.664 18.558 15.234 1.00 0.00 H new ATOM 379 N LEU A 25 54.394 10.489 15.137 1.00 0.00 N ATOM 380 CA LEU A 25 54.347 9.210 14.402 1.00 0.00 C ATOM 381 C LEU A 25 52.998 9.037 13.724 1.00 0.00 C ATOM 382 O LEU A 25 52.041 8.577 14.316 1.00 0.00 O ATOM 383 CB LEU A 25 54.587 8.064 15.372 1.00 0.00 C ATOM 384 CG LEU A 25 55.885 8.325 16.156 1.00 0.00 C ATOM 385 CD1 LEU A 25 56.230 7.103 16.997 1.00 0.00 C ATOM 386 CD2 LEU A 25 57.036 8.604 15.182 1.00 0.00 C ATOM 0 H LEU A 25 54.382 10.405 16.153 1.00 0.00 H new ATOM 0 HA LEU A 25 55.122 9.211 13.636 1.00 0.00 H new ATOM 0 HB2 LEU A 25 53.746 7.972 16.059 1.00 0.00 H new ATOM 0 HB3 LEU A 25 54.660 7.122 14.829 1.00 0.00 H new ATOM 0 HG LEU A 25 55.739 9.189 16.804 1.00 0.00 H new ATOM 0 HD11 LEU A 25 57.150 7.291 17.551 1.00 0.00 H new ATOM 0 HD12 LEU A 25 55.419 6.902 17.697 1.00 0.00 H new ATOM 0 HD13 LEU A 25 56.369 6.240 16.345 1.00 0.00 H new ATOM 0 HD21 LEU A 25 57.952 8.788 15.744 1.00 0.00 H new ATOM 0 HD22 LEU A 25 57.177 7.742 14.530 1.00 0.00 H new ATOM 0 HD23 LEU A 25 56.798 9.480 14.579 1.00 0.00 H new ATOM 398 N ALA A 26 52.918 9.399 12.481 1.00 0.00 N ATOM 399 CA ALA A 26 51.641 9.259 11.743 1.00 0.00 C ATOM 400 C ALA A 26 51.387 7.789 11.402 1.00 0.00 C ATOM 401 O ALA A 26 50.287 7.405 11.054 1.00 0.00 O ATOM 402 CB ALA A 26 51.723 10.054 10.446 1.00 0.00 C ATOM 0 H ALA A 26 53.689 9.789 11.940 1.00 0.00 H new ATOM 0 HA ALA A 26 50.829 9.632 12.367 1.00 0.00 H new ATOM 0 HB1 ALA A 26 50.786 9.955 9.898 1.00 0.00 H new ATOM 0 HB2 ALA A 26 51.900 11.105 10.674 1.00 0.00 H new ATOM 0 HB3 ALA A 26 52.542 9.672 9.836 1.00 0.00 H new ATOM 408 N SER A 27 52.393 6.971 11.477 1.00 0.00 N ATOM 409 CA SER A 27 52.212 5.534 11.132 1.00 0.00 C ATOM 410 C SER A 27 53.482 4.768 11.491 1.00 0.00 C ATOM 411 O SER A 27 54.447 5.336 11.961 1.00 0.00 O ATOM 412 CB SER A 27 51.938 5.397 9.634 1.00 0.00 C ATOM 413 OG SER A 27 52.362 6.579 8.967 1.00 0.00 O ATOM 0 H SER A 27 53.336 7.233 11.763 1.00 0.00 H new ATOM 0 HA SER A 27 51.369 5.127 11.690 1.00 0.00 H new ATOM 0 HB2 SER A 27 52.466 4.531 9.234 1.00 0.00 H new ATOM 0 HB3 SER A 27 50.875 5.230 9.461 1.00 0.00 H new ATOM 0 HG SER A 27 52.189 6.493 8.006 1.00 0.00 H new ATOM 419 N TYR A 28 53.485 3.478 11.298 1.00 0.00 N ATOM 420 CA TYR A 28 54.690 2.687 11.658 1.00 0.00 C ATOM 421 C TYR A 28 54.770 1.426 10.765 1.00 0.00 C ATOM 422 O TYR A 28 53.779 0.770 10.511 1.00 0.00 O ATOM 423 CB TYR A 28 54.591 2.330 13.166 1.00 0.00 C ATOM 424 CG TYR A 28 54.603 0.838 13.396 1.00 0.00 C ATOM 425 CD1 TYR A 28 53.395 0.113 13.354 1.00 0.00 C ATOM 426 CD2 TYR A 28 55.817 0.180 13.676 1.00 0.00 C ATOM 427 CE1 TYR A 28 53.399 -1.276 13.590 1.00 0.00 C ATOM 428 CE2 TYR A 28 55.825 -1.209 13.913 1.00 0.00 C ATOM 429 CZ TYR A 28 54.614 -1.940 13.871 1.00 0.00 C ATOM 430 OH TYR A 28 54.618 -3.300 14.102 1.00 0.00 O ATOM 0 H TYR A 28 52.709 2.942 10.909 1.00 0.00 H new ATOM 0 HA TYR A 28 55.604 3.256 11.490 1.00 0.00 H new ATOM 0 HB2 TYR A 28 55.423 2.786 13.702 1.00 0.00 H new ATOM 0 HB3 TYR A 28 53.676 2.753 13.579 1.00 0.00 H new ATOM 0 HD1 TYR A 28 52.467 0.622 13.141 1.00 0.00 H new ATOM 0 HD2 TYR A 28 56.740 0.739 13.709 1.00 0.00 H new ATOM 0 HE1 TYR A 28 52.474 -1.833 13.556 1.00 0.00 H new ATOM 0 HE2 TYR A 28 56.755 -1.715 14.127 1.00 0.00 H new ATOM 0 HH TYR A 28 54.743 -3.775 13.254 1.00 0.00 H new ATOM 440 N ARG A 29 55.947 1.090 10.297 1.00 0.00 N ATOM 441 CA ARG A 29 56.098 -0.120 9.431 1.00 0.00 C ATOM 442 C ARG A 29 57.343 -0.899 9.869 1.00 0.00 C ATOM 443 O ARG A 29 58.421 -0.716 9.340 1.00 0.00 O ATOM 444 CB ARG A 29 56.249 0.310 7.971 1.00 0.00 C ATOM 445 CG ARG A 29 54.905 0.170 7.256 1.00 0.00 C ATOM 446 CD ARG A 29 55.035 0.673 5.817 1.00 0.00 C ATOM 447 NE ARG A 29 54.255 -0.218 4.906 1.00 0.00 N ATOM 448 CZ ARG A 29 54.437 -0.168 3.605 1.00 0.00 C ATOM 449 NH1 ARG A 29 55.302 0.668 3.083 1.00 0.00 N ATOM 450 NH2 ARG A 29 53.750 -0.957 2.825 1.00 0.00 N ATOM 0 H ARG A 29 56.810 1.602 10.478 1.00 0.00 H new ATOM 0 HA ARG A 29 55.216 -0.753 9.529 1.00 0.00 H new ATOM 0 HB2 ARG A 29 56.595 1.342 7.919 1.00 0.00 H new ATOM 0 HB3 ARG A 29 57.002 -0.304 7.476 1.00 0.00 H new ATOM 0 HG2 ARG A 29 54.586 -0.872 7.260 1.00 0.00 H new ATOM 0 HG3 ARG A 29 54.140 0.740 7.783 1.00 0.00 H new ATOM 0 HD2 ARG A 29 54.668 1.697 5.744 1.00 0.00 H new ATOM 0 HD3 ARG A 29 56.083 0.688 5.519 1.00 0.00 H new ATOM 0 HE ARG A 29 53.575 -0.871 5.297 1.00 0.00 H new ATOM 0 HH11 ARG A 29 55.841 1.288 3.688 1.00 0.00 H new ATOM 0 HH12 ARG A 29 55.436 0.699 2.072 1.00 0.00 H new ATOM 0 HH21 ARG A 29 53.075 -1.609 3.225 1.00 0.00 H new ATOM 0 HH22 ARG A 29 53.888 -0.922 1.815 1.00 0.00 H new ATOM 464 N ARG A 30 57.205 -1.745 10.851 1.00 0.00 N ATOM 465 CA ARG A 30 58.382 -2.510 11.359 1.00 0.00 C ATOM 466 C ARG A 30 59.094 -3.241 10.217 1.00 0.00 C ATOM 467 O ARG A 30 58.615 -4.232 9.704 1.00 0.00 O ATOM 468 CB ARG A 30 57.918 -3.529 12.400 1.00 0.00 C ATOM 469 CG ARG A 30 58.934 -3.576 13.542 1.00 0.00 C ATOM 470 CD ARG A 30 58.510 -4.625 14.567 1.00 0.00 C ATOM 471 NE ARG A 30 57.207 -4.229 15.178 1.00 0.00 N ATOM 472 CZ ARG A 30 56.779 -4.812 16.277 1.00 0.00 C ATOM 473 NH1 ARG A 30 57.495 -5.752 16.832 1.00 0.00 N ATOM 474 NH2 ARG A 30 55.641 -4.456 16.822 1.00 0.00 N ATOM 0 H ARG A 30 56.325 -1.942 11.327 1.00 0.00 H new ATOM 0 HA ARG A 30 59.081 -1.806 11.811 1.00 0.00 H new ATOM 0 HB2 ARG A 30 56.935 -3.255 12.782 1.00 0.00 H new ATOM 0 HB3 ARG A 30 57.819 -4.514 11.944 1.00 0.00 H new ATOM 0 HG2 ARG A 30 59.923 -3.815 13.152 1.00 0.00 H new ATOM 0 HG3 ARG A 30 59.006 -2.598 14.017 1.00 0.00 H new ATOM 0 HD2 ARG A 30 58.417 -5.600 14.088 1.00 0.00 H new ATOM 0 HD3 ARG A 30 59.272 -4.721 15.341 1.00 0.00 H new ATOM 0 HE ARG A 30 56.644 -3.500 14.740 1.00 0.00 H new ATOM 0 HH11 ARG A 30 58.382 -6.032 16.414 1.00 0.00 H new ATOM 0 HH12 ARG A 30 57.167 -6.207 17.684 1.00 0.00 H new ATOM 0 HH21 ARG A 30 55.078 -3.721 16.394 1.00 0.00 H new ATOM 0 HH22 ARG A 30 55.318 -4.914 17.674 1.00 0.00 H new ATOM 488 N ILE A 31 60.264 -2.781 9.850 1.00 0.00 N ATOM 489 CA ILE A 31 61.042 -3.470 8.782 1.00 0.00 C ATOM 490 C ILE A 31 61.607 -4.777 9.356 1.00 0.00 C ATOM 491 O ILE A 31 61.956 -4.855 10.517 1.00 0.00 O ATOM 492 CB ILE A 31 62.202 -2.553 8.319 1.00 0.00 C ATOM 493 CG1 ILE A 31 61.688 -1.577 7.260 1.00 0.00 C ATOM 494 CG2 ILE A 31 63.346 -3.391 7.719 1.00 0.00 C ATOM 495 CD1 ILE A 31 62.825 -0.643 6.836 1.00 0.00 C ATOM 0 H ILE A 31 60.713 -1.955 10.247 1.00 0.00 H new ATOM 0 HA ILE A 31 60.401 -3.689 7.928 1.00 0.00 H new ATOM 0 HB ILE A 31 62.579 -2.004 9.182 1.00 0.00 H new ATOM 0 HG12 ILE A 31 61.311 -2.125 6.396 1.00 0.00 H new ATOM 0 HG13 ILE A 31 60.855 -0.997 7.657 1.00 0.00 H new ATOM 0 HG21 ILE A 31 64.152 -2.730 7.399 1.00 0.00 H new ATOM 0 HG22 ILE A 31 63.722 -4.085 8.471 1.00 0.00 H new ATOM 0 HG23 ILE A 31 62.975 -3.952 6.861 1.00 0.00 H new ATOM 0 HD11 ILE A 31 62.461 0.054 6.081 1.00 0.00 H new ATOM 0 HD12 ILE A 31 63.181 -0.086 7.703 1.00 0.00 H new ATOM 0 HD13 ILE A 31 63.644 -1.231 6.422 1.00 0.00 H new ATOM 507 N THR A 32 61.716 -5.794 8.550 1.00 0.00 N ATOM 508 CA THR A 32 62.278 -7.079 9.049 1.00 0.00 C ATOM 509 C THR A 32 62.483 -8.036 7.877 1.00 0.00 C ATOM 510 O THR A 32 62.382 -9.239 8.021 1.00 0.00 O ATOM 511 CB THR A 32 61.316 -7.703 10.058 1.00 0.00 C ATOM 512 OG1 THR A 32 60.001 -7.214 9.826 1.00 0.00 O ATOM 513 CG2 THR A 32 61.759 -7.339 11.473 1.00 0.00 C ATOM 0 H THR A 32 61.441 -5.792 7.568 1.00 0.00 H new ATOM 0 HA THR A 32 63.236 -6.890 9.534 1.00 0.00 H new ATOM 0 HB THR A 32 61.321 -8.787 9.945 1.00 0.00 H new ATOM 0 HG1 THR A 32 59.384 -7.616 10.473 1.00 0.00 H new ATOM 0 HG21 THR A 32 61.074 -7.784 12.195 1.00 0.00 H new ATOM 0 HG22 THR A 32 62.766 -7.718 11.648 1.00 0.00 H new ATOM 0 HG23 THR A 32 61.754 -6.255 11.588 1.00 0.00 H new ATOM 521 N SER A 33 62.782 -7.516 6.719 1.00 0.00 N ATOM 522 CA SER A 33 63.005 -8.401 5.547 1.00 0.00 C ATOM 523 C SER A 33 64.137 -9.378 5.868 1.00 0.00 C ATOM 524 O SER A 33 65.001 -9.098 6.676 1.00 0.00 O ATOM 525 CB SER A 33 63.386 -7.553 4.331 1.00 0.00 C ATOM 526 OG SER A 33 63.906 -8.397 3.312 1.00 0.00 O ATOM 0 H SER A 33 62.881 -6.517 6.536 1.00 0.00 H new ATOM 0 HA SER A 33 62.094 -8.956 5.325 1.00 0.00 H new ATOM 0 HB2 SER A 33 62.514 -7.014 3.962 1.00 0.00 H new ATOM 0 HB3 SER A 33 64.127 -6.805 4.613 1.00 0.00 H new ATOM 0 HG SER A 33 63.573 -8.100 2.440 1.00 0.00 H new ATOM 532 N SER A 34 64.140 -10.525 5.249 1.00 0.00 N ATOM 533 CA SER A 34 65.215 -11.519 5.527 1.00 0.00 C ATOM 534 C SER A 34 66.551 -11.021 4.958 1.00 0.00 C ATOM 535 O SER A 34 67.587 -11.613 5.182 1.00 0.00 O ATOM 536 CB SER A 34 64.852 -12.854 4.876 1.00 0.00 C ATOM 537 OG SER A 34 64.358 -12.619 3.564 1.00 0.00 O ATOM 0 H SER A 34 63.445 -10.818 4.562 1.00 0.00 H new ATOM 0 HA SER A 34 65.312 -11.649 6.605 1.00 0.00 H new ATOM 0 HB2 SER A 34 65.727 -13.502 4.836 1.00 0.00 H new ATOM 0 HB3 SER A 34 64.100 -13.370 5.473 1.00 0.00 H new ATOM 0 HG SER A 34 64.126 -13.473 3.144 1.00 0.00 H new ATOM 543 N LYS A 35 66.537 -9.945 4.213 1.00 0.00 N ATOM 544 CA LYS A 35 67.806 -9.430 3.628 1.00 0.00 C ATOM 545 C LYS A 35 68.286 -8.192 4.402 1.00 0.00 C ATOM 546 O LYS A 35 69.410 -7.756 4.250 1.00 0.00 O ATOM 547 CB LYS A 35 67.572 -9.063 2.156 1.00 0.00 C ATOM 548 CG LYS A 35 68.516 -9.877 1.258 1.00 0.00 C ATOM 549 CD LYS A 35 69.960 -9.733 1.752 1.00 0.00 C ATOM 550 CE LYS A 35 70.921 -9.861 0.568 1.00 0.00 C ATOM 551 NZ LYS A 35 71.463 -11.247 0.515 1.00 0.00 N ATOM 0 H LYS A 35 65.703 -9.404 3.986 1.00 0.00 H new ATOM 0 HA LYS A 35 68.572 -10.203 3.697 1.00 0.00 H new ATOM 0 HB2 LYS A 35 66.535 -9.261 1.883 1.00 0.00 H new ATOM 0 HB3 LYS A 35 67.743 -7.997 2.006 1.00 0.00 H new ATOM 0 HG2 LYS A 35 68.223 -10.927 1.265 1.00 0.00 H new ATOM 0 HG3 LYS A 35 68.439 -9.531 0.227 1.00 0.00 H new ATOM 0 HD2 LYS A 35 70.094 -8.767 2.240 1.00 0.00 H new ATOM 0 HD3 LYS A 35 70.179 -10.499 2.496 1.00 0.00 H new ATOM 0 HE2 LYS A 35 70.403 -9.626 -0.362 1.00 0.00 H new ATOM 0 HE3 LYS A 35 71.736 -9.144 0.668 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 72.116 -11.334 -0.290 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 71.972 -11.455 1.398 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 70.680 -11.922 0.400 1.00 0.00 H new ATOM 565 N CYS A 36 67.451 -7.622 5.234 1.00 0.00 N ATOM 566 CA CYS A 36 67.882 -6.413 6.006 1.00 0.00 C ATOM 567 C CYS A 36 68.831 -6.833 7.140 1.00 0.00 C ATOM 568 O CYS A 36 68.523 -7.730 7.900 1.00 0.00 O ATOM 569 CB CYS A 36 66.656 -5.710 6.599 1.00 0.00 C ATOM 570 SG CYS A 36 65.727 -4.880 5.279 1.00 0.00 S ATOM 0 H CYS A 36 66.497 -7.937 5.412 1.00 0.00 H new ATOM 0 HA CYS A 36 68.400 -5.728 5.335 1.00 0.00 H new ATOM 0 HB2 CYS A 36 66.018 -6.435 7.105 1.00 0.00 H new ATOM 0 HB3 CYS A 36 66.969 -4.983 7.349 1.00 0.00 H new ATOM 575 N PRO A 37 69.973 -6.164 7.219 1.00 0.00 N ATOM 576 CA PRO A 37 70.970 -6.458 8.242 1.00 0.00 C ATOM 577 C PRO A 37 70.414 -6.172 9.634 1.00 0.00 C ATOM 578 O PRO A 37 70.912 -6.669 10.626 1.00 0.00 O ATOM 579 CB PRO A 37 72.137 -5.506 7.944 1.00 0.00 C ATOM 580 CG PRO A 37 71.724 -4.618 6.734 1.00 0.00 C ATOM 581 CD PRO A 37 70.335 -5.084 6.287 1.00 0.00 C ATOM 0 HA PRO A 37 71.269 -7.506 8.225 1.00 0.00 H new ATOM 0 HB2 PRO A 37 72.359 -4.888 8.814 1.00 0.00 H new ATOM 0 HB3 PRO A 37 73.041 -6.069 7.714 1.00 0.00 H new ATOM 0 HG2 PRO A 37 71.705 -3.566 7.017 1.00 0.00 H new ATOM 0 HG3 PRO A 37 72.443 -4.716 5.921 1.00 0.00 H new ATOM 0 HD2 PRO A 37 69.613 -4.268 6.330 1.00 0.00 H new ATOM 0 HD3 PRO A 37 70.352 -5.441 5.257 1.00 0.00 H new ATOM 589 N LYS A 38 69.413 -5.353 9.722 1.00 0.00 N ATOM 590 CA LYS A 38 68.857 -5.009 11.051 1.00 0.00 C ATOM 591 C LYS A 38 67.368 -4.679 10.938 1.00 0.00 C ATOM 592 O LYS A 38 66.954 -3.918 10.085 1.00 0.00 O ATOM 593 CB LYS A 38 69.596 -3.788 11.601 1.00 0.00 C ATOM 594 CG LYS A 38 70.902 -4.231 12.260 1.00 0.00 C ATOM 595 CD LYS A 38 71.033 -3.562 13.630 1.00 0.00 C ATOM 596 CE LYS A 38 72.118 -4.268 14.444 1.00 0.00 C ATOM 597 NZ LYS A 38 72.016 -3.856 15.872 1.00 0.00 N ATOM 0 H LYS A 38 68.954 -4.905 8.929 1.00 0.00 H new ATOM 0 HA LYS A 38 68.983 -5.862 11.718 1.00 0.00 H new ATOM 0 HB2 LYS A 38 69.804 -3.084 10.796 1.00 0.00 H new ATOM 0 HB3 LYS A 38 68.970 -3.268 12.326 1.00 0.00 H new ATOM 0 HG2 LYS A 38 70.917 -5.315 12.370 1.00 0.00 H new ATOM 0 HG3 LYS A 38 71.750 -3.963 11.629 1.00 0.00 H new ATOM 0 HD2 LYS A 38 71.283 -2.508 13.509 1.00 0.00 H new ATOM 0 HD3 LYS A 38 70.081 -3.605 14.159 1.00 0.00 H new ATOM 0 HE2 LYS A 38 72.007 -5.349 14.358 1.00 0.00 H new ATOM 0 HE3 LYS A 38 73.103 -4.017 14.052 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 72.754 -4.336 16.425 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 72.143 -2.826 15.946 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 71.080 -4.117 16.243 1.00 0.00 H new ATOM 611 N GLU A 39 66.566 -5.207 11.823 1.00 0.00 N ATOM 612 CA GLU A 39 65.115 -4.878 11.799 1.00 0.00 C ATOM 613 C GLU A 39 64.958 -3.386 12.095 1.00 0.00 C ATOM 614 O GLU A 39 65.933 -2.674 12.235 1.00 0.00 O ATOM 615 CB GLU A 39 64.385 -5.694 12.869 1.00 0.00 C ATOM 616 CG GLU A 39 64.810 -7.161 12.772 1.00 0.00 C ATOM 617 CD GLU A 39 63.865 -8.025 13.611 1.00 0.00 C ATOM 618 OE1 GLU A 39 62.791 -7.547 13.936 1.00 0.00 O ATOM 619 OE2 GLU A 39 64.232 -9.148 13.916 1.00 0.00 O ATOM 0 H GLU A 39 66.854 -5.851 12.560 1.00 0.00 H new ATOM 0 HA GLU A 39 64.690 -5.116 10.824 1.00 0.00 H new ATOM 0 HB2 GLU A 39 64.615 -5.303 13.860 1.00 0.00 H new ATOM 0 HB3 GLU A 39 63.307 -5.607 12.735 1.00 0.00 H new ATOM 0 HG2 GLU A 39 64.791 -7.488 11.732 1.00 0.00 H new ATOM 0 HG3 GLU A 39 65.835 -7.277 13.124 1.00 0.00 H new ATOM 626 N ALA A 40 63.753 -2.900 12.193 1.00 0.00 N ATOM 627 CA ALA A 40 63.574 -1.448 12.480 1.00 0.00 C ATOM 628 C ALA A 40 62.094 -1.100 12.531 1.00 0.00 C ATOM 629 O ALA A 40 61.236 -1.938 12.345 1.00 0.00 O ATOM 630 CB ALA A 40 64.236 -0.628 11.369 1.00 0.00 C ATOM 0 H ALA A 40 62.892 -3.437 12.088 1.00 0.00 H new ATOM 0 HA ALA A 40 64.032 -1.220 13.443 1.00 0.00 H new ATOM 0 HB1 ALA A 40 64.107 0.435 11.575 1.00 0.00 H new ATOM 0 HB2 ALA A 40 65.299 -0.863 11.327 1.00 0.00 H new ATOM 0 HB3 ALA A 40 63.773 -0.871 10.413 1.00 0.00 H new ATOM 636 N VAL A 41 61.795 0.150 12.728 1.00 0.00 N ATOM 637 CA VAL A 41 60.380 0.594 12.723 1.00 0.00 C ATOM 638 C VAL A 41 60.282 1.834 11.885 1.00 0.00 C ATOM 639 O VAL A 41 60.712 2.895 12.282 1.00 0.00 O ATOM 640 CB VAL A 41 59.893 0.908 14.146 1.00 0.00 C ATOM 641 CG1 VAL A 41 58.804 1.993 14.103 1.00 0.00 C ATOM 642 CG2 VAL A 41 59.299 -0.338 14.747 1.00 0.00 C ATOM 0 H VAL A 41 62.478 0.889 12.894 1.00 0.00 H new ATOM 0 HA VAL A 41 59.757 -0.204 12.319 1.00 0.00 H new ATOM 0 HB VAL A 41 60.736 1.258 14.741 1.00 0.00 H new ATOM 0 HG11 VAL A 41 58.465 2.209 15.116 1.00 0.00 H new ATOM 0 HG12 VAL A 41 59.211 2.900 13.656 1.00 0.00 H new ATOM 0 HG13 VAL A 41 57.963 1.641 13.506 1.00 0.00 H new ATOM 0 HG21 VAL A 41 58.951 -0.124 15.757 1.00 0.00 H new ATOM 0 HG22 VAL A 41 58.460 -0.672 14.137 1.00 0.00 H new ATOM 0 HG23 VAL A 41 60.056 -1.121 14.782 1.00 0.00 H new ATOM 652 N ILE A 42 59.697 1.731 10.757 1.00 0.00 N ATOM 653 CA ILE A 42 59.555 2.913 9.924 1.00 0.00 C ATOM 654 C ILE A 42 58.455 3.791 10.502 1.00 0.00 C ATOM 655 O ILE A 42 57.298 3.682 10.152 1.00 0.00 O ATOM 656 CB ILE A 42 59.230 2.487 8.512 1.00 0.00 C ATOM 657 CG1 ILE A 42 60.430 1.688 7.973 1.00 0.00 C ATOM 658 CG2 ILE A 42 58.979 3.727 7.660 1.00 0.00 C ATOM 659 CD1 ILE A 42 60.297 1.479 6.471 1.00 0.00 C ATOM 0 H ILE A 42 59.307 0.871 10.372 1.00 0.00 H new ATOM 0 HA ILE A 42 60.483 3.485 9.904 1.00 0.00 H new ATOM 0 HB ILE A 42 58.335 1.866 8.484 1.00 0.00 H new ATOM 0 HG12 ILE A 42 61.356 2.219 8.192 1.00 0.00 H new ATOM 0 HG13 ILE A 42 60.489 0.723 8.477 1.00 0.00 H new ATOM 0 HG21 ILE A 42 58.744 3.426 6.639 1.00 0.00 H new ATOM 0 HG22 ILE A 42 58.142 4.290 8.074 1.00 0.00 H new ATOM 0 HG23 ILE A 42 59.871 4.353 7.657 1.00 0.00 H new ATOM 0 HD11 ILE A 42 61.153 0.912 6.105 1.00 0.00 H new ATOM 0 HD12 ILE A 42 59.380 0.928 6.260 1.00 0.00 H new ATOM 0 HD13 ILE A 42 60.262 2.447 5.971 1.00 0.00 H new ATOM 671 N PHE A 43 58.818 4.643 11.410 1.00 0.00 N ATOM 672 CA PHE A 43 57.822 5.526 12.061 1.00 0.00 C ATOM 673 C PHE A 43 57.458 6.675 11.117 1.00 0.00 C ATOM 674 O PHE A 43 57.946 7.778 11.260 1.00 0.00 O ATOM 675 CB PHE A 43 58.424 6.112 13.345 1.00 0.00 C ATOM 676 CG PHE A 43 58.184 5.182 14.519 1.00 0.00 C ATOM 677 CD1 PHE A 43 56.937 4.530 14.651 1.00 0.00 C ATOM 678 CD2 PHE A 43 59.203 4.953 15.476 1.00 0.00 C ATOM 679 CE1 PHE A 43 56.708 3.654 15.736 1.00 0.00 C ATOM 680 CE2 PHE A 43 58.968 4.077 16.558 1.00 0.00 C ATOM 681 CZ PHE A 43 57.724 3.429 16.687 1.00 0.00 C ATOM 0 H PHE A 43 59.777 4.767 11.734 1.00 0.00 H new ATOM 0 HA PHE A 43 56.929 4.947 12.298 1.00 0.00 H new ATOM 0 HB2 PHE A 43 59.494 6.270 13.212 1.00 0.00 H new ATOM 0 HB3 PHE A 43 57.981 7.087 13.549 1.00 0.00 H new ATOM 0 HD1 PHE A 43 56.159 4.701 13.922 1.00 0.00 H new ATOM 0 HD2 PHE A 43 60.158 5.448 15.378 1.00 0.00 H new ATOM 0 HE1 PHE A 43 55.755 3.157 15.837 1.00 0.00 H new ATOM 0 HE2 PHE A 43 59.744 3.903 17.289 1.00 0.00 H new ATOM 0 HZ PHE A 43 57.548 2.759 17.516 1.00 0.00 H new ATOM 691 N LYS A 44 56.602 6.438 10.159 1.00 0.00 N ATOM 692 CA LYS A 44 56.218 7.541 9.230 1.00 0.00 C ATOM 693 C LYS A 44 55.681 8.702 10.049 1.00 0.00 C ATOM 694 O LYS A 44 54.550 8.688 10.477 1.00 0.00 O ATOM 695 CB LYS A 44 55.125 7.060 8.271 1.00 0.00 C ATOM 696 CG LYS A 44 55.639 7.133 6.833 1.00 0.00 C ATOM 697 CD LYS A 44 54.454 7.262 5.874 1.00 0.00 C ATOM 698 CE LYS A 44 54.889 6.851 4.466 1.00 0.00 C ATOM 699 NZ LYS A 44 53.723 6.927 3.543 1.00 0.00 N ATOM 0 H LYS A 44 56.156 5.538 9.980 1.00 0.00 H new ATOM 0 HA LYS A 44 57.089 7.852 8.654 1.00 0.00 H new ATOM 0 HB2 LYS A 44 54.838 6.037 8.514 1.00 0.00 H new ATOM 0 HB3 LYS A 44 54.233 7.676 8.381 1.00 0.00 H new ATOM 0 HG2 LYS A 44 56.308 7.985 6.718 1.00 0.00 H new ATOM 0 HG3 LYS A 44 56.217 6.240 6.596 1.00 0.00 H new ATOM 0 HD2 LYS A 44 53.630 6.632 6.210 1.00 0.00 H new ATOM 0 HD3 LYS A 44 54.088 8.289 5.868 1.00 0.00 H new ATOM 0 HE2 LYS A 44 55.687 7.505 4.115 1.00 0.00 H new ATOM 0 HE3 LYS A 44 55.290 5.838 4.479 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 54.019 6.648 2.586 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 52.975 6.285 3.875 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 53.360 7.901 3.522 1.00 0.00 H new ATOM 713 N THR A 45 56.487 9.693 10.292 1.00 0.00 N ATOM 714 CA THR A 45 56.022 10.844 11.108 1.00 0.00 C ATOM 715 C THR A 45 54.813 11.511 10.416 1.00 0.00 C ATOM 716 O THR A 45 54.110 10.886 9.652 1.00 0.00 O ATOM 717 CB THR A 45 57.173 11.837 11.276 1.00 0.00 C ATOM 718 OG1 THR A 45 57.874 11.964 10.048 1.00 0.00 O ATOM 719 CG2 THR A 45 58.118 11.315 12.356 1.00 0.00 C ATOM 0 H THR A 45 57.449 9.756 9.960 1.00 0.00 H new ATOM 0 HA THR A 45 55.708 10.503 12.095 1.00 0.00 H new ATOM 0 HB THR A 45 56.783 12.813 11.566 1.00 0.00 H new ATOM 0 HG1 THR A 45 58.610 11.318 10.023 1.00 0.00 H new ATOM 0 HG21 THR A 45 58.944 12.014 12.486 1.00 0.00 H new ATOM 0 HG22 THR A 45 57.576 11.215 13.296 1.00 0.00 H new ATOM 0 HG23 THR A 45 58.510 10.342 12.058 1.00 0.00 H new ATOM 727 N ILE A 46 54.570 12.773 10.669 1.00 0.00 N ATOM 728 CA ILE A 46 53.406 13.450 10.018 1.00 0.00 C ATOM 729 C ILE A 46 53.860 14.097 8.752 1.00 0.00 C ATOM 730 O ILE A 46 53.107 14.256 7.811 1.00 0.00 O ATOM 731 CB ILE A 46 52.836 14.536 10.932 1.00 0.00 C ATOM 732 CG1 ILE A 46 53.988 15.416 11.488 1.00 0.00 C ATOM 733 CG2 ILE A 46 52.038 13.891 12.079 1.00 0.00 C ATOM 734 CD1 ILE A 46 54.517 14.861 12.818 1.00 0.00 C ATOM 0 H ILE A 46 55.123 13.360 11.293 1.00 0.00 H new ATOM 0 HA ILE A 46 52.638 12.703 9.818 1.00 0.00 H new ATOM 0 HB ILE A 46 52.161 15.172 10.359 1.00 0.00 H new ATOM 0 HG12 ILE A 46 54.799 15.460 10.761 1.00 0.00 H new ATOM 0 HG13 ILE A 46 53.633 16.436 11.632 1.00 0.00 H new ATOM 0 HG21 ILE A 46 51.635 14.671 12.726 1.00 0.00 H new ATOM 0 HG22 ILE A 46 51.218 13.303 11.666 1.00 0.00 H new ATOM 0 HG23 ILE A 46 52.694 13.242 12.659 1.00 0.00 H new ATOM 0 HD11 ILE A 46 55.323 15.498 13.183 1.00 0.00 H new ATOM 0 HD12 ILE A 46 53.710 14.841 13.551 1.00 0.00 H new ATOM 0 HD13 ILE A 46 54.894 13.850 12.666 1.00 0.00 H new ATOM 746 N VAL A 47 55.086 14.472 8.705 1.00 0.00 N ATOM 747 CA VAL A 47 55.601 15.106 7.502 1.00 0.00 C ATOM 748 C VAL A 47 56.124 14.021 6.558 1.00 0.00 C ATOM 749 O VAL A 47 56.851 14.291 5.623 1.00 0.00 O ATOM 750 CB VAL A 47 56.709 16.067 7.899 1.00 0.00 C ATOM 751 CG1 VAL A 47 57.952 15.289 8.341 1.00 0.00 C ATOM 752 CG2 VAL A 47 57.041 16.948 6.721 1.00 0.00 C ATOM 0 H VAL A 47 55.760 14.362 9.463 1.00 0.00 H new ATOM 0 HA VAL A 47 54.819 15.665 6.988 1.00 0.00 H new ATOM 0 HB VAL A 47 56.374 16.683 8.734 1.00 0.00 H new ATOM 0 HG11 VAL A 47 58.738 15.989 8.623 1.00 0.00 H new ATOM 0 HG12 VAL A 47 57.703 14.660 9.196 1.00 0.00 H new ATOM 0 HG13 VAL A 47 58.301 14.663 7.520 1.00 0.00 H new ATOM 0 HG21 VAL A 47 57.836 17.641 6.997 1.00 0.00 H new ATOM 0 HG22 VAL A 47 57.372 16.330 5.887 1.00 0.00 H new ATOM 0 HG23 VAL A 47 56.155 17.511 6.426 1.00 0.00 H new ATOM 762 N ALA A 48 55.732 12.787 6.790 1.00 0.00 N ATOM 763 CA ALA A 48 56.169 11.683 5.912 1.00 0.00 C ATOM 764 C ALA A 48 57.657 11.410 6.125 1.00 0.00 C ATOM 765 O ALA A 48 58.305 10.786 5.309 1.00 0.00 O ATOM 766 CB ALA A 48 55.913 12.068 4.466 1.00 0.00 C ATOM 0 H ALA A 48 55.123 12.509 7.560 1.00 0.00 H new ATOM 0 HA ALA A 48 55.609 10.779 6.152 1.00 0.00 H new ATOM 0 HB1 ALA A 48 56.233 11.257 3.811 1.00 0.00 H new ATOM 0 HB2 ALA A 48 54.848 12.252 4.321 1.00 0.00 H new ATOM 0 HB3 ALA A 48 56.473 12.972 4.225 1.00 0.00 H new ATOM 772 N LYS A 49 58.200 11.852 7.226 1.00 0.00 N ATOM 773 CA LYS A 49 59.636 11.590 7.498 1.00 0.00 C ATOM 774 C LYS A 49 59.777 10.189 8.087 1.00 0.00 C ATOM 775 O LYS A 49 59.916 10.017 9.280 1.00 0.00 O ATOM 776 CB LYS A 49 60.167 12.618 8.489 1.00 0.00 C ATOM 777 CG LYS A 49 61.324 13.393 7.852 1.00 0.00 C ATOM 778 CD LYS A 49 61.470 14.751 8.541 1.00 0.00 C ATOM 779 CE LYS A 49 61.886 14.541 9.999 1.00 0.00 C ATOM 780 NZ LYS A 49 61.709 15.813 10.754 1.00 0.00 N ATOM 0 H LYS A 49 57.710 12.382 7.946 1.00 0.00 H new ATOM 0 HA LYS A 49 60.207 11.662 6.572 1.00 0.00 H new ATOM 0 HB2 LYS A 49 59.371 13.305 8.778 1.00 0.00 H new ATOM 0 HB3 LYS A 49 60.505 12.121 9.398 1.00 0.00 H new ATOM 0 HG2 LYS A 49 62.250 12.825 7.944 1.00 0.00 H new ATOM 0 HG3 LYS A 49 61.140 13.532 6.787 1.00 0.00 H new ATOM 0 HD2 LYS A 49 62.214 15.356 8.023 1.00 0.00 H new ATOM 0 HD3 LYS A 49 60.528 15.297 8.495 1.00 0.00 H new ATOM 0 HE2 LYS A 49 61.285 13.751 10.450 1.00 0.00 H new ATOM 0 HE3 LYS A 49 62.926 14.218 10.049 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 61.992 15.671 11.745 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 62.301 16.555 10.328 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 60.711 16.103 10.717 1.00 0.00 H new ATOM 794 N GLU A 50 59.733 9.184 7.258 1.00 0.00 N ATOM 795 CA GLU A 50 59.856 7.788 7.767 1.00 0.00 C ATOM 796 C GLU A 50 61.093 7.678 8.654 1.00 0.00 C ATOM 797 O GLU A 50 62.204 7.880 8.208 1.00 0.00 O ATOM 798 CB GLU A 50 59.992 6.830 6.583 1.00 0.00 C ATOM 799 CG GLU A 50 58.912 7.141 5.547 1.00 0.00 C ATOM 800 CD GLU A 50 58.531 5.857 4.807 1.00 0.00 C ATOM 801 OE1 GLU A 50 59.397 5.294 4.158 1.00 0.00 O ATOM 802 OE2 GLU A 50 57.382 5.460 4.901 1.00 0.00 O ATOM 0 H GLU A 50 59.617 9.268 6.248 1.00 0.00 H new ATOM 0 HA GLU A 50 58.970 7.530 8.347 1.00 0.00 H new ATOM 0 HB2 GLU A 50 60.980 6.928 6.134 1.00 0.00 H new ATOM 0 HB3 GLU A 50 59.898 5.799 6.924 1.00 0.00 H new ATOM 0 HG2 GLU A 50 58.035 7.565 6.036 1.00 0.00 H new ATOM 0 HG3 GLU A 50 59.275 7.887 4.840 1.00 0.00 H new ATOM 809 N ILE A 51 60.916 7.377 9.913 1.00 0.00 N ATOM 810 CA ILE A 51 62.105 7.281 10.813 1.00 0.00 C ATOM 811 C ILE A 51 62.268 5.871 11.338 1.00 0.00 C ATOM 812 O ILE A 51 61.617 5.474 12.283 1.00 0.00 O ATOM 813 CB ILE A 51 61.967 8.204 12.020 1.00 0.00 C ATOM 814 CG1 ILE A 51 60.894 9.249 11.794 1.00 0.00 C ATOM 815 CG2 ILE A 51 63.293 8.903 12.263 1.00 0.00 C ATOM 816 CD1 ILE A 51 60.700 10.003 13.092 1.00 0.00 C ATOM 0 H ILE A 51 60.014 7.196 10.354 1.00 0.00 H new ATOM 0 HA ILE A 51 62.970 7.573 10.218 1.00 0.00 H new ATOM 0 HB ILE A 51 61.685 7.601 12.883 1.00 0.00 H new ATOM 0 HG12 ILE A 51 61.188 9.931 10.996 1.00 0.00 H new ATOM 0 HG13 ILE A 51 59.962 8.778 11.483 1.00 0.00 H new ATOM 0 HG21 ILE A 51 63.203 9.565 13.124 1.00 0.00 H new ATOM 0 HG22 ILE A 51 64.066 8.159 12.456 1.00 0.00 H new ATOM 0 HG23 ILE A 51 63.563 9.487 11.383 1.00 0.00 H new ATOM 0 HD11 ILE A 51 59.931 10.764 12.959 1.00 0.00 H new ATOM 0 HD12 ILE A 51 60.392 9.309 13.874 1.00 0.00 H new ATOM 0 HD13 ILE A 51 61.637 10.480 13.379 1.00 0.00 H new ATOM 828 N CYS A 52 63.191 5.143 10.809 1.00 0.00 N ATOM 829 CA CYS A 52 63.453 3.793 11.351 1.00 0.00 C ATOM 830 C CYS A 52 63.840 3.947 12.817 1.00 0.00 C ATOM 831 O CYS A 52 64.691 4.737 13.155 1.00 0.00 O ATOM 832 CB CYS A 52 64.592 3.148 10.580 1.00 0.00 C ATOM 833 SG CYS A 52 63.941 2.464 9.039 1.00 0.00 S ATOM 0 H CYS A 52 63.779 5.421 10.023 1.00 0.00 H new ATOM 0 HA CYS A 52 62.569 3.162 11.257 1.00 0.00 H new ATOM 0 HB2 CYS A 52 65.368 3.884 10.368 1.00 0.00 H new ATOM 0 HB3 CYS A 52 65.053 2.361 11.177 1.00 0.00 H new ATOM 838 N ALA A 53 63.199 3.242 13.688 1.00 0.00 N ATOM 839 CA ALA A 53 63.512 3.391 15.134 1.00 0.00 C ATOM 840 C ALA A 53 63.785 2.013 15.742 1.00 0.00 C ATOM 841 O ALA A 53 63.165 1.033 15.385 1.00 0.00 O ATOM 842 CB ALA A 53 62.325 4.053 15.842 1.00 0.00 C ATOM 0 H ALA A 53 62.468 2.565 13.468 1.00 0.00 H new ATOM 0 HA ALA A 53 64.397 4.015 15.258 1.00 0.00 H new ATOM 0 HB1 ALA A 53 62.550 4.164 16.903 1.00 0.00 H new ATOM 0 HB2 ALA A 53 62.142 5.035 15.405 1.00 0.00 H new ATOM 0 HB3 ALA A 53 61.437 3.432 15.723 1.00 0.00 H new ATOM 848 N ASP A 54 64.724 1.931 16.646 1.00 0.00 N ATOM 849 CA ASP A 54 65.057 0.616 17.264 1.00 0.00 C ATOM 850 C ASP A 54 63.828 0.066 18.019 1.00 0.00 C ATOM 851 O ASP A 54 63.421 0.633 19.013 1.00 0.00 O ATOM 852 CB ASP A 54 66.213 0.803 18.250 1.00 0.00 C ATOM 853 CG ASP A 54 66.548 -0.538 18.904 1.00 0.00 C ATOM 854 OD1 ASP A 54 66.973 -1.433 18.192 1.00 0.00 O ATOM 855 OD2 ASP A 54 66.373 -0.648 20.107 1.00 0.00 O ATOM 0 H ASP A 54 65.276 2.720 16.983 1.00 0.00 H new ATOM 0 HA ASP A 54 65.344 -0.088 16.483 1.00 0.00 H new ATOM 0 HB2 ASP A 54 67.088 1.195 17.731 1.00 0.00 H new ATOM 0 HB3 ASP A 54 65.940 1.533 19.012 1.00 0.00 H new ATOM 860 N PRO A 55 63.271 -1.036 17.529 1.00 0.00 N ATOM 861 CA PRO A 55 62.108 -1.653 18.169 1.00 0.00 C ATOM 862 C PRO A 55 62.474 -2.140 19.577 1.00 0.00 C ATOM 863 O PRO A 55 61.617 -2.411 20.393 1.00 0.00 O ATOM 864 CB PRO A 55 61.740 -2.847 17.271 1.00 0.00 C ATOM 865 CG PRO A 55 62.790 -2.899 16.115 1.00 0.00 C ATOM 866 CD PRO A 55 63.758 -1.722 16.323 1.00 0.00 C ATOM 0 HA PRO A 55 61.280 -0.952 18.276 1.00 0.00 H new ATOM 0 HB2 PRO A 55 61.751 -3.775 17.842 1.00 0.00 H new ATOM 0 HB3 PRO A 55 60.733 -2.731 16.871 1.00 0.00 H new ATOM 0 HG2 PRO A 55 63.329 -3.846 16.128 1.00 0.00 H new ATOM 0 HG3 PRO A 55 62.298 -2.825 15.145 1.00 0.00 H new ATOM 0 HD2 PRO A 55 64.782 -2.072 16.454 1.00 0.00 H new ATOM 0 HD3 PRO A 55 63.758 -1.054 15.462 1.00 0.00 H new ATOM 874 N LYS A 56 63.745 -2.261 19.862 1.00 0.00 N ATOM 875 CA LYS A 56 64.165 -2.736 21.201 1.00 0.00 C ATOM 876 C LYS A 56 64.331 -1.544 22.151 1.00 0.00 C ATOM 877 O LYS A 56 64.952 -1.651 23.190 1.00 0.00 O ATOM 878 CB LYS A 56 65.497 -3.480 21.083 1.00 0.00 C ATOM 879 CG LYS A 56 65.234 -4.947 20.735 1.00 0.00 C ATOM 880 CD LYS A 56 65.634 -5.207 19.282 1.00 0.00 C ATOM 881 CE LYS A 56 65.905 -6.700 19.086 1.00 0.00 C ATOM 882 NZ LYS A 56 67.337 -6.987 19.384 1.00 0.00 N ATOM 0 H LYS A 56 64.508 -2.049 19.219 1.00 0.00 H new ATOM 0 HA LYS A 56 63.403 -3.407 21.597 1.00 0.00 H new ATOM 0 HB2 LYS A 56 66.117 -3.018 20.314 1.00 0.00 H new ATOM 0 HB3 LYS A 56 66.048 -3.411 22.021 1.00 0.00 H new ATOM 0 HG2 LYS A 56 65.801 -5.597 21.401 1.00 0.00 H new ATOM 0 HG3 LYS A 56 64.180 -5.183 20.881 1.00 0.00 H new ATOM 0 HD2 LYS A 56 64.840 -4.880 18.611 1.00 0.00 H new ATOM 0 HD3 LYS A 56 66.523 -4.629 19.030 1.00 0.00 H new ATOM 0 HE2 LYS A 56 65.261 -7.287 19.741 1.00 0.00 H new ATOM 0 HE3 LYS A 56 65.669 -6.992 18.063 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 67.523 -8.002 19.251 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 67.942 -6.437 18.741 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 67.547 -6.723 20.368 1.00 0.00 H new ATOM 896 N GLN A 57 63.780 -0.410 21.809 1.00 0.00 N ATOM 897 CA GLN A 57 63.909 0.776 22.700 1.00 0.00 C ATOM 898 C GLN A 57 62.748 0.791 23.693 1.00 0.00 C ATOM 899 O GLN A 57 61.820 0.012 23.590 1.00 0.00 O ATOM 900 CB GLN A 57 63.878 2.054 21.859 1.00 0.00 C ATOM 901 CG GLN A 57 65.238 2.752 21.938 1.00 0.00 C ATOM 902 CD GLN A 57 65.552 3.093 23.396 1.00 0.00 C ATOM 903 OE1 GLN A 57 65.127 4.113 23.899 1.00 0.00 O ATOM 904 NE2 GLN A 57 66.287 2.276 24.101 1.00 0.00 N ATOM 0 H GLN A 57 63.248 -0.255 20.953 1.00 0.00 H new ATOM 0 HA GLN A 57 64.853 0.723 23.242 1.00 0.00 H new ATOM 0 HB2 GLN A 57 63.640 1.814 20.823 1.00 0.00 H new ATOM 0 HB3 GLN A 57 63.094 2.720 22.220 1.00 0.00 H new ATOM 0 HG2 GLN A 57 66.015 2.106 21.529 1.00 0.00 H new ATOM 0 HG3 GLN A 57 65.228 3.660 21.335 1.00 0.00 H new ATOM 0 HE21 GLN A 57 66.645 1.419 23.679 1.00 0.00 H new ATOM 0 HE22 GLN A 57 66.504 2.495 25.073 1.00 0.00 H new ATOM 913 N LYS A 58 62.790 1.665 24.660 1.00 0.00 N ATOM 914 CA LYS A 58 61.688 1.718 25.659 1.00 0.00 C ATOM 915 C LYS A 58 60.663 2.780 25.241 1.00 0.00 C ATOM 916 O LYS A 58 59.549 2.798 25.726 1.00 0.00 O ATOM 917 CB LYS A 58 62.267 2.067 27.043 1.00 0.00 C ATOM 918 CG LYS A 58 61.130 2.404 28.029 1.00 0.00 C ATOM 919 CD LYS A 58 60.069 1.296 28.004 1.00 0.00 C ATOM 920 CE LYS A 58 59.774 0.839 29.435 1.00 0.00 C ATOM 921 NZ LYS A 58 60.449 -0.466 29.687 1.00 0.00 N ATOM 0 H LYS A 58 63.539 2.343 24.801 1.00 0.00 H new ATOM 0 HA LYS A 58 61.195 0.747 25.709 1.00 0.00 H new ATOM 0 HB2 LYS A 58 62.850 1.228 27.423 1.00 0.00 H new ATOM 0 HB3 LYS A 58 62.947 2.915 26.957 1.00 0.00 H new ATOM 0 HG2 LYS A 58 61.531 2.512 29.037 1.00 0.00 H new ATOM 0 HG3 LYS A 58 60.677 3.359 27.762 1.00 0.00 H new ATOM 0 HD2 LYS A 58 59.157 1.662 27.532 1.00 0.00 H new ATOM 0 HD3 LYS A 58 60.421 0.454 27.407 1.00 0.00 H new ATOM 0 HE2 LYS A 58 60.125 1.586 30.147 1.00 0.00 H new ATOM 0 HE3 LYS A 58 58.699 0.739 29.582 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 60.250 -0.778 30.659 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 60.093 -1.176 29.016 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 61.476 -0.356 29.563 1.00 0.00 H new ATOM 935 N TRP A 59 61.016 3.654 24.338 1.00 0.00 N ATOM 936 CA TRP A 59 60.043 4.683 23.898 1.00 0.00 C ATOM 937 C TRP A 59 59.363 4.197 22.625 1.00 0.00 C ATOM 938 O TRP A 59 58.235 4.539 22.341 1.00 0.00 O ATOM 939 CB TRP A 59 60.767 6.024 23.663 1.00 0.00 C ATOM 940 CG TRP A 59 61.524 5.999 22.368 1.00 0.00 C ATOM 941 CD1 TRP A 59 62.783 5.521 22.205 1.00 0.00 C ATOM 942 CD2 TRP A 59 61.097 6.481 21.065 1.00 0.00 C ATOM 943 NE1 TRP A 59 63.155 5.681 20.878 1.00 0.00 N ATOM 944 CE2 TRP A 59 62.151 6.268 20.133 1.00 0.00 C ATOM 945 CE3 TRP A 59 59.899 7.081 20.597 1.00 0.00 C ATOM 946 CZ2 TRP A 59 62.025 6.640 18.782 1.00 0.00 C ATOM 947 CZ3 TRP A 59 59.773 7.456 19.236 1.00 0.00 C ATOM 948 CH2 TRP A 59 60.842 7.231 18.336 1.00 0.00 C ATOM 0 H TRP A 59 61.932 3.697 23.891 1.00 0.00 H new ATOM 0 HA TRP A 59 59.288 4.842 24.667 1.00 0.00 H new ATOM 0 HB2 TRP A 59 60.041 6.837 23.650 1.00 0.00 H new ATOM 0 HB3 TRP A 59 61.453 6.222 24.487 1.00 0.00 H new ATOM 0 HD1 TRP A 59 63.396 5.087 22.981 1.00 0.00 H new ATOM 0 HE1 TRP A 59 64.059 5.400 20.499 1.00 0.00 H new ATOM 0 HE3 TRP A 59 59.080 7.252 21.280 1.00 0.00 H new ATOM 0 HZ2 TRP A 59 62.839 6.469 18.094 1.00 0.00 H new ATOM 0 HZ3 TRP A 59 58.860 7.914 18.885 1.00 0.00 H new ATOM 0 HH2 TRP A 59 60.742 7.518 17.300 1.00 0.00 H new ATOM 959 N VAL A 60 60.030 3.368 21.876 1.00 0.00 N ATOM 960 CA VAL A 60 59.414 2.818 20.650 1.00 0.00 C ATOM 961 C VAL A 60 58.520 1.631 21.034 1.00 0.00 C ATOM 962 O VAL A 60 57.731 1.158 20.249 1.00 0.00 O ATOM 963 CB VAL A 60 60.511 2.367 19.692 1.00 0.00 C ATOM 964 CG1 VAL A 60 59.888 1.665 18.490 1.00 0.00 C ATOM 965 CG2 VAL A 60 61.288 3.590 19.214 1.00 0.00 C ATOM 0 H VAL A 60 60.980 3.049 22.065 1.00 0.00 H new ATOM 0 HA VAL A 60 58.809 3.579 20.157 1.00 0.00 H new ATOM 0 HB VAL A 60 61.181 1.677 20.204 1.00 0.00 H new ATOM 0 HG11 VAL A 60 60.675 1.344 17.808 1.00 0.00 H new ATOM 0 HG12 VAL A 60 59.324 0.795 18.828 1.00 0.00 H new ATOM 0 HG13 VAL A 60 59.218 2.353 17.974 1.00 0.00 H new ATOM 0 HG21 VAL A 60 62.075 3.276 18.528 1.00 0.00 H new ATOM 0 HG22 VAL A 60 60.611 4.274 18.701 1.00 0.00 H new ATOM 0 HG23 VAL A 60 61.734 4.095 20.071 1.00 0.00 H new ATOM 975 N GLN A 61 58.617 1.167 22.252 1.00 0.00 N ATOM 976 CA GLN A 61 57.742 0.048 22.685 1.00 0.00 C ATOM 977 C GLN A 61 56.385 0.626 23.079 1.00 0.00 C ATOM 978 O GLN A 61 55.368 -0.034 23.001 1.00 0.00 O ATOM 979 CB GLN A 61 58.368 -0.664 23.887 1.00 0.00 C ATOM 980 CG GLN A 61 59.145 -1.891 23.404 1.00 0.00 C ATOM 981 CD GLN A 61 58.184 -3.069 23.236 1.00 0.00 C ATOM 982 OE1 GLN A 61 57.070 -2.900 22.780 1.00 0.00 O ATOM 983 NE2 GLN A 61 58.570 -4.265 23.588 1.00 0.00 N ATOM 0 H GLN A 61 59.263 1.515 22.960 1.00 0.00 H new ATOM 0 HA GLN A 61 57.624 -0.671 21.875 1.00 0.00 H new ATOM 0 HB2 GLN A 61 59.034 0.015 24.419 1.00 0.00 H new ATOM 0 HB3 GLN A 61 57.591 -0.965 24.590 1.00 0.00 H new ATOM 0 HG2 GLN A 61 59.639 -1.673 22.457 1.00 0.00 H new ATOM 0 HG3 GLN A 61 59.927 -2.145 24.120 1.00 0.00 H new ATOM 0 HE21 GLN A 61 59.505 -4.407 23.971 1.00 0.00 H new ATOM 0 HE22 GLN A 61 57.937 -5.058 23.480 1.00 0.00 H new ATOM 992 N ASP A 62 56.361 1.871 23.484 1.00 0.00 N ATOM 993 CA ASP A 62 55.080 2.507 23.858 1.00 0.00 C ATOM 994 C ASP A 62 54.477 3.177 22.621 1.00 0.00 C ATOM 995 O ASP A 62 53.280 3.171 22.418 1.00 0.00 O ATOM 996 CB ASP A 62 55.325 3.557 24.944 1.00 0.00 C ATOM 997 CG ASP A 62 54.003 3.891 25.638 1.00 0.00 C ATOM 998 OD1 ASP A 62 53.517 3.050 26.378 1.00 0.00 O ATOM 999 OD2 ASP A 62 53.499 4.980 25.419 1.00 0.00 O ATOM 0 H ASP A 62 57.182 2.470 23.569 1.00 0.00 H new ATOM 0 HA ASP A 62 54.392 1.753 24.240 1.00 0.00 H new ATOM 0 HB2 ASP A 62 56.045 3.182 25.671 1.00 0.00 H new ATOM 0 HB3 ASP A 62 55.755 4.457 24.504 1.00 0.00 H new ATOM 1004 N SER A 63 55.306 3.743 21.785 1.00 0.00 N ATOM 1005 CA SER A 63 54.795 4.400 20.552 1.00 0.00 C ATOM 1006 C SER A 63 54.398 3.328 19.547 1.00 0.00 C ATOM 1007 O SER A 63 53.306 3.323 19.031 1.00 0.00 O ATOM 1008 CB SER A 63 55.896 5.260 19.946 1.00 0.00 C ATOM 1009 OG SER A 63 56.687 5.817 20.987 1.00 0.00 O ATOM 0 H SER A 63 56.318 3.777 21.905 1.00 0.00 H new ATOM 0 HA SER A 63 53.934 5.021 20.797 1.00 0.00 H new ATOM 0 HB2 SER A 63 56.519 4.659 19.283 1.00 0.00 H new ATOM 0 HB3 SER A 63 55.460 6.055 19.341 1.00 0.00 H new ATOM 0 HG SER A 63 57.508 5.292 21.091 1.00 0.00 H new ATOM 1015 N MET A 64 55.288 2.419 19.265 1.00 0.00 N ATOM 1016 CA MET A 64 54.978 1.333 18.293 1.00 0.00 C ATOM 1017 C MET A 64 53.668 0.653 18.690 1.00 0.00 C ATOM 1018 O MET A 64 52.959 0.127 17.861 1.00 0.00 O ATOM 1019 CB MET A 64 56.111 0.305 18.306 1.00 0.00 C ATOM 1020 CG MET A 64 55.782 -0.844 17.351 1.00 0.00 C ATOM 1021 SD MET A 64 57.303 -1.735 16.922 1.00 0.00 S ATOM 1022 CE MET A 64 58.005 -1.835 18.591 1.00 0.00 C ATOM 0 H MET A 64 56.224 2.381 19.669 1.00 0.00 H new ATOM 0 HA MET A 64 54.879 1.755 17.293 1.00 0.00 H new ATOM 0 HB2 MET A 64 57.047 0.779 18.010 1.00 0.00 H new ATOM 0 HB3 MET A 64 56.254 -0.079 19.316 1.00 0.00 H new ATOM 0 HG2 MET A 64 55.069 -1.524 17.817 1.00 0.00 H new ATOM 0 HG3 MET A 64 55.309 -0.456 16.449 1.00 0.00 H new ATOM 0 HE1 MET A 64 58.785 -2.596 18.613 1.00 0.00 H new ATOM 0 HE2 MET A 64 58.432 -0.870 18.864 1.00 0.00 H new ATOM 0 HE3 MET A 64 57.221 -2.099 19.300 1.00 0.00 H new ATOM 1032 N ASP A 65 53.338 0.676 19.953 1.00 0.00 N ATOM 1033 CA ASP A 65 52.077 0.052 20.404 1.00 0.00 C ATOM 1034 C ASP A 65 50.938 1.026 20.160 1.00 0.00 C ATOM 1035 O ASP A 65 49.848 0.649 19.780 1.00 0.00 O ATOM 1036 CB ASP A 65 52.167 -0.272 21.897 1.00 0.00 C ATOM 1037 CG ASP A 65 52.608 -1.726 22.077 1.00 0.00 C ATOM 1038 OD1 ASP A 65 51.794 -2.604 21.845 1.00 0.00 O ATOM 1039 OD2 ASP A 65 53.752 -1.937 22.445 1.00 0.00 O ATOM 0 H ASP A 65 53.896 1.105 20.691 1.00 0.00 H new ATOM 0 HA ASP A 65 51.901 -0.871 19.852 1.00 0.00 H new ATOM 0 HB2 ASP A 65 52.877 0.397 22.383 1.00 0.00 H new ATOM 0 HB3 ASP A 65 51.200 -0.112 22.374 1.00 0.00 H new ATOM 1044 N HIS A 66 51.191 2.284 20.356 1.00 0.00 N ATOM 1045 CA HIS A 66 50.142 3.299 20.117 1.00 0.00 C ATOM 1046 C HIS A 66 49.694 3.205 18.662 1.00 0.00 C ATOM 1047 O HIS A 66 48.529 3.342 18.348 1.00 0.00 O ATOM 1048 CB HIS A 66 50.703 4.695 20.393 1.00 0.00 C ATOM 1049 CG HIS A 66 49.625 5.722 20.176 1.00 0.00 C ATOM 1050 ND1 HIS A 66 48.529 5.831 21.018 1.00 0.00 N ATOM 1051 CD2 HIS A 66 49.462 6.691 19.220 1.00 0.00 C ATOM 1052 CE1 HIS A 66 47.761 6.836 20.554 1.00 0.00 C ATOM 1053 NE2 HIS A 66 48.285 7.393 19.459 1.00 0.00 N ATOM 0 H HIS A 66 52.087 2.654 20.674 1.00 0.00 H new ATOM 0 HA HIS A 66 49.295 3.121 20.779 1.00 0.00 H new ATOM 0 HB2 HIS A 66 51.075 4.753 21.416 1.00 0.00 H new ATOM 0 HB3 HIS A 66 51.548 4.895 19.735 1.00 0.00 H new ATOM 0 HD2 HIS A 66 50.144 6.881 18.405 1.00 0.00 H new ATOM 0 HE1 HIS A 66 46.835 7.152 21.011 1.00 0.00 H new ATOM 0 HE2 HIS A 66 47.904 8.167 18.915 1.00 0.00 H new ATOM 1061 N LEU A 67 50.612 2.936 17.774 1.00 0.00 N ATOM 1062 CA LEU A 67 50.249 2.797 16.342 1.00 0.00 C ATOM 1063 C LEU A 67 49.726 1.394 16.120 1.00 0.00 C ATOM 1064 O LEU A 67 48.849 1.163 15.311 1.00 0.00 O ATOM 1065 CB LEU A 67 51.488 3.037 15.464 1.00 0.00 C ATOM 1066 CG LEU A 67 52.282 4.240 15.996 1.00 0.00 C ATOM 1067 CD1 LEU A 67 53.655 4.278 15.343 1.00 0.00 C ATOM 1068 CD2 LEU A 67 51.546 5.521 15.662 1.00 0.00 C ATOM 0 H LEU A 67 51.602 2.807 17.984 1.00 0.00 H new ATOM 0 HA LEU A 67 49.487 3.529 16.075 1.00 0.00 H new ATOM 0 HB2 LEU A 67 52.118 2.148 15.459 1.00 0.00 H new ATOM 0 HB3 LEU A 67 51.184 3.218 14.433 1.00 0.00 H new ATOM 0 HG LEU A 67 52.390 4.145 17.076 1.00 0.00 H new ATOM 0 HD11 LEU A 67 54.215 5.133 15.723 1.00 0.00 H new ATOM 0 HD12 LEU A 67 54.194 3.359 15.575 1.00 0.00 H new ATOM 0 HD13 LEU A 67 53.542 4.370 14.263 1.00 0.00 H new ATOM 0 HD21 LEU A 67 52.110 6.374 16.040 1.00 0.00 H new ATOM 0 HD22 LEU A 67 51.438 5.607 14.581 1.00 0.00 H new ATOM 0 HD23 LEU A 67 50.559 5.505 16.125 1.00 0.00 H new ATOM 1080 N ASP A 68 50.218 0.459 16.876 1.00 0.00 N ATOM 1081 CA ASP A 68 49.715 -0.917 16.762 1.00 0.00 C ATOM 1082 C ASP A 68 48.263 -0.950 17.243 1.00 0.00 C ATOM 1083 O ASP A 68 47.558 -1.920 17.048 1.00 0.00 O ATOM 1084 CB ASP A 68 50.570 -1.847 17.626 1.00 0.00 C ATOM 1085 CG ASP A 68 51.178 -2.944 16.749 1.00 0.00 C ATOM 1086 OD1 ASP A 68 50.462 -3.472 15.913 1.00 0.00 O ATOM 1087 OD2 ASP A 68 52.348 -3.238 16.928 1.00 0.00 O ATOM 0 H ASP A 68 50.952 0.597 17.571 1.00 0.00 H new ATOM 0 HA ASP A 68 49.767 -1.250 15.725 1.00 0.00 H new ATOM 0 HB2 ASP A 68 51.361 -1.280 18.117 1.00 0.00 H new ATOM 0 HB3 ASP A 68 49.961 -2.292 18.413 1.00 0.00 H new ATOM 1273 N ALA B 4 67.345 13.899 9.999 1.00 0.00 N ATOM 1274 CA ALA B 4 66.575 12.718 9.518 1.00 0.00 C ATOM 1275 C ALA B 4 67.547 11.659 9.000 1.00 0.00 C ATOM 1276 O ALA B 4 67.488 11.255 7.856 1.00 0.00 O ATOM 1277 CB ALA B 4 65.636 13.144 8.388 1.00 0.00 C ATOM 0 HA ALA B 4 65.988 12.306 10.339 1.00 0.00 H new ATOM 0 HB1 ALA B 4 65.073 12.279 8.037 1.00 0.00 H new ATOM 0 HB2 ALA B 4 64.944 13.902 8.756 1.00 0.00 H new ATOM 0 HB3 ALA B 4 66.220 13.555 7.565 1.00 0.00 H new ATOM 1283 N ILE B 5 68.441 11.208 9.833 1.00 0.00 N ATOM 1284 CA ILE B 5 69.418 10.176 9.390 1.00 0.00 C ATOM 1285 C ILE B 5 68.873 8.782 9.706 1.00 0.00 C ATOM 1286 O ILE B 5 69.336 7.792 9.177 1.00 0.00 O ATOM 1287 CB ILE B 5 70.744 10.386 10.115 1.00 0.00 C ATOM 1288 CG1 ILE B 5 71.382 11.691 9.643 1.00 0.00 C ATOM 1289 CG2 ILE B 5 71.678 9.225 9.804 1.00 0.00 C ATOM 1290 CD1 ILE B 5 71.887 12.476 10.852 1.00 0.00 C ATOM 0 H ILE B 5 68.538 11.510 10.803 1.00 0.00 H new ATOM 0 HA ILE B 5 69.576 10.264 8.315 1.00 0.00 H new ATOM 0 HB ILE B 5 70.568 10.436 11.189 1.00 0.00 H new ATOM 0 HG12 ILE B 5 72.207 11.480 8.962 1.00 0.00 H new ATOM 0 HG13 ILE B 5 70.655 12.284 9.088 1.00 0.00 H new ATOM 0 HG21 ILE B 5 72.626 9.372 10.321 1.00 0.00 H new ATOM 0 HG22 ILE B 5 71.223 8.293 10.139 1.00 0.00 H new ATOM 0 HG23 ILE B 5 71.854 9.177 8.729 1.00 0.00 H new ATOM 0 HD11 ILE B 5 72.343 13.408 10.516 1.00 0.00 H new ATOM 0 HD12 ILE B 5 71.052 12.699 11.516 1.00 0.00 H new ATOM 0 HD13 ILE B 5 72.628 11.882 11.388 1.00 0.00 H new ATOM 1302 N ASN B 6 67.882 8.700 10.536 1.00 0.00 N ATOM 1303 CA ASN B 6 67.290 7.369 10.845 1.00 0.00 C ATOM 1304 C ASN B 6 66.195 7.112 9.831 1.00 0.00 C ATOM 1305 O ASN B 6 65.047 7.001 10.166 1.00 0.00 O ATOM 1306 CB ASN B 6 66.680 7.320 12.274 1.00 0.00 C ATOM 1307 CG ASN B 6 66.806 8.677 12.990 1.00 0.00 C ATOM 1308 OD1 ASN B 6 67.581 8.820 13.913 1.00 0.00 O ATOM 1309 ND2 ASN B 6 66.077 9.685 12.585 1.00 0.00 N ATOM 0 H ASN B 6 67.453 9.492 11.016 1.00 0.00 H new ATOM 0 HA ASN B 6 68.074 6.613 10.799 1.00 0.00 H new ATOM 0 HB2 ASN B 6 65.629 7.037 12.212 1.00 0.00 H new ATOM 0 HB3 ASN B 6 67.184 6.551 12.859 1.00 0.00 H new ATOM 0 HD21 ASN B 6 66.160 10.592 13.045 1.00 0.00 H new ATOM 0 HD22 ASN B 6 65.426 9.564 11.809 1.00 0.00 H new ATOM 1316 N ALA B 7 66.537 7.096 8.580 1.00 0.00 N ATOM 1317 CA ALA B 7 65.500 6.915 7.535 1.00 0.00 C ATOM 1318 C ALA B 7 65.542 5.493 6.958 1.00 0.00 C ATOM 1319 O ALA B 7 66.601 5.005 6.615 1.00 0.00 O ATOM 1320 CB ALA B 7 65.763 7.895 6.395 1.00 0.00 C ATOM 0 H ALA B 7 67.491 7.200 8.234 1.00 0.00 H new ATOM 0 HA ALA B 7 64.525 7.091 7.989 1.00 0.00 H new ATOM 0 HB1 ALA B 7 65.004 7.767 5.623 1.00 0.00 H new ATOM 0 HB2 ALA B 7 65.725 8.915 6.776 1.00 0.00 H new ATOM 0 HB3 ALA B 7 66.748 7.703 5.970 1.00 0.00 H new ATOM 1326 N PRO B 8 64.370 4.898 6.775 1.00 0.00 N ATOM 1327 CA PRO B 8 64.274 3.595 6.137 1.00 0.00 C ATOM 1328 C PRO B 8 64.706 3.759 4.695 1.00 0.00 C ATOM 1329 O PRO B 8 63.971 4.259 3.866 1.00 0.00 O ATOM 1330 CB PRO B 8 62.798 3.211 6.209 1.00 0.00 C ATOM 1331 CG PRO B 8 62.047 4.404 6.871 1.00 0.00 C ATOM 1332 CD PRO B 8 63.093 5.477 7.204 1.00 0.00 C ATOM 0 HA PRO B 8 64.896 2.834 6.608 1.00 0.00 H new ATOM 0 HB2 PRO B 8 62.403 3.012 5.213 1.00 0.00 H new ATOM 0 HB3 PRO B 8 62.665 2.300 6.793 1.00 0.00 H new ATOM 0 HG2 PRO B 8 61.290 4.803 6.196 1.00 0.00 H new ATOM 0 HG3 PRO B 8 61.530 4.079 7.774 1.00 0.00 H new ATOM 0 HD2 PRO B 8 62.885 6.409 6.679 1.00 0.00 H new ATOM 0 HD3 PRO B 8 63.100 5.706 8.270 1.00 0.00 H new ATOM 1340 N VAL B 9 65.904 3.416 4.404 1.00 0.00 N ATOM 1341 CA VAL B 9 66.424 3.627 3.039 1.00 0.00 C ATOM 1342 C VAL B 9 66.135 2.396 2.170 1.00 0.00 C ATOM 1343 O VAL B 9 66.667 1.327 2.387 1.00 0.00 O ATOM 1344 CB VAL B 9 67.922 3.855 3.142 1.00 0.00 C ATOM 1345 CG1 VAL B 9 68.563 2.626 3.759 1.00 0.00 C ATOM 1346 CG2 VAL B 9 68.505 4.112 1.762 1.00 0.00 C ATOM 0 H VAL B 9 66.562 2.991 5.058 1.00 0.00 H new ATOM 0 HA VAL B 9 65.941 4.488 2.577 1.00 0.00 H new ATOM 0 HB VAL B 9 68.120 4.725 3.768 1.00 0.00 H new ATOM 0 HG11 VAL B 9 69.639 2.778 3.838 1.00 0.00 H new ATOM 0 HG12 VAL B 9 68.146 2.458 4.752 1.00 0.00 H new ATOM 0 HG13 VAL B 9 68.364 1.758 3.131 1.00 0.00 H new ATOM 0 HG21 VAL B 9 69.580 4.274 1.845 1.00 0.00 H new ATOM 0 HG22 VAL B 9 68.317 3.250 1.121 1.00 0.00 H new ATOM 0 HG23 VAL B 9 68.037 4.996 1.328 1.00 0.00 H new ATOM 1356 N THR B 10 65.297 2.539 1.184 1.00 0.00 N ATOM 1357 CA THR B 10 64.987 1.377 0.311 1.00 0.00 C ATOM 1358 C THR B 10 66.133 1.163 -0.672 1.00 0.00 C ATOM 1359 O THR B 10 66.334 1.939 -1.587 1.00 0.00 O ATOM 1360 CB THR B 10 63.695 1.639 -0.460 1.00 0.00 C ATOM 1361 OG1 THR B 10 62.676 2.041 0.445 1.00 0.00 O ATOM 1362 CG2 THR B 10 63.270 0.359 -1.176 1.00 0.00 C ATOM 0 H THR B 10 64.816 3.406 0.946 1.00 0.00 H new ATOM 0 HA THR B 10 64.862 0.486 0.927 1.00 0.00 H new ATOM 0 HB THR B 10 63.858 2.430 -1.192 1.00 0.00 H new ATOM 0 HG1 THR B 10 61.847 2.211 -0.050 1.00 0.00 H new ATOM 0 HG21 THR B 10 62.348 0.540 -1.728 1.00 0.00 H new ATOM 0 HG22 THR B 10 64.054 0.052 -1.869 1.00 0.00 H new ATOM 0 HG23 THR B 10 63.105 -0.430 -0.443 1.00 0.00 H new ATOM 1370 N CYS B 11 66.890 0.116 -0.496 1.00 0.00 N ATOM 1371 CA CYS B 11 68.025 -0.142 -1.429 1.00 0.00 C ATOM 1372 C CYS B 11 67.941 -1.570 -1.966 1.00 0.00 C ATOM 1373 O CYS B 11 66.911 -2.212 -1.903 1.00 0.00 O ATOM 1374 CB CYS B 11 69.354 0.038 -0.696 1.00 0.00 C ATOM 1375 SG CYS B 11 69.334 1.592 0.221 1.00 0.00 S ATOM 0 H CYS B 11 66.774 -0.570 0.250 1.00 0.00 H new ATOM 0 HA CYS B 11 67.966 0.565 -2.256 1.00 0.00 H new ATOM 0 HB2 CYS B 11 69.521 -0.796 -0.014 1.00 0.00 H new ATOM 0 HB3 CYS B 11 70.178 0.036 -1.410 1.00 0.00 H new ATOM 1380 N CYS B 12 69.026 -2.073 -2.485 1.00 0.00 N ATOM 1381 CA CYS B 12 69.031 -3.464 -3.022 1.00 0.00 C ATOM 1382 C CYS B 12 70.301 -4.175 -2.541 1.00 0.00 C ATOM 1383 O CYS B 12 71.076 -3.631 -1.781 1.00 0.00 O ATOM 1384 CB CYS B 12 69.039 -3.427 -4.554 1.00 0.00 C ATOM 1385 SG CYS B 12 67.836 -2.220 -5.149 1.00 0.00 S ATOM 0 H CYS B 12 69.915 -1.578 -2.561 1.00 0.00 H new ATOM 0 HA CYS B 12 68.143 -3.991 -2.674 1.00 0.00 H new ATOM 0 HB2 CYS B 12 70.035 -3.168 -4.914 1.00 0.00 H new ATOM 0 HB3 CYS B 12 68.803 -4.414 -4.951 1.00 0.00 H new ATOM 1390 N TYR B 13 70.540 -5.364 -3.015 1.00 0.00 N ATOM 1391 CA TYR B 13 71.788 -6.092 -2.624 1.00 0.00 C ATOM 1392 C TYR B 13 72.363 -6.788 -3.860 1.00 0.00 C ATOM 1393 O TYR B 13 73.557 -6.794 -4.084 1.00 0.00 O ATOM 1394 CB TYR B 13 71.473 -7.140 -1.548 1.00 0.00 C ATOM 1395 CG TYR B 13 71.133 -6.454 -0.241 1.00 0.00 C ATOM 1396 CD1 TYR B 13 71.835 -5.290 0.162 1.00 0.00 C ATOM 1397 CD2 TYR B 13 70.105 -6.972 0.576 1.00 0.00 C ATOM 1398 CE1 TYR B 13 71.503 -4.650 1.373 1.00 0.00 C ATOM 1399 CE2 TYR B 13 69.778 -6.330 1.789 1.00 0.00 C ATOM 1400 CZ TYR B 13 70.475 -5.167 2.185 1.00 0.00 C ATOM 1401 OH TYR B 13 70.146 -4.535 3.365 1.00 0.00 O ATOM 0 H TYR B 13 69.928 -5.868 -3.657 1.00 0.00 H new ATOM 0 HA TYR B 13 72.511 -5.382 -2.223 1.00 0.00 H new ATOM 0 HB2 TYR B 13 70.638 -7.763 -1.869 1.00 0.00 H new ATOM 0 HB3 TYR B 13 72.329 -7.800 -1.410 1.00 0.00 H new ATOM 0 HD1 TYR B 13 72.624 -4.894 -0.459 1.00 0.00 H new ATOM 0 HD2 TYR B 13 69.569 -7.859 0.273 1.00 0.00 H new ATOM 0 HE1 TYR B 13 72.037 -3.763 1.678 1.00 0.00 H new ATOM 0 HE2 TYR B 13 68.994 -6.728 2.416 1.00 0.00 H new ATOM 0 HH TYR B 13 69.175 -4.410 3.409 1.00 0.00 H new ATOM 1411 N ASN B 14 71.516 -7.359 -4.672 1.00 0.00 N ATOM 1412 CA ASN B 14 71.998 -8.036 -5.905 1.00 0.00 C ATOM 1413 C ASN B 14 71.315 -7.399 -7.107 1.00 0.00 C ATOM 1414 O ASN B 14 70.672 -6.374 -6.990 1.00 0.00 O ATOM 1415 CB ASN B 14 71.652 -9.524 -5.839 1.00 0.00 C ATOM 1416 CG ASN B 14 72.335 -10.146 -4.622 1.00 0.00 C ATOM 1417 OD1 ASN B 14 73.510 -10.454 -4.661 1.00 0.00 O ATOM 1418 ND2 ASN B 14 71.645 -10.346 -3.534 1.00 0.00 N ATOM 0 H ASN B 14 70.506 -7.385 -4.532 1.00 0.00 H new ATOM 0 HA ASN B 14 73.079 -7.929 -5.995 1.00 0.00 H new ATOM 0 HB2 ASN B 14 70.572 -9.656 -5.772 1.00 0.00 H new ATOM 0 HB3 ASN B 14 71.978 -10.026 -6.750 1.00 0.00 H new ATOM 0 HD21 ASN B 14 72.091 -10.761 -2.716 1.00 0.00 H new ATOM 0 HD22 ASN B 14 70.659 -10.088 -3.501 1.00 0.00 H new ATOM 1425 N PHE B 15 71.452 -7.976 -8.265 1.00 0.00 N ATOM 1426 CA PHE B 15 70.807 -7.366 -9.460 1.00 0.00 C ATOM 1427 C PHE B 15 70.484 -8.438 -10.504 1.00 0.00 C ATOM 1428 O PHE B 15 71.365 -9.082 -11.039 1.00 0.00 O ATOM 1429 CB PHE B 15 71.756 -6.334 -10.073 1.00 0.00 C ATOM 1430 CG PHE B 15 72.132 -5.309 -9.031 1.00 0.00 C ATOM 1431 CD1 PHE B 15 71.199 -4.320 -8.643 1.00 0.00 C ATOM 1432 CD2 PHE B 15 73.417 -5.336 -8.443 1.00 0.00 C ATOM 1433 CE1 PHE B 15 71.551 -3.359 -7.669 1.00 0.00 C ATOM 1434 CE2 PHE B 15 73.768 -4.375 -7.469 1.00 0.00 C ATOM 1435 CZ PHE B 15 72.835 -3.387 -7.082 1.00 0.00 C ATOM 0 H PHE B 15 71.976 -8.834 -8.437 1.00 0.00 H new ATOM 0 HA PHE B 15 69.878 -6.886 -9.152 1.00 0.00 H new ATOM 0 HB2 PHE B 15 72.651 -6.828 -10.451 1.00 0.00 H new ATOM 0 HB3 PHE B 15 71.278 -5.845 -10.922 1.00 0.00 H new ATOM 0 HD1 PHE B 15 70.217 -4.299 -9.091 1.00 0.00 H new ATOM 0 HD2 PHE B 15 74.130 -6.091 -8.738 1.00 0.00 H new ATOM 0 HE1 PHE B 15 70.838 -2.603 -7.374 1.00 0.00 H new ATOM 0 HE2 PHE B 15 74.750 -4.395 -7.020 1.00 0.00 H new ATOM 0 HZ PHE B 15 73.104 -2.653 -6.337 1.00 0.00 H new ATOM 1445 N THR B 16 69.219 -8.604 -10.829 1.00 0.00 N ATOM 1446 CA THR B 16 68.838 -9.610 -11.886 1.00 0.00 C ATOM 1447 C THR B 16 69.726 -9.389 -13.112 1.00 0.00 C ATOM 1448 O THR B 16 69.478 -8.517 -13.913 1.00 0.00 O ATOM 1449 CB THR B 16 67.349 -9.439 -12.299 1.00 0.00 C ATOM 1450 OG1 THR B 16 67.195 -9.772 -13.673 1.00 0.00 O ATOM 1451 CG2 THR B 16 66.897 -7.992 -12.079 1.00 0.00 C ATOM 0 H THR B 16 68.439 -8.093 -10.414 1.00 0.00 H new ATOM 0 HA THR B 16 68.974 -10.615 -11.487 1.00 0.00 H new ATOM 0 HB THR B 16 66.738 -10.101 -11.685 1.00 0.00 H new ATOM 0 HG1 THR B 16 67.477 -9.014 -14.227 1.00 0.00 H new ATOM 0 HG21 THR B 16 65.852 -7.888 -12.373 1.00 0.00 H new ATOM 0 HG22 THR B 16 67.005 -7.733 -11.026 1.00 0.00 H new ATOM 0 HG23 THR B 16 67.511 -7.323 -12.682 1.00 0.00 H new ATOM 1459 N ASN B 17 70.769 -10.151 -13.254 1.00 0.00 N ATOM 1460 CA ASN B 17 71.667 -9.949 -14.420 1.00 0.00 C ATOM 1461 C ASN B 17 71.205 -10.816 -15.593 1.00 0.00 C ATOM 1462 O ASN B 17 71.854 -10.882 -16.618 1.00 0.00 O ATOM 1463 CB ASN B 17 73.099 -10.324 -14.037 1.00 0.00 C ATOM 1464 CG ASN B 17 74.038 -10.026 -15.206 1.00 0.00 C ATOM 1465 OD1 ASN B 17 73.701 -9.267 -16.093 1.00 0.00 O ATOM 1466 ND2 ASN B 17 75.212 -10.595 -15.247 1.00 0.00 N ATOM 0 H ASN B 17 71.038 -10.901 -12.618 1.00 0.00 H new ATOM 0 HA ASN B 17 71.634 -8.901 -14.717 1.00 0.00 H new ATOM 0 HB2 ASN B 17 73.409 -9.762 -13.156 1.00 0.00 H new ATOM 0 HB3 ASN B 17 73.151 -11.381 -13.776 1.00 0.00 H new ATOM 0 HD21 ASN B 17 75.845 -10.402 -16.023 1.00 0.00 H new ATOM 0 HD22 ASN B 17 75.496 -11.232 -14.503 1.00 0.00 H new ATOM 1473 N ARG B 18 70.079 -11.461 -15.466 1.00 0.00 N ATOM 1474 CA ARG B 18 69.577 -12.292 -16.589 1.00 0.00 C ATOM 1475 C ARG B 18 68.600 -11.461 -17.412 1.00 0.00 C ATOM 1476 O ARG B 18 67.728 -10.809 -16.876 1.00 0.00 O ATOM 1477 CB ARG B 18 68.863 -13.526 -16.039 1.00 0.00 C ATOM 1478 CG ARG B 18 69.895 -14.598 -15.684 1.00 0.00 C ATOM 1479 CD ARG B 18 69.571 -15.186 -14.310 1.00 0.00 C ATOM 1480 NE ARG B 18 69.154 -16.620 -14.461 1.00 0.00 N ATOM 1481 CZ ARG B 18 69.877 -17.464 -15.162 1.00 0.00 C ATOM 1482 NH1 ARG B 18 71.059 -17.104 -15.583 1.00 0.00 N ATOM 1483 NH2 ARG B 18 69.394 -18.632 -15.505 1.00 0.00 N ATOM 0 H ARG B 18 69.488 -11.447 -14.635 1.00 0.00 H new ATOM 0 HA ARG B 18 70.411 -12.614 -17.213 1.00 0.00 H new ATOM 0 HB2 ARG B 18 68.282 -13.259 -15.156 1.00 0.00 H new ATOM 0 HB3 ARG B 18 68.161 -13.913 -16.778 1.00 0.00 H new ATOM 0 HG2 ARG B 18 69.891 -15.385 -16.438 1.00 0.00 H new ATOM 0 HG3 ARG B 18 70.896 -14.166 -15.679 1.00 0.00 H new ATOM 0 HD2 ARG B 18 70.443 -15.117 -13.659 1.00 0.00 H new ATOM 0 HD3 ARG B 18 68.774 -14.613 -13.837 1.00 0.00 H new ATOM 0 HE ARG B 18 68.297 -16.944 -14.013 1.00 0.00 H new ATOM 0 HH11 ARG B 18 71.416 -16.173 -15.367 1.00 0.00 H new ATOM 0 HH12 ARG B 18 71.626 -17.754 -16.128 1.00 0.00 H new ATOM 0 HH21 ARG B 18 68.448 -18.894 -15.228 1.00 0.00 H new ATOM 0 HH22 ARG B 18 69.964 -19.280 -16.049 1.00 0.00 H new ATOM 1497 N LYS B 19 68.744 -11.463 -18.706 1.00 0.00 N ATOM 1498 CA LYS B 19 67.825 -10.655 -19.556 1.00 0.00 C ATOM 1499 C LYS B 19 66.380 -11.031 -19.237 1.00 0.00 C ATOM 1500 O LYS B 19 65.828 -11.960 -19.794 1.00 0.00 O ATOM 1501 CB LYS B 19 68.117 -10.927 -21.032 1.00 0.00 C ATOM 1502 CG LYS B 19 69.587 -10.618 -21.326 1.00 0.00 C ATOM 1503 CD LYS B 19 69.739 -10.203 -22.790 1.00 0.00 C ATOM 1504 CE LYS B 19 70.971 -9.306 -22.940 1.00 0.00 C ATOM 1505 NZ LYS B 19 71.948 -9.954 -23.860 1.00 0.00 N ATOM 0 H LYS B 19 69.457 -11.988 -19.213 1.00 0.00 H new ATOM 0 HA LYS B 19 67.977 -9.595 -19.352 1.00 0.00 H new ATOM 0 HB2 LYS B 19 67.898 -11.968 -21.271 1.00 0.00 H new ATOM 0 HB3 LYS B 19 67.472 -10.313 -21.661 1.00 0.00 H new ATOM 0 HG2 LYS B 19 69.939 -9.820 -20.672 1.00 0.00 H new ATOM 0 HG3 LYS B 19 70.202 -11.494 -21.120 1.00 0.00 H new ATOM 0 HD2 LYS B 19 69.840 -11.086 -23.421 1.00 0.00 H new ATOM 0 HD3 LYS B 19 68.847 -9.673 -23.124 1.00 0.00 H new ATOM 0 HE2 LYS B 19 70.679 -8.331 -23.330 1.00 0.00 H new ATOM 0 HE3 LYS B 19 71.430 -9.135 -21.966 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 72.785 -9.345 -23.962 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 72.235 -10.874 -23.470 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 71.507 -10.095 -24.791 1.00 0.00 H new ATOM 1519 N ILE B 20 65.766 -10.315 -18.340 1.00 0.00 N ATOM 1520 CA ILE B 20 64.371 -10.617 -17.973 1.00 0.00 C ATOM 1521 C ILE B 20 63.445 -10.018 -19.023 1.00 0.00 C ATOM 1522 O ILE B 20 63.523 -8.851 -19.352 1.00 0.00 O ATOM 1523 CB ILE B 20 64.076 -10.025 -16.577 1.00 0.00 C ATOM 1524 CG1 ILE B 20 64.449 -11.064 -15.513 1.00 0.00 C ATOM 1525 CG2 ILE B 20 62.585 -9.662 -16.436 1.00 0.00 C ATOM 1526 CD1 ILE B 20 63.904 -10.623 -14.158 1.00 0.00 C ATOM 0 H ILE B 20 66.182 -9.526 -17.844 1.00 0.00 H new ATOM 0 HA ILE B 20 64.209 -11.694 -17.935 1.00 0.00 H new ATOM 0 HB ILE B 20 64.663 -9.116 -16.447 1.00 0.00 H new ATOM 0 HG12 ILE B 20 64.040 -12.038 -15.782 1.00 0.00 H new ATOM 0 HG13 ILE B 20 65.532 -11.176 -15.462 1.00 0.00 H new ATOM 0 HG21 ILE B 20 62.404 -9.247 -15.444 1.00 0.00 H new ATOM 0 HG22 ILE B 20 62.317 -8.924 -17.192 1.00 0.00 H new ATOM 0 HG23 ILE B 20 61.978 -10.557 -16.571 1.00 0.00 H new ATOM 0 HD11 ILE B 20 64.169 -11.362 -13.401 1.00 0.00 H new ATOM 0 HD12 ILE B 20 64.334 -9.658 -13.889 1.00 0.00 H new ATOM 0 HD13 ILE B 20 62.819 -10.534 -14.214 1.00 0.00 H new ATOM 1538 N SER B 21 62.573 -10.814 -19.539 1.00 0.00 N ATOM 1539 CA SER B 21 61.615 -10.329 -20.570 1.00 0.00 C ATOM 1540 C SER B 21 60.981 -9.010 -20.117 1.00 0.00 C ATOM 1541 O SER B 21 60.425 -8.915 -19.040 1.00 0.00 O ATOM 1542 CB SER B 21 60.520 -11.374 -20.753 1.00 0.00 C ATOM 1543 OG SER B 21 60.084 -11.370 -22.107 1.00 0.00 O ATOM 0 H SER B 21 62.474 -11.799 -19.292 1.00 0.00 H new ATOM 0 HA SER B 21 62.143 -10.166 -21.509 1.00 0.00 H new ATOM 0 HB2 SER B 21 60.895 -12.361 -20.483 1.00 0.00 H new ATOM 0 HB3 SER B 21 59.683 -11.159 -20.089 1.00 0.00 H new ATOM 0 HG SER B 21 59.381 -12.043 -22.226 1.00 0.00 H new ATOM 1549 N VAL B 22 61.051 -7.994 -20.934 1.00 0.00 N ATOM 1550 CA VAL B 22 60.443 -6.692 -20.556 1.00 0.00 C ATOM 1551 C VAL B 22 58.963 -6.900 -20.219 1.00 0.00 C ATOM 1552 O VAL B 22 58.350 -6.095 -19.546 1.00 0.00 O ATOM 1553 CB VAL B 22 60.568 -5.711 -21.724 1.00 0.00 C ATOM 1554 CG1 VAL B 22 59.866 -6.289 -22.954 1.00 0.00 C ATOM 1555 CG2 VAL B 22 59.916 -4.379 -21.345 1.00 0.00 C ATOM 0 H VAL B 22 61.504 -8.012 -21.848 1.00 0.00 H new ATOM 0 HA VAL B 22 60.961 -6.287 -19.686 1.00 0.00 H new ATOM 0 HB VAL B 22 61.622 -5.549 -21.949 1.00 0.00 H new ATOM 0 HG11 VAL B 22 59.955 -5.590 -23.786 1.00 0.00 H new ATOM 0 HG12 VAL B 22 60.330 -7.237 -23.226 1.00 0.00 H new ATOM 0 HG13 VAL B 22 58.812 -6.452 -22.728 1.00 0.00 H new ATOM 0 HG21 VAL B 22 60.005 -3.680 -22.177 1.00 0.00 H new ATOM 0 HG22 VAL B 22 58.862 -4.541 -21.119 1.00 0.00 H new ATOM 0 HG23 VAL B 22 60.416 -3.966 -20.469 1.00 0.00 H new ATOM 1565 N GLN B 23 58.388 -7.981 -20.675 1.00 0.00 N ATOM 1566 CA GLN B 23 56.975 -8.252 -20.386 1.00 0.00 C ATOM 1567 C GLN B 23 56.829 -8.539 -18.899 1.00 0.00 C ATOM 1568 O GLN B 23 55.935 -8.047 -18.240 1.00 0.00 O ATOM 1569 CB GLN B 23 56.519 -9.467 -21.231 1.00 0.00 C ATOM 1570 CG GLN B 23 56.072 -10.641 -20.339 1.00 0.00 C ATOM 1571 CD GLN B 23 55.480 -11.750 -21.210 1.00 0.00 C ATOM 1572 OE1 GLN B 23 54.768 -11.480 -22.157 1.00 0.00 O ATOM 1573 NE2 GLN B 23 55.744 -12.997 -20.927 1.00 0.00 N ATOM 0 H GLN B 23 58.855 -8.689 -21.242 1.00 0.00 H new ATOM 0 HA GLN B 23 56.352 -7.394 -20.641 1.00 0.00 H new ATOM 0 HB2 GLN B 23 55.697 -9.170 -21.882 1.00 0.00 H new ATOM 0 HB3 GLN B 23 57.336 -9.790 -21.876 1.00 0.00 H new ATOM 0 HG2 GLN B 23 56.921 -11.024 -19.772 1.00 0.00 H new ATOM 0 HG3 GLN B 23 55.333 -10.300 -19.615 1.00 0.00 H new ATOM 0 HE21 GLN B 23 56.342 -13.224 -20.132 1.00 0.00 H new ATOM 0 HE22 GLN B 23 55.353 -13.744 -21.501 1.00 0.00 H new ATOM 1582 N ARG B 24 57.701 -9.346 -18.371 1.00 0.00 N ATOM 1583 CA ARG B 24 57.616 -9.686 -16.940 1.00 0.00 C ATOM 1584 C ARG B 24 57.676 -8.419 -16.118 1.00 0.00 C ATOM 1585 O ARG B 24 57.118 -8.332 -15.047 1.00 0.00 O ATOM 1586 CB ARG B 24 58.785 -10.588 -16.549 1.00 0.00 C ATOM 1587 CG ARG B 24 58.810 -11.814 -17.450 1.00 0.00 C ATOM 1588 CD ARG B 24 58.105 -12.972 -16.750 1.00 0.00 C ATOM 1589 NE ARG B 24 59.122 -13.940 -16.241 1.00 0.00 N ATOM 1590 CZ ARG B 24 58.765 -15.148 -15.864 1.00 0.00 C ATOM 1591 NH1 ARG B 24 57.511 -15.528 -15.936 1.00 0.00 N ATOM 1592 NH2 ARG B 24 59.666 -15.977 -15.413 1.00 0.00 N ATOM 0 H ARG B 24 58.471 -9.784 -18.877 1.00 0.00 H new ATOM 0 HA ARG B 24 56.677 -10.207 -16.753 1.00 0.00 H new ATOM 0 HB2 ARG B 24 59.724 -10.041 -16.636 1.00 0.00 H new ATOM 0 HB3 ARG B 24 58.689 -10.892 -15.507 1.00 0.00 H new ATOM 0 HG2 ARG B 24 58.318 -11.593 -18.397 1.00 0.00 H new ATOM 0 HG3 ARG B 24 59.839 -12.087 -17.682 1.00 0.00 H new ATOM 0 HD2 ARG B 24 57.499 -12.597 -15.925 1.00 0.00 H new ATOM 0 HD3 ARG B 24 57.427 -13.471 -17.442 1.00 0.00 H new ATOM 0 HE ARG B 24 60.102 -13.662 -16.185 1.00 0.00 H new ATOM 0 HH11 ARG B 24 56.802 -14.884 -16.287 1.00 0.00 H new ATOM 0 HH12 ARG B 24 57.245 -16.467 -15.641 1.00 0.00 H new ATOM 0 HH21 ARG B 24 60.642 -15.687 -15.354 1.00 0.00 H new ATOM 0 HH22 ARG B 24 59.394 -16.915 -15.119 1.00 0.00 H new ATOM 1606 N LEU B 25 58.372 -7.448 -16.601 1.00 0.00 N ATOM 1607 CA LEU B 25 58.514 -6.189 -15.843 1.00 0.00 C ATOM 1608 C LEU B 25 57.201 -5.424 -15.833 1.00 0.00 C ATOM 1609 O LEU B 25 56.888 -4.683 -16.743 1.00 0.00 O ATOM 1610 CB LEU B 25 59.601 -5.339 -16.479 1.00 0.00 C ATOM 1611 CG LEU B 25 60.886 -6.174 -16.614 1.00 0.00 C ATOM 1612 CD1 LEU B 25 62.030 -5.284 -17.083 1.00 0.00 C ATOM 1613 CD2 LEU B 25 61.254 -6.790 -15.260 1.00 0.00 C ATOM 0 H LEU B 25 58.855 -7.470 -17.499 1.00 0.00 H new ATOM 0 HA LEU B 25 58.786 -6.423 -14.814 1.00 0.00 H new ATOM 0 HB2 LEU B 25 59.277 -4.988 -17.459 1.00 0.00 H new ATOM 0 HB3 LEU B 25 59.790 -4.455 -15.870 1.00 0.00 H new ATOM 0 HG LEU B 25 60.715 -6.968 -17.341 1.00 0.00 H new ATOM 0 HD11 LEU B 25 62.939 -5.879 -17.177 1.00 0.00 H new ATOM 0 HD12 LEU B 25 61.779 -4.848 -18.050 1.00 0.00 H new ATOM 0 HD13 LEU B 25 62.192 -4.487 -16.357 1.00 0.00 H new ATOM 0 HD21 LEU B 25 62.165 -7.380 -15.364 1.00 0.00 H new ATOM 0 HD22 LEU B 25 61.417 -5.996 -14.531 1.00 0.00 H new ATOM 0 HD23 LEU B 25 60.442 -7.433 -14.920 1.00 0.00 H new ATOM 1625 N ALA B 26 56.431 -5.597 -14.803 1.00 0.00 N ATOM 1626 CA ALA B 26 55.136 -4.885 -14.710 1.00 0.00 C ATOM 1627 C ALA B 26 55.367 -3.410 -14.375 1.00 0.00 C ATOM 1628 O ALA B 26 54.486 -2.586 -14.524 1.00 0.00 O ATOM 1629 CB ALA B 26 54.298 -5.513 -13.603 1.00 0.00 C ATOM 0 H ALA B 26 56.646 -6.207 -14.014 1.00 0.00 H new ATOM 0 HA ALA B 26 54.620 -4.962 -15.667 1.00 0.00 H new ATOM 0 HB1 ALA B 26 53.343 -4.993 -13.530 1.00 0.00 H new ATOM 0 HB2 ALA B 26 54.122 -6.564 -13.832 1.00 0.00 H new ATOM 0 HB3 ALA B 26 54.829 -5.432 -12.654 1.00 0.00 H new ATOM 1635 N SER B 27 56.530 -3.075 -13.905 1.00 0.00 N ATOM 1636 CA SER B 27 56.804 -1.658 -13.538 1.00 0.00 C ATOM 1637 C SER B 27 58.286 -1.503 -13.205 1.00 0.00 C ATOM 1638 O SER B 27 59.041 -2.455 -13.243 1.00 0.00 O ATOM 1639 CB SER B 27 55.965 -1.274 -12.319 1.00 0.00 C ATOM 1640 OG SER B 27 55.530 -2.454 -11.655 1.00 0.00 O ATOM 0 H SER B 27 57.306 -3.720 -13.758 1.00 0.00 H new ATOM 0 HA SER B 27 56.546 -1.007 -14.373 1.00 0.00 H new ATOM 0 HB2 SER B 27 56.552 -0.656 -11.639 1.00 0.00 H new ATOM 0 HB3 SER B 27 55.105 -0.679 -12.628 1.00 0.00 H new ATOM 0 HG SER B 27 54.993 -2.210 -10.872 1.00 0.00 H new ATOM 1646 N TYR B 28 58.717 -0.312 -12.903 1.00 0.00 N ATOM 1647 CA TYR B 28 60.157 -0.109 -12.600 1.00 0.00 C ATOM 1648 C TYR B 28 60.322 1.098 -11.646 1.00 0.00 C ATOM 1649 O TYR B 28 59.679 2.118 -11.801 1.00 0.00 O ATOM 1650 CB TYR B 28 60.901 0.106 -13.946 1.00 0.00 C ATOM 1651 CG TYR B 28 61.611 1.436 -13.994 1.00 0.00 C ATOM 1652 CD1 TYR B 28 60.919 2.584 -14.431 1.00 0.00 C ATOM 1653 CD2 TYR B 28 62.970 1.523 -13.629 1.00 0.00 C ATOM 1654 CE1 TYR B 28 61.583 3.824 -14.498 1.00 0.00 C ATOM 1655 CE2 TYR B 28 63.638 2.761 -13.697 1.00 0.00 C ATOM 1656 CZ TYR B 28 62.945 3.916 -14.132 1.00 0.00 C ATOM 1657 OH TYR B 28 63.597 5.131 -14.199 1.00 0.00 O ATOM 0 H TYR B 28 58.137 0.525 -12.853 1.00 0.00 H new ATOM 0 HA TYR B 28 60.583 -0.977 -12.096 1.00 0.00 H new ATOM 0 HB2 TYR B 28 61.624 -0.696 -14.092 1.00 0.00 H new ATOM 0 HB3 TYR B 28 60.188 0.046 -14.768 1.00 0.00 H new ATOM 0 HD1 TYR B 28 59.879 2.512 -14.714 1.00 0.00 H new ATOM 0 HD2 TYR B 28 63.498 0.641 -13.298 1.00 0.00 H new ATOM 0 HE1 TYR B 28 61.052 4.704 -14.829 1.00 0.00 H new ATOM 0 HE2 TYR B 28 64.679 2.829 -13.417 1.00 0.00 H new ATOM 0 HH TYR B 28 63.504 5.600 -13.343 1.00 0.00 H new ATOM 1667 N ARG B 29 61.184 0.981 -10.666 1.00 0.00 N ATOM 1668 CA ARG B 29 61.398 2.110 -9.708 1.00 0.00 C ATOM 1669 C ARG B 29 62.900 2.278 -9.456 1.00 0.00 C ATOM 1670 O ARG B 29 63.447 1.733 -8.520 1.00 0.00 O ATOM 1671 CB ARG B 29 60.688 1.804 -8.388 1.00 0.00 C ATOM 1672 CG ARG B 29 59.348 2.542 -8.346 1.00 0.00 C ATOM 1673 CD ARG B 29 58.603 2.175 -7.063 1.00 0.00 C ATOM 1674 NE ARG B 29 57.925 3.390 -6.517 1.00 0.00 N ATOM 1675 CZ ARG B 29 57.463 3.402 -5.286 1.00 0.00 C ATOM 1676 NH1 ARG B 29 57.583 2.347 -4.517 1.00 0.00 N ATOM 1677 NH2 ARG B 29 56.878 4.474 -4.826 1.00 0.00 N ATOM 0 H ARG B 29 61.750 0.151 -10.488 1.00 0.00 H new ATOM 0 HA ARG B 29 60.992 3.030 -10.129 1.00 0.00 H new ATOM 0 HB2 ARG B 29 60.527 0.730 -8.290 1.00 0.00 H new ATOM 0 HB3 ARG B 29 61.311 2.111 -7.548 1.00 0.00 H new ATOM 0 HG2 ARG B 29 59.512 3.619 -8.388 1.00 0.00 H new ATOM 0 HG3 ARG B 29 58.747 2.277 -9.216 1.00 0.00 H new ATOM 0 HD2 ARG B 29 57.868 1.396 -7.266 1.00 0.00 H new ATOM 0 HD3 ARG B 29 59.300 1.772 -6.328 1.00 0.00 H new ATOM 0 HE ARG B 29 57.820 4.217 -7.105 1.00 0.00 H new ATOM 0 HH11 ARG B 29 58.038 1.506 -4.872 1.00 0.00 H new ATOM 0 HH12 ARG B 29 57.221 2.367 -3.564 1.00 0.00 H new ATOM 0 HH21 ARG B 29 56.781 5.297 -5.421 1.00 0.00 H new ATOM 0 HH22 ARG B 29 56.518 4.489 -3.872 1.00 0.00 H new ATOM 1691 N ARG B 30 63.572 3.005 -10.305 1.00 0.00 N ATOM 1692 CA ARG B 30 65.046 3.180 -10.146 1.00 0.00 C ATOM 1693 C ARG B 30 65.391 3.676 -8.740 1.00 0.00 C ATOM 1694 O ARG B 30 65.172 4.823 -8.401 1.00 0.00 O ATOM 1695 CB ARG B 30 65.553 4.190 -11.176 1.00 0.00 C ATOM 1696 CG ARG B 30 66.897 3.711 -11.727 1.00 0.00 C ATOM 1697 CD ARG B 30 67.441 4.735 -12.721 1.00 0.00 C ATOM 1698 NE ARG B 30 66.519 4.834 -13.892 1.00 0.00 N ATOM 1699 CZ ARG B 30 66.907 5.426 -15.000 1.00 0.00 C ATOM 1700 NH1 ARG B 30 68.104 5.940 -15.073 1.00 0.00 N ATOM 1701 NH2 ARG B 30 66.104 5.503 -16.033 1.00 0.00 N ATOM 0 H ARG B 30 63.164 3.488 -11.105 1.00 0.00 H new ATOM 0 HA ARG B 30 65.526 2.213 -10.300 1.00 0.00 H new ATOM 0 HB2 ARG B 30 64.831 4.296 -11.986 1.00 0.00 H new ATOM 0 HB3 ARG B 30 65.663 5.172 -10.717 1.00 0.00 H new ATOM 0 HG2 ARG B 30 67.606 3.570 -10.911 1.00 0.00 H new ATOM 0 HG3 ARG B 30 66.777 2.744 -12.216 1.00 0.00 H new ATOM 0 HD2 ARG B 30 67.539 5.708 -12.239 1.00 0.00 H new ATOM 0 HD3 ARG B 30 68.437 4.441 -13.053 1.00 0.00 H new ATOM 0 HE ARG B 30 65.581 4.439 -13.832 1.00 0.00 H new ATOM 0 HH11 ARG B 30 68.734 5.881 -14.273 1.00 0.00 H new ATOM 0 HH12 ARG B 30 68.410 6.400 -15.930 1.00 0.00 H new ATOM 0 HH21 ARG B 30 65.168 5.101 -15.982 1.00 0.00 H new ATOM 0 HH22 ARG B 30 66.415 5.965 -16.888 1.00 0.00 H new ATOM 1715 N ILE B 31 65.974 2.826 -7.932 1.00 0.00 N ATOM 1716 CA ILE B 31 66.389 3.251 -6.565 1.00 0.00 C ATOM 1717 C ILE B 31 67.621 4.159 -6.689 1.00 0.00 C ATOM 1718 O ILE B 31 68.454 3.973 -7.552 1.00 0.00 O ATOM 1719 CB ILE B 31 66.738 1.998 -5.723 1.00 0.00 C ATOM 1720 CG1 ILE B 31 65.461 1.420 -5.113 1.00 0.00 C ATOM 1721 CG2 ILE B 31 67.715 2.364 -4.589 1.00 0.00 C ATOM 1722 CD1 ILE B 31 65.803 0.156 -4.319 1.00 0.00 C ATOM 0 H ILE B 31 66.180 1.854 -8.163 1.00 0.00 H new ATOM 0 HA ILE B 31 65.581 3.793 -6.075 1.00 0.00 H new ATOM 0 HB ILE B 31 67.208 1.262 -6.375 1.00 0.00 H new ATOM 0 HG12 ILE B 31 64.991 2.156 -4.461 1.00 0.00 H new ATOM 0 HG13 ILE B 31 64.743 1.186 -5.899 1.00 0.00 H new ATOM 0 HG21 ILE B 31 67.949 1.472 -4.008 1.00 0.00 H new ATOM 0 HG22 ILE B 31 68.632 2.770 -5.016 1.00 0.00 H new ATOM 0 HG23 ILE B 31 67.256 3.110 -3.940 1.00 0.00 H new ATOM 0 HD11 ILE B 31 64.893 -0.257 -3.883 1.00 0.00 H new ATOM 0 HD12 ILE B 31 66.254 -0.581 -4.984 1.00 0.00 H new ATOM 0 HD13 ILE B 31 66.506 0.405 -3.524 1.00 0.00 H new ATOM 1734 N THR B 32 67.752 5.120 -5.822 1.00 0.00 N ATOM 1735 CA THR B 32 68.938 6.017 -5.882 1.00 0.00 C ATOM 1736 C THR B 32 68.955 6.925 -4.655 1.00 0.00 C ATOM 1737 O THR B 32 69.421 8.046 -4.707 1.00 0.00 O ATOM 1738 CB THR B 32 68.875 6.869 -7.148 1.00 0.00 C ATOM 1739 OG1 THR B 32 67.527 6.973 -7.585 1.00 0.00 O ATOM 1740 CG2 THR B 32 69.721 6.218 -8.240 1.00 0.00 C ATOM 0 H THR B 32 67.090 5.324 -5.074 1.00 0.00 H new ATOM 0 HA THR B 32 69.846 5.414 -5.899 1.00 0.00 H new ATOM 0 HB THR B 32 69.262 7.866 -6.936 1.00 0.00 H new ATOM 0 HG1 THR B 32 67.488 7.521 -8.396 1.00 0.00 H new ATOM 0 HG21 THR B 32 69.677 6.825 -9.144 1.00 0.00 H new ATOM 0 HG22 THR B 32 70.755 6.143 -7.903 1.00 0.00 H new ATOM 0 HG23 THR B 32 69.336 5.221 -8.453 1.00 0.00 H new ATOM 1748 N SER B 33 68.464 6.448 -3.545 1.00 0.00 N ATOM 1749 CA SER B 33 68.467 7.283 -2.316 1.00 0.00 C ATOM 1750 C SER B 33 69.906 7.688 -1.991 1.00 0.00 C ATOM 1751 O SER B 33 70.846 7.007 -2.347 1.00 0.00 O ATOM 1752 CB SER B 33 67.883 6.479 -1.151 1.00 0.00 C ATOM 1753 OG SER B 33 68.176 7.143 0.072 1.00 0.00 O ATOM 0 H SER B 33 68.062 5.517 -3.438 1.00 0.00 H new ATOM 0 HA SER B 33 67.862 8.176 -2.475 1.00 0.00 H new ATOM 0 HB2 SER B 33 66.805 6.373 -1.271 1.00 0.00 H new ATOM 0 HB3 SER B 33 68.303 5.473 -1.142 1.00 0.00 H new ATOM 0 HG SER B 33 67.398 7.093 0.666 1.00 0.00 H new ATOM 1759 N SER B 34 70.086 8.794 -1.326 1.00 0.00 N ATOM 1760 CA SER B 34 71.467 9.242 -0.988 1.00 0.00 C ATOM 1761 C SER B 34 72.077 8.311 0.069 1.00 0.00 C ATOM 1762 O SER B 34 73.242 8.414 0.398 1.00 0.00 O ATOM 1763 CB SER B 34 71.417 10.668 -0.440 1.00 0.00 C ATOM 1764 OG SER B 34 70.337 10.784 0.477 1.00 0.00 O ATOM 0 H SER B 34 69.338 9.407 -1.002 1.00 0.00 H new ATOM 0 HA SER B 34 72.083 9.214 -1.887 1.00 0.00 H new ATOM 0 HB2 SER B 34 72.357 10.912 0.055 1.00 0.00 H new ATOM 0 HB3 SER B 34 71.293 11.379 -1.257 1.00 0.00 H new ATOM 0 HG SER B 34 70.305 11.697 0.831 1.00 0.00 H new ATOM 1770 N LYS B 35 71.299 7.411 0.615 1.00 0.00 N ATOM 1771 CA LYS B 35 71.842 6.494 1.656 1.00 0.00 C ATOM 1772 C LYS B 35 72.080 5.096 1.061 1.00 0.00 C ATOM 1773 O LYS B 35 72.734 4.264 1.660 1.00 0.00 O ATOM 1774 CB LYS B 35 70.844 6.399 2.817 1.00 0.00 C ATOM 1775 CG LYS B 35 71.517 6.854 4.123 1.00 0.00 C ATOM 1776 CD LYS B 35 72.836 6.097 4.322 1.00 0.00 C ATOM 1777 CE LYS B 35 73.118 5.948 5.818 1.00 0.00 C ATOM 1778 NZ LYS B 35 74.081 7.000 6.248 1.00 0.00 N ATOM 0 H LYS B 35 70.315 7.274 0.384 1.00 0.00 H new ATOM 0 HA LYS B 35 72.792 6.886 2.019 1.00 0.00 H new ATOM 0 HB2 LYS B 35 69.973 7.020 2.611 1.00 0.00 H new ATOM 0 HB3 LYS B 35 70.488 5.374 2.919 1.00 0.00 H new ATOM 0 HG2 LYS B 35 71.705 7.927 4.091 1.00 0.00 H new ATOM 0 HG3 LYS B 35 70.852 6.672 4.967 1.00 0.00 H new ATOM 0 HD2 LYS B 35 72.778 5.115 3.852 1.00 0.00 H new ATOM 0 HD3 LYS B 35 73.652 6.634 3.839 1.00 0.00 H new ATOM 0 HE2 LYS B 35 72.191 6.035 6.384 1.00 0.00 H new ATOM 0 HE3 LYS B 35 73.527 4.959 6.025 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 74.273 6.900 7.265 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 74.969 6.897 5.716 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 73.674 7.939 6.064 1.00 0.00 H new ATOM 1792 N CYS B 36 71.561 4.826 -0.111 1.00 0.00 N ATOM 1793 CA CYS B 36 71.770 3.477 -0.721 1.00 0.00 C ATOM 1794 C CYS B 36 73.207 3.365 -1.257 1.00 0.00 C ATOM 1795 O CYS B 36 73.663 4.229 -1.979 1.00 0.00 O ATOM 1796 CB CYS B 36 70.778 3.266 -1.871 1.00 0.00 C ATOM 1797 SG CYS B 36 69.109 3.014 -1.203 1.00 0.00 S ATOM 0 H CYS B 36 71.006 5.476 -0.668 1.00 0.00 H new ATOM 0 HA CYS B 36 71.607 2.714 0.040 1.00 0.00 H new ATOM 0 HB2 CYS B 36 70.787 4.130 -2.535 1.00 0.00 H new ATOM 0 HB3 CYS B 36 71.076 2.403 -2.467 1.00 0.00 H new ATOM 1802 N PRO B 37 73.885 2.292 -0.878 1.00 0.00 N ATOM 1803 CA PRO B 37 75.260 2.058 -1.306 1.00 0.00 C ATOM 1804 C PRO B 37 75.332 1.880 -2.820 1.00 0.00 C ATOM 1805 O PRO B 37 76.374 2.033 -3.426 1.00 0.00 O ATOM 1806 CB PRO B 37 75.677 0.754 -0.611 1.00 0.00 C ATOM 1807 CG PRO B 37 74.446 0.231 0.187 1.00 0.00 C ATOM 1808 CD PRO B 37 73.323 1.256 0.003 1.00 0.00 C ATOM 0 HA PRO B 37 75.909 2.896 -1.050 1.00 0.00 H new ATOM 0 HB2 PRO B 37 76.000 0.015 -1.345 1.00 0.00 H new ATOM 0 HB3 PRO B 37 76.520 0.929 0.057 1.00 0.00 H new ATOM 0 HG2 PRO B 37 74.138 -0.748 -0.179 1.00 0.00 H new ATOM 0 HG3 PRO B 37 74.692 0.114 1.242 1.00 0.00 H new ATOM 0 HD2 PRO B 37 72.440 0.797 -0.442 1.00 0.00 H new ATOM 0 HD3 PRO B 37 73.015 1.678 0.960 1.00 0.00 H new ATOM 1816 N LYS B 38 74.244 1.525 -3.432 1.00 0.00 N ATOM 1817 CA LYS B 38 74.263 1.301 -4.895 1.00 0.00 C ATOM 1818 C LYS B 38 72.892 1.606 -5.500 1.00 0.00 C ATOM 1819 O LYS B 38 71.873 1.164 -5.008 1.00 0.00 O ATOM 1820 CB LYS B 38 74.613 -0.163 -5.172 1.00 0.00 C ATOM 1821 CG LYS B 38 76.130 -0.348 -5.123 1.00 0.00 C ATOM 1822 CD LYS B 38 76.584 -1.147 -6.347 1.00 0.00 C ATOM 1823 CE LYS B 38 78.100 -1.019 -6.507 1.00 0.00 C ATOM 1824 NZ LYS B 38 78.498 -1.497 -7.861 1.00 0.00 N ATOM 0 H LYS B 38 73.341 1.380 -2.981 1.00 0.00 H new ATOM 0 HA LYS B 38 75.005 1.961 -5.344 1.00 0.00 H new ATOM 0 HB2 LYS B 38 74.134 -0.807 -4.435 1.00 0.00 H new ATOM 0 HB3 LYS B 38 74.232 -0.459 -6.149 1.00 0.00 H new ATOM 0 HG2 LYS B 38 76.625 0.623 -5.104 1.00 0.00 H new ATOM 0 HG3 LYS B 38 76.415 -0.869 -4.209 1.00 0.00 H new ATOM 0 HD2 LYS B 38 76.307 -2.195 -6.233 1.00 0.00 H new ATOM 0 HD3 LYS B 38 76.081 -0.779 -7.241 1.00 0.00 H new ATOM 0 HE2 LYS B 38 78.404 0.019 -6.372 1.00 0.00 H new ATOM 0 HE3 LYS B 38 78.608 -1.603 -5.739 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 79.529 -1.410 -7.971 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 78.220 -2.493 -7.973 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 78.023 -0.922 -8.586 1.00 0.00 H new ATOM 1838 N GLU B 39 72.863 2.319 -6.595 1.00 0.00 N ATOM 1839 CA GLU B 39 71.563 2.602 -7.261 1.00 0.00 C ATOM 1840 C GLU B 39 70.974 1.276 -7.744 1.00 0.00 C ATOM 1841 O GLU B 39 71.530 0.224 -7.500 1.00 0.00 O ATOM 1842 CB GLU B 39 71.790 3.529 -8.457 1.00 0.00 C ATOM 1843 CG GLU B 39 72.671 4.706 -8.032 1.00 0.00 C ATOM 1844 CD GLU B 39 72.642 5.786 -9.116 1.00 0.00 C ATOM 1845 OE1 GLU B 39 71.741 5.750 -9.938 1.00 0.00 O ATOM 1846 OE2 GLU B 39 73.522 6.631 -9.107 1.00 0.00 O ATOM 0 H GLU B 39 73.683 2.716 -7.054 1.00 0.00 H new ATOM 0 HA GLU B 39 70.880 3.086 -6.564 1.00 0.00 H new ATOM 0 HB2 GLU B 39 72.265 2.981 -9.270 1.00 0.00 H new ATOM 0 HB3 GLU B 39 70.835 3.894 -8.834 1.00 0.00 H new ATOM 0 HG2 GLU B 39 72.316 5.116 -7.086 1.00 0.00 H new ATOM 0 HG3 GLU B 39 73.694 4.367 -7.869 1.00 0.00 H new ATOM 1853 N ALA B 40 69.863 1.305 -8.424 1.00 0.00 N ATOM 1854 CA ALA B 40 69.270 0.025 -8.905 1.00 0.00 C ATOM 1855 C ALA B 40 67.972 0.294 -9.652 1.00 0.00 C ATOM 1856 O ALA B 40 67.540 1.419 -9.790 1.00 0.00 O ATOM 1857 CB ALA B 40 68.968 -0.876 -7.702 1.00 0.00 C ATOM 0 H ALA B 40 69.344 2.149 -8.666 1.00 0.00 H new ATOM 0 HA ALA B 40 69.979 -0.462 -9.575 1.00 0.00 H new ATOM 0 HB1 ALA B 40 68.534 -1.814 -8.049 1.00 0.00 H new ATOM 0 HB2 ALA B 40 69.891 -1.082 -7.161 1.00 0.00 H new ATOM 0 HB3 ALA B 40 68.263 -0.374 -7.039 1.00 0.00 H new ATOM 1863 N VAL B 41 67.323 -0.746 -10.088 1.00 0.00 N ATOM 1864 CA VAL B 41 66.015 -0.584 -10.767 1.00 0.00 C ATOM 1865 C VAL B 41 65.062 -1.589 -10.193 1.00 0.00 C ATOM 1866 O VAL B 41 65.160 -2.768 -10.457 1.00 0.00 O ATOM 1867 CB VAL B 41 66.143 -0.817 -12.279 1.00 0.00 C ATOM 1868 CG1 VAL B 41 64.820 -1.366 -12.841 1.00 0.00 C ATOM 1869 CG2 VAL B 41 66.438 0.496 -12.956 1.00 0.00 C ATOM 0 H VAL B 41 67.647 -1.709 -10.001 1.00 0.00 H new ATOM 0 HA VAL B 41 65.655 0.433 -10.610 1.00 0.00 H new ATOM 0 HB VAL B 41 66.945 -1.532 -12.462 1.00 0.00 H new ATOM 0 HG11 VAL B 41 64.920 -1.528 -13.914 1.00 0.00 H new ATOM 0 HG12 VAL B 41 64.581 -2.310 -12.352 1.00 0.00 H new ATOM 0 HG13 VAL B 41 64.020 -0.649 -12.655 1.00 0.00 H new ATOM 0 HG21 VAL B 41 66.530 0.339 -14.031 1.00 0.00 H new ATOM 0 HG22 VAL B 41 65.626 1.197 -12.760 1.00 0.00 H new ATOM 0 HG23 VAL B 41 67.371 0.904 -12.568 1.00 0.00 H new ATOM 1879 N ILE B 42 64.128 -1.149 -9.445 1.00 0.00 N ATOM 1880 CA ILE B 42 63.165 -2.085 -8.889 1.00 0.00 C ATOM 1881 C ILE B 42 62.198 -2.503 -9.987 1.00 0.00 C ATOM 1882 O ILE B 42 61.160 -1.906 -10.187 1.00 0.00 O ATOM 1883 CB ILE B 42 62.440 -1.425 -7.741 1.00 0.00 C ATOM 1884 CG1 ILE B 42 63.473 -1.122 -6.641 1.00 0.00 C ATOM 1885 CG2 ILE B 42 61.359 -2.368 -7.223 1.00 0.00 C ATOM 1886 CD1 ILE B 42 62.773 -0.730 -5.348 1.00 0.00 C ATOM 0 H ILE B 42 63.988 -0.171 -9.192 1.00 0.00 H new ATOM 0 HA ILE B 42 63.666 -2.976 -8.509 1.00 0.00 H new ATOM 0 HB ILE B 42 61.962 -0.498 -8.058 1.00 0.00 H new ATOM 0 HG12 ILE B 42 64.100 -1.997 -6.471 1.00 0.00 H new ATOM 0 HG13 ILE B 42 64.132 -0.316 -6.964 1.00 0.00 H new ATOM 0 HG21 ILE B 42 60.832 -1.897 -6.394 1.00 0.00 H new ATOM 0 HG22 ILE B 42 60.653 -2.587 -8.024 1.00 0.00 H new ATOM 0 HG23 ILE B 42 61.819 -3.295 -6.881 1.00 0.00 H new ATOM 0 HD11 ILE B 42 63.518 -0.519 -4.581 1.00 0.00 H new ATOM 0 HD12 ILE B 42 62.166 0.159 -5.518 1.00 0.00 H new ATOM 0 HD13 ILE B 42 62.134 -1.549 -5.018 1.00 0.00 H new ATOM 1898 N PHE B 43 62.557 -3.517 -10.713 1.00 0.00 N ATOM 1899 CA PHE B 43 61.703 -3.987 -11.828 1.00 0.00 C ATOM 1900 C PHE B 43 60.528 -4.793 -11.271 1.00 0.00 C ATOM 1901 O PHE B 43 60.540 -6.009 -11.289 1.00 0.00 O ATOM 1902 CB PHE B 43 62.529 -4.892 -12.754 1.00 0.00 C ATOM 1903 CG PHE B 43 63.238 -4.066 -13.810 1.00 0.00 C ATOM 1904 CD1 PHE B 43 62.563 -2.987 -14.425 1.00 0.00 C ATOM 1905 CD2 PHE B 43 64.574 -4.361 -14.177 1.00 0.00 C ATOM 1906 CE1 PHE B 43 63.219 -2.207 -15.403 1.00 0.00 C ATOM 1907 CE2 PHE B 43 65.226 -3.576 -15.155 1.00 0.00 C ATOM 1908 CZ PHE B 43 64.550 -2.503 -15.766 1.00 0.00 C ATOM 0 H PHE B 43 63.418 -4.047 -10.579 1.00 0.00 H new ATOM 0 HA PHE B 43 61.330 -3.126 -12.382 1.00 0.00 H new ATOM 0 HB2 PHE B 43 63.260 -5.450 -12.169 1.00 0.00 H new ATOM 0 HB3 PHE B 43 61.878 -5.624 -13.233 1.00 0.00 H new ATOM 0 HD1 PHE B 43 61.545 -2.759 -14.147 1.00 0.00 H new ATOM 0 HD2 PHE B 43 65.094 -5.185 -13.710 1.00 0.00 H new ATOM 0 HE1 PHE B 43 62.702 -1.384 -15.873 1.00 0.00 H new ATOM 0 HE2 PHE B 43 66.245 -3.800 -15.434 1.00 0.00 H new ATOM 0 HZ PHE B 43 65.051 -1.906 -16.514 1.00 0.00 H new ATOM 1918 N LYS B 44 59.506 -4.140 -10.785 1.00 0.00 N ATOM 1919 CA LYS B 44 58.341 -4.897 -10.245 1.00 0.00 C ATOM 1920 C LYS B 44 57.817 -5.822 -11.330 1.00 0.00 C ATOM 1921 O LYS B 44 57.113 -5.402 -12.218 1.00 0.00 O ATOM 1922 CB LYS B 44 57.227 -3.926 -9.839 1.00 0.00 C ATOM 1923 CG LYS B 44 56.959 -4.054 -8.339 1.00 0.00 C ATOM 1924 CD LYS B 44 55.530 -3.602 -8.037 1.00 0.00 C ATOM 1925 CE LYS B 44 55.407 -3.260 -6.550 1.00 0.00 C ATOM 1926 NZ LYS B 44 54.028 -2.771 -6.265 1.00 0.00 N ATOM 0 H LYS B 44 59.428 -3.124 -10.739 1.00 0.00 H new ATOM 0 HA LYS B 44 58.653 -5.470 -9.372 1.00 0.00 H new ATOM 0 HB2 LYS B 44 57.516 -2.903 -10.081 1.00 0.00 H new ATOM 0 HB3 LYS B 44 56.319 -4.143 -10.401 1.00 0.00 H new ATOM 0 HG2 LYS B 44 57.100 -5.087 -8.020 1.00 0.00 H new ATOM 0 HG3 LYS B 44 57.670 -3.447 -7.778 1.00 0.00 H new ATOM 0 HD2 LYS B 44 55.276 -2.732 -8.643 1.00 0.00 H new ATOM 0 HD3 LYS B 44 54.825 -4.390 -8.299 1.00 0.00 H new ATOM 0 HE2 LYS B 44 55.625 -4.140 -5.944 1.00 0.00 H new ATOM 0 HE3 LYS B 44 56.138 -2.498 -6.280 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 53.944 -2.539 -5.255 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 53.837 -1.921 -6.833 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 53.340 -3.512 -6.508 1.00 0.00 H new ATOM 1940 N THR B 45 58.174 -7.073 -11.280 1.00 0.00 N ATOM 1941 CA THR B 45 57.711 -8.017 -12.329 1.00 0.00 C ATOM 1942 C THR B 45 56.167 -8.072 -12.328 1.00 0.00 C ATOM 1943 O THR B 45 55.510 -7.145 -11.905 1.00 0.00 O ATOM 1944 CB THR B 45 58.308 -9.399 -12.058 1.00 0.00 C ATOM 1945 OG1 THR B 45 58.262 -9.672 -10.666 1.00 0.00 O ATOM 1946 CG2 THR B 45 59.758 -9.410 -12.537 1.00 0.00 C ATOM 0 H THR B 45 58.767 -7.482 -10.557 1.00 0.00 H new ATOM 0 HA THR B 45 58.041 -7.680 -13.311 1.00 0.00 H new ATOM 0 HB THR B 45 57.738 -10.161 -12.589 1.00 0.00 H new ATOM 0 HG1 THR B 45 59.097 -9.376 -10.247 1.00 0.00 H new ATOM 0 HG21 THR B 45 60.196 -10.390 -12.349 1.00 0.00 H new ATOM 0 HG22 THR B 45 59.790 -9.197 -13.605 1.00 0.00 H new ATOM 0 HG23 THR B 45 60.325 -8.651 -11.998 1.00 0.00 H new ATOM 1954 N ILE B 46 55.583 -9.150 -12.789 1.00 0.00 N ATOM 1955 CA ILE B 46 54.090 -9.236 -12.805 1.00 0.00 C ATOM 1956 C ILE B 46 53.622 -9.881 -11.543 1.00 0.00 C ATOM 1957 O ILE B 46 52.532 -9.630 -11.065 1.00 0.00 O ATOM 1958 CB ILE B 46 53.614 -10.089 -13.982 1.00 0.00 C ATOM 1959 CG1 ILE B 46 54.432 -11.407 -14.042 1.00 0.00 C ATOM 1960 CG2 ILE B 46 53.753 -9.298 -15.295 1.00 0.00 C ATOM 1961 CD1 ILE B 46 55.675 -11.247 -14.929 1.00 0.00 C ATOM 0 H ILE B 46 56.071 -9.969 -13.152 1.00 0.00 H new ATOM 0 HA ILE B 46 53.686 -8.228 -12.899 1.00 0.00 H new ATOM 0 HB ILE B 46 52.563 -10.341 -13.844 1.00 0.00 H new ATOM 0 HG12 ILE B 46 54.735 -11.697 -13.036 1.00 0.00 H new ATOM 0 HG13 ILE B 46 53.805 -12.210 -14.430 1.00 0.00 H new ATOM 0 HG21 ILE B 46 53.412 -9.913 -16.128 1.00 0.00 H new ATOM 0 HG22 ILE B 46 53.148 -8.393 -15.240 1.00 0.00 H new ATOM 0 HG23 ILE B 46 54.798 -9.027 -15.448 1.00 0.00 H new ATOM 0 HD11 ILE B 46 56.229 -12.186 -14.952 1.00 0.00 H new ATOM 0 HD12 ILE B 46 55.368 -10.981 -15.941 1.00 0.00 H new ATOM 0 HD13 ILE B 46 56.312 -10.460 -14.525 1.00 0.00 H new ATOM 1973 N VAL B 47 54.429 -10.707 -10.985 1.00 0.00 N ATOM 1974 CA VAL B 47 54.044 -11.371 -9.750 1.00 0.00 C ATOM 1975 C VAL B 47 54.468 -10.496 -8.567 1.00 0.00 C ATOM 1976 O VAL B 47 54.519 -10.939 -7.438 1.00 0.00 O ATOM 1977 CB VAL B 47 54.723 -12.727 -9.698 1.00 0.00 C ATOM 1978 CG1 VAL B 47 56.224 -12.562 -9.451 1.00 0.00 C ATOM 1979 CG2 VAL B 47 54.103 -13.545 -8.591 1.00 0.00 C ATOM 0 H VAL B 47 55.353 -10.951 -11.341 1.00 0.00 H new ATOM 0 HA VAL B 47 52.965 -11.518 -9.704 1.00 0.00 H new ATOM 0 HB VAL B 47 54.587 -13.237 -10.652 1.00 0.00 H new ATOM 0 HG11 VAL B 47 56.697 -13.543 -9.416 1.00 0.00 H new ATOM 0 HG12 VAL B 47 56.663 -11.976 -10.258 1.00 0.00 H new ATOM 0 HG13 VAL B 47 56.382 -12.049 -8.502 1.00 0.00 H new ATOM 0 HG21 VAL B 47 54.585 -14.522 -8.546 1.00 0.00 H new ATOM 0 HG22 VAL B 47 54.237 -13.030 -7.640 1.00 0.00 H new ATOM 0 HG23 VAL B 47 53.039 -13.675 -8.787 1.00 0.00 H new ATOM 1989 N ALA B 48 54.754 -9.238 -8.826 1.00 0.00 N ATOM 1990 CA ALA B 48 55.148 -8.320 -7.739 1.00 0.00 C ATOM 1991 C ALA B 48 56.540 -8.687 -7.230 1.00 0.00 C ATOM 1992 O ALA B 48 56.938 -8.295 -6.151 1.00 0.00 O ATOM 1993 CB ALA B 48 54.137 -8.422 -6.612 1.00 0.00 C ATOM 0 H ALA B 48 54.727 -8.818 -9.755 1.00 0.00 H new ATOM 0 HA ALA B 48 55.172 -7.297 -8.113 1.00 0.00 H new ATOM 0 HB1 ALA B 48 54.422 -7.746 -5.805 1.00 0.00 H new ATOM 0 HB2 ALA B 48 53.149 -8.148 -6.983 1.00 0.00 H new ATOM 0 HB3 ALA B 48 54.112 -9.445 -6.237 1.00 0.00 H new ATOM 1999 N LYS B 49 57.294 -9.416 -8.005 1.00 0.00 N ATOM 2000 CA LYS B 49 58.666 -9.779 -7.573 1.00 0.00 C ATOM 2001 C LYS B 49 59.605 -8.619 -7.890 1.00 0.00 C ATOM 2002 O LYS B 49 60.323 -8.638 -8.868 1.00 0.00 O ATOM 2003 CB LYS B 49 59.127 -11.029 -8.314 1.00 0.00 C ATOM 2004 CG LYS B 49 59.451 -12.132 -7.306 1.00 0.00 C ATOM 2005 CD LYS B 49 59.337 -13.498 -7.986 1.00 0.00 C ATOM 2006 CE LYS B 49 60.410 -13.618 -9.070 1.00 0.00 C ATOM 2007 NZ LYS B 49 60.101 -14.783 -9.948 1.00 0.00 N ATOM 0 H LYS B 49 57.016 -9.775 -8.919 1.00 0.00 H new ATOM 0 HA LYS B 49 58.674 -9.980 -6.502 1.00 0.00 H new ATOM 0 HB2 LYS B 49 58.349 -11.366 -8.999 1.00 0.00 H new ATOM 0 HB3 LYS B 49 60.007 -10.803 -8.917 1.00 0.00 H new ATOM 0 HG2 LYS B 49 60.458 -11.994 -6.911 1.00 0.00 H new ATOM 0 HG3 LYS B 49 58.767 -12.078 -6.459 1.00 0.00 H new ATOM 0 HD2 LYS B 49 59.457 -14.294 -7.251 1.00 0.00 H new ATOM 0 HD3 LYS B 49 58.346 -13.616 -8.425 1.00 0.00 H new ATOM 0 HE2 LYS B 49 60.449 -12.703 -9.662 1.00 0.00 H new ATOM 0 HE3 LYS B 49 61.392 -13.744 -8.613 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 60.830 -14.865 -10.685 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 60.085 -15.653 -9.378 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 59.172 -14.645 -10.394 1.00 0.00 H new ATOM 2021 N GLU B 50 59.598 -7.602 -7.074 1.00 0.00 N ATOM 2022 CA GLU B 50 60.483 -6.430 -7.329 1.00 0.00 C ATOM 2023 C GLU B 50 61.914 -6.914 -7.547 1.00 0.00 C ATOM 2024 O GLU B 50 62.520 -7.497 -6.670 1.00 0.00 O ATOM 2025 CB GLU B 50 60.441 -5.494 -6.123 1.00 0.00 C ATOM 2026 CG GLU B 50 58.987 -5.241 -5.723 1.00 0.00 C ATOM 2027 CD GLU B 50 58.863 -3.844 -5.110 1.00 0.00 C ATOM 2028 OE1 GLU B 50 59.487 -3.611 -4.088 1.00 0.00 O ATOM 2029 OE2 GLU B 50 58.148 -3.032 -5.674 1.00 0.00 O ATOM 0 H GLU B 50 59.016 -7.531 -6.239 1.00 0.00 H new ATOM 0 HA GLU B 50 60.140 -5.898 -8.216 1.00 0.00 H new ATOM 0 HB2 GLU B 50 60.987 -5.934 -5.289 1.00 0.00 H new ATOM 0 HB3 GLU B 50 60.932 -4.551 -6.364 1.00 0.00 H new ATOM 0 HG2 GLU B 50 58.339 -5.326 -6.595 1.00 0.00 H new ATOM 0 HG3 GLU B 50 58.659 -5.995 -5.007 1.00 0.00 H new ATOM 2036 N ILE B 51 62.462 -6.696 -8.714 1.00 0.00 N ATOM 2037 CA ILE B 51 63.854 -7.173 -8.965 1.00 0.00 C ATOM 2038 C ILE B 51 64.785 -6.007 -9.216 1.00 0.00 C ATOM 2039 O ILE B 51 64.851 -5.480 -10.307 1.00 0.00 O ATOM 2040 CB ILE B 51 63.920 -8.080 -10.190 1.00 0.00 C ATOM 2041 CG1 ILE B 51 62.544 -8.581 -10.579 1.00 0.00 C ATOM 2042 CG2 ILE B 51 64.809 -9.272 -9.877 1.00 0.00 C ATOM 2043 CD1 ILE B 51 62.675 -9.321 -11.892 1.00 0.00 C ATOM 0 H ILE B 51 62.014 -6.215 -9.494 1.00 0.00 H new ATOM 0 HA ILE B 51 64.158 -7.724 -8.075 1.00 0.00 H new ATOM 0 HB ILE B 51 64.325 -7.504 -11.022 1.00 0.00 H new ATOM 0 HG12 ILE B 51 62.145 -9.240 -9.808 1.00 0.00 H new ATOM 0 HG13 ILE B 51 61.848 -7.748 -10.678 1.00 0.00 H new ATOM 0 HG21 ILE B 51 64.861 -9.925 -10.748 1.00 0.00 H new ATOM 0 HG22 ILE B 51 65.810 -8.923 -9.625 1.00 0.00 H new ATOM 0 HG23 ILE B 51 64.394 -9.824 -9.034 1.00 0.00 H new ATOM 0 HD11 ILE B 51 61.698 -9.694 -12.198 1.00 0.00 H new ATOM 0 HD12 ILE B 51 63.060 -8.644 -12.654 1.00 0.00 H new ATOM 0 HD13 ILE B 51 63.362 -10.159 -11.771 1.00 0.00 H new ATOM 2055 N CYS B 52 65.575 -5.658 -8.257 1.00 0.00 N ATOM 2056 CA CYS B 52 66.569 -4.588 -8.485 1.00 0.00 C ATOM 2057 C CYS B 52 67.477 -5.032 -9.624 1.00 0.00 C ATOM 2058 O CYS B 52 67.992 -6.125 -9.621 1.00 0.00 O ATOM 2059 CB CYS B 52 67.387 -4.379 -7.222 1.00 0.00 C ATOM 2060 SG CYS B 52 66.445 -3.339 -6.080 1.00 0.00 S ATOM 0 H CYS B 52 65.578 -6.066 -7.322 1.00 0.00 H new ATOM 0 HA CYS B 52 66.075 -3.650 -8.739 1.00 0.00 H new ATOM 0 HB2 CYS B 52 67.615 -5.338 -6.757 1.00 0.00 H new ATOM 0 HB3 CYS B 52 68.339 -3.907 -7.463 1.00 0.00 H new ATOM 2065 N ALA B 53 67.641 -4.219 -10.616 1.00 0.00 N ATOM 2066 CA ALA B 53 68.483 -4.625 -11.772 1.00 0.00 C ATOM 2067 C ALA B 53 69.526 -3.541 -12.048 1.00 0.00 C ATOM 2068 O ALA B 53 69.261 -2.364 -11.914 1.00 0.00 O ATOM 2069 CB ALA B 53 67.590 -4.825 -13.001 1.00 0.00 C ATOM 0 H ALA B 53 67.230 -3.288 -10.682 1.00 0.00 H new ATOM 0 HA ALA B 53 68.996 -5.560 -11.547 1.00 0.00 H new ATOM 0 HB1 ALA B 53 68.203 -5.123 -13.852 1.00 0.00 H new ATOM 0 HB2 ALA B 53 66.855 -5.602 -12.794 1.00 0.00 H new ATOM 0 HB3 ALA B 53 67.076 -3.892 -13.233 1.00 0.00 H new ATOM 2075 N ASP B 54 70.715 -3.931 -12.419 1.00 0.00 N ATOM 2076 CA ASP B 54 71.786 -2.928 -12.684 1.00 0.00 C ATOM 2077 C ASP B 54 71.365 -2.012 -13.853 1.00 0.00 C ATOM 2078 O ASP B 54 71.263 -2.465 -14.975 1.00 0.00 O ATOM 2079 CB ASP B 54 73.079 -3.660 -13.056 1.00 0.00 C ATOM 2080 CG ASP B 54 74.178 -2.638 -13.350 1.00 0.00 C ATOM 2081 OD1 ASP B 54 74.553 -1.921 -12.438 1.00 0.00 O ATOM 2082 OD2 ASP B 54 74.625 -2.589 -14.484 1.00 0.00 O ATOM 0 H ASP B 54 70.992 -4.904 -12.550 1.00 0.00 H new ATOM 0 HA ASP B 54 71.945 -2.323 -11.791 1.00 0.00 H new ATOM 0 HB2 ASP B 54 73.386 -4.315 -12.241 1.00 0.00 H new ATOM 0 HB3 ASP B 54 72.913 -4.292 -13.928 1.00 0.00 H new ATOM 2087 N PRO B 55 71.141 -0.737 -13.560 1.00 0.00 N ATOM 2088 CA PRO B 55 70.749 0.228 -14.591 1.00 0.00 C ATOM 2089 C PRO B 55 71.871 0.383 -15.624 1.00 0.00 C ATOM 2090 O PRO B 55 71.664 0.890 -16.708 1.00 0.00 O ATOM 2091 CB PRO B 55 70.528 1.552 -13.839 1.00 0.00 C ATOM 2092 CG PRO B 55 70.863 1.297 -12.336 1.00 0.00 C ATOM 2093 CD PRO B 55 71.260 -0.185 -12.201 1.00 0.00 C ATOM 0 HA PRO B 55 69.857 -0.088 -15.131 1.00 0.00 H new ATOM 0 HB2 PRO B 55 71.166 2.336 -14.247 1.00 0.00 H new ATOM 0 HB3 PRO B 55 69.498 1.889 -13.951 1.00 0.00 H new ATOM 0 HG2 PRO B 55 71.677 1.944 -12.008 1.00 0.00 H new ATOM 0 HG3 PRO B 55 70.002 1.523 -11.707 1.00 0.00 H new ATOM 0 HD2 PRO B 55 72.276 -0.288 -11.821 1.00 0.00 H new ATOM 0 HD3 PRO B 55 70.604 -0.707 -11.504 1.00 0.00 H new ATOM 2101 N LYS B 56 73.063 -0.044 -15.291 1.00 0.00 N ATOM 2102 CA LYS B 56 74.192 0.087 -16.242 1.00 0.00 C ATOM 2103 C LYS B 56 74.276 -1.161 -17.128 1.00 0.00 C ATOM 2104 O LYS B 56 75.283 -1.416 -17.758 1.00 0.00 O ATOM 2105 CB LYS B 56 75.498 0.245 -15.461 1.00 0.00 C ATOM 2106 CG LYS B 56 75.717 1.721 -15.125 1.00 0.00 C ATOM 2107 CD LYS B 56 75.485 1.944 -13.629 1.00 0.00 C ATOM 2108 CE LYS B 56 76.210 3.214 -13.184 1.00 0.00 C ATOM 2109 NZ LYS B 56 77.601 2.874 -12.773 1.00 0.00 N ATOM 0 H LYS B 56 73.297 -0.478 -14.398 1.00 0.00 H new ATOM 0 HA LYS B 56 74.031 0.963 -16.871 1.00 0.00 H new ATOM 0 HB2 LYS B 56 75.460 -0.345 -14.546 1.00 0.00 H new ATOM 0 HB3 LYS B 56 76.334 -0.133 -16.050 1.00 0.00 H new ATOM 0 HG2 LYS B 56 76.730 2.020 -15.395 1.00 0.00 H new ATOM 0 HG3 LYS B 56 75.035 2.342 -15.706 1.00 0.00 H new ATOM 0 HD2 LYS B 56 74.418 2.031 -13.425 1.00 0.00 H new ATOM 0 HD3 LYS B 56 75.849 1.087 -13.062 1.00 0.00 H new ATOM 0 HE2 LYS B 56 76.227 3.940 -13.997 1.00 0.00 H new ATOM 0 HE3 LYS B 56 75.677 3.678 -12.354 1.00 0.00 H new ATOM 0 HZ1 LYS B 56 78.094 3.738 -12.470 1.00 0.00 H new ATOM 0 HZ2 LYS B 56 77.574 2.196 -11.985 1.00 0.00 H new ATOM 0 HZ3 LYS B 56 78.107 2.450 -13.577 1.00 0.00 H new ATOM 2123 N GLN B 57 73.228 -1.939 -17.188 1.00 0.00 N ATOM 2124 CA GLN B 57 73.260 -3.161 -18.039 1.00 0.00 C ATOM 2125 C GLN B 57 72.775 -2.810 -19.446 1.00 0.00 C ATOM 2126 O GLN B 57 72.300 -1.719 -19.694 1.00 0.00 O ATOM 2127 CB GLN B 57 72.343 -4.229 -17.436 1.00 0.00 C ATOM 2128 CG GLN B 57 73.185 -5.416 -16.962 1.00 0.00 C ATOM 2129 CD GLN B 57 73.959 -5.999 -18.147 1.00 0.00 C ATOM 2130 OE1 GLN B 57 73.438 -6.809 -18.888 1.00 0.00 O ATOM 2131 NE2 GLN B 57 75.189 -5.619 -18.358 1.00 0.00 N ATOM 0 H GLN B 57 72.354 -1.781 -16.686 1.00 0.00 H new ATOM 0 HA GLN B 57 74.279 -3.544 -18.088 1.00 0.00 H new ATOM 0 HB2 GLN B 57 71.781 -3.811 -16.601 1.00 0.00 H new ATOM 0 HB3 GLN B 57 71.615 -4.559 -18.177 1.00 0.00 H new ATOM 0 HG2 GLN B 57 73.878 -5.096 -16.184 1.00 0.00 H new ATOM 0 HG3 GLN B 57 72.542 -6.179 -16.523 1.00 0.00 H new ATOM 0 HE21 GLN B 57 75.627 -4.939 -17.736 1.00 0.00 H new ATOM 0 HE22 GLN B 57 75.713 -6.002 -19.145 1.00 0.00 H new ATOM 2140 N LYS B 58 72.896 -3.720 -20.371 1.00 0.00 N ATOM 2141 CA LYS B 58 72.446 -3.429 -21.760 1.00 0.00 C ATOM 2142 C LYS B 58 71.015 -3.943 -21.959 1.00 0.00 C ATOM 2143 O LYS B 58 70.338 -3.563 -22.893 1.00 0.00 O ATOM 2144 CB LYS B 58 73.393 -4.117 -22.761 1.00 0.00 C ATOM 2145 CG LYS B 58 72.796 -4.068 -24.182 1.00 0.00 C ATOM 2146 CD LYS B 58 72.381 -2.632 -24.528 1.00 0.00 C ATOM 2147 CE LYS B 58 72.975 -2.241 -25.883 1.00 0.00 C ATOM 2148 NZ LYS B 58 74.148 -1.347 -25.672 1.00 0.00 N ATOM 0 H LYS B 58 73.286 -4.651 -20.226 1.00 0.00 H new ATOM 0 HA LYS B 58 72.464 -2.352 -21.929 1.00 0.00 H new ATOM 0 HB2 LYS B 58 74.365 -3.624 -22.750 1.00 0.00 H new ATOM 0 HB3 LYS B 58 73.558 -5.153 -22.464 1.00 0.00 H new ATOM 0 HG2 LYS B 58 73.528 -4.428 -24.905 1.00 0.00 H new ATOM 0 HG3 LYS B 58 71.932 -4.730 -24.246 1.00 0.00 H new ATOM 0 HD2 LYS B 58 71.294 -2.554 -24.559 1.00 0.00 H new ATOM 0 HD3 LYS B 58 72.728 -1.946 -23.755 1.00 0.00 H new ATOM 0 HE2 LYS B 58 73.278 -3.134 -26.430 1.00 0.00 H new ATOM 0 HE3 LYS B 58 72.223 -1.735 -26.489 1.00 0.00 H new ATOM 0 HZ1 LYS B 58 74.552 -1.081 -26.593 1.00 0.00 H new ATOM 0 HZ2 LYS B 58 73.845 -0.490 -25.166 1.00 0.00 H new ATOM 0 HZ3 LYS B 58 74.867 -1.845 -25.109 1.00 0.00 H new ATOM 2162 N TRP B 59 70.541 -4.790 -21.086 1.00 0.00 N ATOM 2163 CA TRP B 59 69.154 -5.295 -21.238 1.00 0.00 C ATOM 2164 C TRP B 59 68.230 -4.453 -20.367 1.00 0.00 C ATOM 2165 O TRP B 59 67.066 -4.285 -20.659 1.00 0.00 O ATOM 2166 CB TRP B 59 69.089 -6.783 -20.837 1.00 0.00 C ATOM 2167 CG TRP B 59 69.118 -6.933 -19.344 1.00 0.00 C ATOM 2168 CD1 TRP B 59 70.240 -6.985 -18.585 1.00 0.00 C ATOM 2169 CD2 TRP B 59 67.997 -7.070 -18.431 1.00 0.00 C ATOM 2170 NE1 TRP B 59 69.875 -7.146 -17.255 1.00 0.00 N ATOM 2171 CE2 TRP B 59 68.503 -7.204 -17.108 1.00 0.00 C ATOM 2172 CE3 TRP B 59 66.590 -7.091 -18.616 1.00 0.00 C ATOM 2173 CZ2 TRP B 59 67.644 -7.357 -16.004 1.00 0.00 C ATOM 2174 CZ3 TRP B 59 65.727 -7.245 -17.504 1.00 0.00 C ATOM 2175 CH2 TRP B 59 66.262 -7.378 -16.201 1.00 0.00 C ATOM 0 H TRP B 59 71.053 -5.150 -20.281 1.00 0.00 H new ATOM 0 HA TRP B 59 68.836 -5.215 -22.277 1.00 0.00 H new ATOM 0 HB2 TRP B 59 68.179 -7.232 -21.235 1.00 0.00 H new ATOM 0 HB3 TRP B 59 69.929 -7.320 -21.278 1.00 0.00 H new ATOM 0 HD1 TRP B 59 71.252 -6.913 -18.954 1.00 0.00 H new ATOM 0 HE1 TRP B 59 70.538 -7.213 -16.483 1.00 0.00 H new ATOM 0 HE3 TRP B 59 66.176 -6.989 -19.608 1.00 0.00 H new ATOM 0 HZ2 TRP B 59 68.052 -7.458 -15.009 1.00 0.00 H new ATOM 0 HZ3 TRP B 59 64.657 -7.261 -17.651 1.00 0.00 H new ATOM 0 HH2 TRP B 59 65.599 -7.496 -15.356 1.00 0.00 H new ATOM 2186 N VAL B 60 68.757 -3.888 -19.319 1.00 0.00 N ATOM 2187 CA VAL B 60 67.931 -3.019 -18.456 1.00 0.00 C ATOM 2188 C VAL B 60 67.866 -1.618 -19.079 1.00 0.00 C ATOM 2189 O VAL B 60 67.071 -0.793 -18.692 1.00 0.00 O ATOM 2190 CB VAL B 60 68.555 -2.949 -17.064 1.00 0.00 C ATOM 2191 CG1 VAL B 60 67.796 -1.940 -16.209 1.00 0.00 C ATOM 2192 CG2 VAL B 60 68.470 -4.327 -16.413 1.00 0.00 C ATOM 0 H VAL B 60 69.728 -3.994 -19.026 1.00 0.00 H new ATOM 0 HA VAL B 60 66.922 -3.423 -18.370 1.00 0.00 H new ATOM 0 HB VAL B 60 69.597 -2.638 -17.146 1.00 0.00 H new ATOM 0 HG11 VAL B 60 68.245 -1.893 -15.217 1.00 0.00 H new ATOM 0 HG12 VAL B 60 67.846 -0.957 -16.676 1.00 0.00 H new ATOM 0 HG13 VAL B 60 66.754 -2.248 -16.122 1.00 0.00 H new ATOM 0 HG21 VAL B 60 68.913 -4.287 -15.418 1.00 0.00 H new ATOM 0 HG22 VAL B 60 67.425 -4.628 -16.333 1.00 0.00 H new ATOM 0 HG23 VAL B 60 69.011 -5.051 -17.022 1.00 0.00 H new ATOM 2202 N GLN B 61 68.679 -1.356 -20.069 1.00 0.00 N ATOM 2203 CA GLN B 61 68.623 -0.031 -20.736 1.00 0.00 C ATOM 2204 C GLN B 61 67.487 -0.055 -21.755 1.00 0.00 C ATOM 2205 O GLN B 61 66.905 0.962 -22.078 1.00 0.00 O ATOM 2206 CB GLN B 61 69.950 0.246 -21.447 1.00 0.00 C ATOM 2207 CG GLN B 61 70.842 1.103 -20.546 1.00 0.00 C ATOM 2208 CD GLN B 61 70.472 2.578 -20.712 1.00 0.00 C ATOM 2209 OE1 GLN B 61 69.309 2.914 -20.828 1.00 0.00 O ATOM 2210 NE2 GLN B 61 71.415 3.477 -20.729 1.00 0.00 N ATOM 0 H GLN B 61 69.375 -2.002 -20.440 1.00 0.00 H new ATOM 0 HA GLN B 61 68.450 0.754 -19.999 1.00 0.00 H new ATOM 0 HB2 GLN B 61 70.450 -0.693 -21.685 1.00 0.00 H new ATOM 0 HB3 GLN B 61 69.769 0.759 -22.391 1.00 0.00 H new ATOM 0 HG2 GLN B 61 70.721 0.802 -19.505 1.00 0.00 H new ATOM 0 HG3 GLN B 61 71.890 0.949 -20.803 1.00 0.00 H new ATOM 0 HE21 GLN B 61 72.390 3.195 -20.632 1.00 0.00 H new ATOM 0 HE22 GLN B 61 71.178 4.463 -20.840 1.00 0.00 H new ATOM 2219 N ASP B 62 67.153 -1.220 -22.249 1.00 0.00 N ATOM 2220 CA ASP B 62 66.046 -1.324 -23.223 1.00 0.00 C ATOM 2221 C ASP B 62 64.739 -1.571 -22.466 1.00 0.00 C ATOM 2222 O ASP B 62 63.694 -1.065 -22.825 1.00 0.00 O ATOM 2223 CB ASP B 62 66.311 -2.487 -24.180 1.00 0.00 C ATOM 2224 CG ASP B 62 65.437 -2.335 -25.427 1.00 0.00 C ATOM 2225 OD1 ASP B 62 65.717 -1.451 -26.219 1.00 0.00 O ATOM 2226 OD2 ASP B 62 64.501 -3.106 -25.566 1.00 0.00 O ATOM 0 H ASP B 62 67.607 -2.103 -22.013 1.00 0.00 H new ATOM 0 HA ASP B 62 65.972 -0.400 -23.796 1.00 0.00 H new ATOM 0 HB2 ASP B 62 67.364 -2.507 -24.462 1.00 0.00 H new ATOM 0 HB3 ASP B 62 66.095 -3.434 -23.686 1.00 0.00 H new ATOM 2231 N SER B 63 64.797 -2.333 -21.407 1.00 0.00 N ATOM 2232 CA SER B 63 63.570 -2.603 -20.610 1.00 0.00 C ATOM 2233 C SER B 63 63.228 -1.366 -19.791 1.00 0.00 C ATOM 2234 O SER B 63 62.126 -0.873 -19.826 1.00 0.00 O ATOM 2235 CB SER B 63 63.830 -3.767 -19.664 1.00 0.00 C ATOM 2236 OG SER B 63 64.710 -4.694 -20.284 1.00 0.00 O ATOM 0 H SER B 63 65.645 -2.781 -21.060 1.00 0.00 H new ATOM 0 HA SER B 63 62.744 -2.849 -21.278 1.00 0.00 H new ATOM 0 HB2 SER B 63 64.265 -3.403 -18.733 1.00 0.00 H new ATOM 0 HB3 SER B 63 62.891 -4.257 -19.407 1.00 0.00 H new ATOM 0 HG SER B 63 65.628 -4.521 -19.989 1.00 0.00 H new ATOM 2242 N MET B 64 64.174 -0.867 -19.048 1.00 0.00 N ATOM 2243 CA MET B 64 63.923 0.345 -18.217 1.00 0.00 C ATOM 2244 C MET B 64 63.328 1.447 -19.092 1.00 0.00 C ATOM 2245 O MET B 64 62.599 2.294 -18.624 1.00 0.00 O ATOM 2246 CB MET B 64 65.243 0.826 -17.615 1.00 0.00 C ATOM 2247 CG MET B 64 65.009 2.102 -16.801 1.00 0.00 C ATOM 2248 SD MET B 64 66.386 2.347 -15.644 1.00 0.00 S ATOM 2249 CE MET B 64 67.739 1.990 -16.798 1.00 0.00 C ATOM 0 H MET B 64 65.118 -1.248 -18.979 1.00 0.00 H new ATOM 0 HA MET B 64 63.224 0.102 -17.416 1.00 0.00 H new ATOM 0 HB2 MET B 64 65.666 0.050 -16.978 1.00 0.00 H new ATOM 0 HB3 MET B 64 65.966 1.017 -18.408 1.00 0.00 H new ATOM 0 HG2 MET B 64 64.924 2.960 -17.468 1.00 0.00 H new ATOM 0 HG3 MET B 64 64.069 2.029 -16.254 1.00 0.00 H new ATOM 0 HE1 MET B 64 68.670 2.400 -16.406 1.00 0.00 H new ATOM 0 HE2 MET B 64 67.840 0.911 -16.918 1.00 0.00 H new ATOM 0 HE3 MET B 64 67.522 2.444 -17.765 1.00 0.00 H new ATOM 2259 N ASP B 65 63.627 1.432 -20.363 1.00 0.00 N ATOM 2260 CA ASP B 65 63.073 2.460 -21.270 1.00 0.00 C ATOM 2261 C ASP B 65 61.665 2.052 -21.666 1.00 0.00 C ATOM 2262 O ASP B 65 60.774 2.870 -21.781 1.00 0.00 O ATOM 2263 CB ASP B 65 63.947 2.570 -22.519 1.00 0.00 C ATOM 2264 CG ASP B 65 64.962 3.700 -22.335 1.00 0.00 C ATOM 2265 OD1 ASP B 65 64.560 4.849 -22.409 1.00 0.00 O ATOM 2266 OD2 ASP B 65 66.125 3.396 -22.123 1.00 0.00 O ATOM 0 H ASP B 65 64.235 0.745 -20.808 1.00 0.00 H new ATOM 0 HA ASP B 65 63.052 3.427 -20.767 1.00 0.00 H new ATOM 0 HB2 ASP B 65 64.465 1.628 -22.697 1.00 0.00 H new ATOM 0 HB3 ASP B 65 63.326 2.763 -23.394 1.00 0.00 H new ATOM 2271 N HIS B 66 61.453 0.785 -21.851 1.00 0.00 N ATOM 2272 CA HIS B 66 60.100 0.304 -22.214 1.00 0.00 C ATOM 2273 C HIS B 66 59.125 0.714 -21.117 1.00 0.00 C ATOM 2274 O HIS B 66 57.999 1.086 -21.377 1.00 0.00 O ATOM 2275 CB HIS B 66 60.115 -1.221 -22.346 1.00 0.00 C ATOM 2276 CG HIS B 66 58.747 -1.703 -22.743 1.00 0.00 C ATOM 2277 ND1 HIS B 66 58.208 -1.449 -23.995 1.00 0.00 N ATOM 2278 CD2 HIS B 66 57.797 -2.425 -22.066 1.00 0.00 C ATOM 2279 CE1 HIS B 66 56.985 -2.010 -24.032 1.00 0.00 C ATOM 2280 NE2 HIS B 66 56.686 -2.618 -22.880 1.00 0.00 N ATOM 0 H HIS B 66 62.163 0.058 -21.766 1.00 0.00 H new ATOM 0 HA HIS B 66 59.793 0.739 -23.165 1.00 0.00 H new ATOM 0 HB2 HIS B 66 60.850 -1.525 -23.091 1.00 0.00 H new ATOM 0 HB3 HIS B 66 60.412 -1.676 -21.401 1.00 0.00 H new ATOM 0 HD2 HIS B 66 57.897 -2.789 -21.054 1.00 0.00 H new ATOM 0 HE1 HIS B 66 56.326 -1.973 -24.887 1.00 0.00 H new ATOM 0 HE2 HIS B 66 55.827 -3.117 -22.648 1.00 0.00 H new ATOM 2288 N LEU B 67 59.564 0.682 -19.888 1.00 0.00 N ATOM 2289 CA LEU B 67 58.684 1.097 -18.768 1.00 0.00 C ATOM 2290 C LEU B 67 58.727 2.607 -18.666 1.00 0.00 C ATOM 2291 O LEU B 67 57.756 3.249 -18.322 1.00 0.00 O ATOM 2292 CB LEU B 67 59.179 0.471 -17.454 1.00 0.00 C ATOM 2293 CG LEU B 67 59.573 -0.995 -17.689 1.00 0.00 C ATOM 2294 CD1 LEU B 67 60.358 -1.513 -16.494 1.00 0.00 C ATOM 2295 CD2 LEU B 67 58.322 -1.835 -17.854 1.00 0.00 C ATOM 0 H LEU B 67 60.500 0.384 -19.614 1.00 0.00 H new ATOM 0 HA LEU B 67 57.663 0.761 -18.949 1.00 0.00 H new ATOM 0 HB2 LEU B 67 60.034 1.030 -17.074 1.00 0.00 H new ATOM 0 HB3 LEU B 67 58.398 0.530 -16.696 1.00 0.00 H new ATOM 0 HG LEU B 67 60.186 -1.060 -18.588 1.00 0.00 H new ATOM 0 HD11 LEU B 67 60.636 -2.553 -16.664 1.00 0.00 H new ATOM 0 HD12 LEU B 67 61.259 -0.914 -16.363 1.00 0.00 H new ATOM 0 HD13 LEU B 67 59.743 -1.444 -15.597 1.00 0.00 H new ATOM 0 HD21 LEU B 67 58.602 -2.875 -18.021 1.00 0.00 H new ATOM 0 HD22 LEU B 67 57.714 -1.763 -16.952 1.00 0.00 H new ATOM 0 HD23 LEU B 67 57.750 -1.472 -18.708 1.00 0.00 H new ATOM 2307 N ASP B 68 59.834 3.187 -19.021 1.00 0.00 N ATOM 2308 CA ASP B 68 59.932 4.652 -19.010 1.00 0.00 C ATOM 2309 C ASP B 68 59.005 5.215 -20.087 1.00 0.00 C ATOM 2310 O ASP B 68 58.743 6.400 -20.136 1.00 0.00 O ATOM 2311 CB ASP B 68 61.377 5.071 -19.295 1.00 0.00 C ATOM 2312 CG ASP B 68 61.904 5.915 -18.134 1.00 0.00 C ATOM 2313 OD1 ASP B 68 61.166 6.766 -17.663 1.00 0.00 O ATOM 2314 OD2 ASP B 68 63.036 5.697 -17.735 1.00 0.00 O ATOM 0 H ASP B 68 60.678 2.698 -19.320 1.00 0.00 H new ATOM 0 HA ASP B 68 59.638 5.039 -18.034 1.00 0.00 H new ATOM 0 HB2 ASP B 68 62.002 4.189 -19.430 1.00 0.00 H new ATOM 0 HB3 ASP B 68 61.425 5.640 -20.223 1.00 0.00 H new