USER MOD reduce.3.24.130724 H: found=0, std=0, add=1290, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1290 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 50 ASN : amide:sc= -2.07 K(o=-6.9,f=-6.4) USER MOD Set 1.2: B 51 LYS NZ :NH3+ 175:sc= -4.87 (180deg=-3.18) USER MOD Set 2.1: A 45 MET CE :methyl 172:sc= -2.14 (180deg=-1.2) USER MOD Set 2.2: A 49 GLN : amide:sc= -2.23 K(o=-6,f=-8.1!) USER MOD Set 2.3: B 45 MET CE :methyl -170:sc= -1.09 (180deg=-1.05) USER MOD Set 2.4: B 49 GLN : amide:sc= -0.53 K(o=-6,f=-11) USER MOD Set 3.1: B 1 MET N :NH3+ 162:sc= -0.235 (180deg=-0.633) USER MOD Set 3.2: B 6 LYS NZ :NH3+ -149:sc= -0.528 (180deg=-2.35!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 LYS NZ :NH3+ -127:sc= 1.13 (180deg=-1.27) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot -174:sc= -0.504 USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 HIS : no HD1:sc=-0.00381 X(o=-0.0038,f=-0.0038) USER MOD Single : A 23 THR OG1 : rot -68:sc= -0.245 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 SER OG : rot -60:sc= 0.586 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 ASN : amide:sc= -0.164 K(o=-0.16,f=-1.7!) USER MOD Single : A 35 MET CE :methyl 177:sc= -2.24 (180deg=-2.36) USER MOD Single : A 36 THR OG1 : rot 180:sc= 0.101 USER MOD Single : A 50 ASN : amide:sc= -3.07 X(o=-3.1,f=-3.2) USER MOD Single : A 51 LYS NZ :NH3+ -137:sc= -3.15! (180deg=-7.35!) USER MOD Single : A 53 LYS NZ :NH3+ 142:sc= -0.406 (180deg=-2.17!) USER MOD Single : A 56 ASN : amide:sc= -0.128 K(o=-0.13,f=-1.6!) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 SER OG : rot -120:sc= 0.454 USER MOD Single : A 67 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.117) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET CE :methyl 157:sc= 0 (180deg=-0.701) USER MOD Single : B 4 SER OG : rot 180:sc= 0 USER MOD Single : B 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 9 LYS NZ :NH3+ -140:sc= -1.14 (180deg=-4.28!) USER MOD Single : B 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 12 THR OG1 : rot -134:sc= 0.254 USER MOD Single : B 13 THR OG1 : rot 180:sc= 0 USER MOD Single : B 21 TYR OH : rot 180:sc= 0 USER MOD Single : B 22 HIS : no HD1:sc= -0.396 X(o=-0.4,f=-0.24) USER MOD Single : B 23 THR OG1 : rot -89:sc= -1.16! USER MOD Single : B 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 28 SER OG : rot 98:sc= 0.757 USER MOD Single : B 30 TYR OH : rot 180:sc= 0 USER MOD Single : B 32 ASN : amide:sc= -0.501 K(o=-0.5,f=0) USER MOD Single : B 35 MET CE :methyl 161:sc= -1.12 (180deg=-3.03!) USER MOD Single : B 36 THR OG1 : rot -89:sc= 0.0973 USER MOD Single : B 53 LYS NZ :NH3+ 147:sc= -0.0538 (180deg=-1.24) USER MOD Single : B 56 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 66 SER OG : rot 62:sc= 0.652 USER MOD Single : B 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 10.620 15.931 -25.105 1.00 0.00 N ATOM 2 CA MET A 1 9.406 15.583 -24.319 1.00 0.00 C ATOM 3 C MET A 1 8.136 15.985 -25.060 1.00 0.00 C ATOM 4 O MET A 1 7.906 17.165 -25.323 1.00 0.00 O ATOM 5 CB MET A 1 9.478 16.299 -22.970 1.00 0.00 C ATOM 6 CG MET A 1 8.818 15.530 -21.837 1.00 0.00 C ATOM 7 SD MET A 1 9.624 15.809 -20.247 1.00 0.00 S ATOM 8 CE MET A 1 8.646 17.165 -19.605 1.00 0.00 C ATOM 0 H1 MET A 1 11.469 15.646 -24.577 1.00 0.00 H new ATOM 0 H2 MET A 1 10.597 15.433 -26.018 1.00 0.00 H new ATOM 0 H3 MET A 1 10.644 16.957 -25.271 1.00 0.00 H new ATOM 0 HA MET A 1 9.372 14.504 -24.171 1.00 0.00 H new ATOM 0 HB2 MET A 1 10.523 16.476 -22.717 1.00 0.00 H new ATOM 0 HB3 MET A 1 9.002 17.276 -23.061 1.00 0.00 H new ATOM 0 HG2 MET A 1 7.771 15.823 -21.766 1.00 0.00 H new ATOM 0 HG3 MET A 1 8.836 14.465 -22.067 1.00 0.00 H new ATOM 0 HE1 MET A 1 9.023 17.453 -18.623 1.00 0.00 H new ATOM 0 HE2 MET A 1 8.714 18.016 -20.283 1.00 0.00 H new ATOM 0 HE3 MET A 1 7.605 16.853 -19.517 1.00 0.00 H new ATOM 20 N VAL A 2 7.312 14.995 -25.393 1.00 0.00 N ATOM 21 CA VAL A 2 6.063 15.246 -26.101 1.00 0.00 C ATOM 22 C VAL A 2 4.858 14.918 -25.225 1.00 0.00 C ATOM 23 O VAL A 2 3.782 14.598 -25.730 1.00 0.00 O ATOM 24 CB VAL A 2 5.979 14.421 -27.399 1.00 0.00 C ATOM 25 CG1 VAL A 2 6.940 14.967 -28.443 1.00 0.00 C ATOM 26 CG2 VAL A 2 6.261 12.953 -27.119 1.00 0.00 C ATOM 0 H VAL A 2 7.488 14.012 -25.183 1.00 0.00 H new ATOM 0 HA VAL A 2 6.049 16.307 -26.351 1.00 0.00 H new ATOM 0 HB VAL A 2 4.966 14.503 -27.794 1.00 0.00 H new ATOM 0 HG11 VAL A 2 6.866 14.371 -29.353 1.00 0.00 H new ATOM 0 HG12 VAL A 2 6.685 16.003 -28.666 1.00 0.00 H new ATOM 0 HG13 VAL A 2 7.959 14.919 -28.060 1.00 0.00 H new ATOM 0 HG21 VAL A 2 6.197 12.387 -28.048 1.00 0.00 H new ATOM 0 HG22 VAL A 2 7.261 12.848 -26.698 1.00 0.00 H new ATOM 0 HG23 VAL A 2 5.527 12.570 -26.410 1.00 0.00 H new ATOM 36 N GLU A 3 5.045 15.001 -23.912 1.00 0.00 N ATOM 37 CA GLU A 3 3.973 14.715 -22.965 1.00 0.00 C ATOM 38 C GLU A 3 3.512 13.265 -23.086 1.00 0.00 C ATOM 39 O GLU A 3 3.519 12.689 -24.174 1.00 0.00 O ATOM 40 CB GLU A 3 2.792 15.657 -23.198 1.00 0.00 C ATOM 41 CG GLU A 3 1.801 15.689 -22.044 1.00 0.00 C ATOM 42 CD GLU A 3 0.427 16.169 -22.470 1.00 0.00 C ATOM 43 OE1 GLU A 3 -0.347 16.606 -21.592 1.00 0.00 O ATOM 44 OE2 GLU A 3 0.125 16.106 -23.680 1.00 0.00 O ATOM 0 H GLU A 3 5.930 15.264 -23.479 1.00 0.00 H new ATOM 0 HA GLU A 3 4.361 14.872 -21.959 1.00 0.00 H new ATOM 0 HB2 GLU A 3 3.170 16.665 -23.369 1.00 0.00 H new ATOM 0 HB3 GLU A 3 2.270 15.354 -24.106 1.00 0.00 H new ATOM 0 HG2 GLU A 3 1.716 14.691 -21.615 1.00 0.00 H new ATOM 0 HG3 GLU A 3 2.183 16.342 -21.259 1.00 0.00 H new ATOM 51 N SER A 4 3.113 12.681 -21.960 1.00 0.00 N ATOM 52 CA SER A 4 2.648 11.298 -21.936 1.00 0.00 C ATOM 53 C SER A 4 3.794 10.334 -22.231 1.00 0.00 C ATOM 54 O SER A 4 4.961 10.725 -22.226 1.00 0.00 O ATOM 55 CB SER A 4 1.516 11.096 -22.947 1.00 0.00 C ATOM 56 OG SER A 4 0.305 10.752 -22.296 1.00 0.00 O ATOM 0 H SER A 4 3.102 13.144 -21.051 1.00 0.00 H new ATOM 0 HA SER A 4 2.269 11.086 -20.936 1.00 0.00 H new ATOM 0 HB2 SER A 4 1.375 12.009 -23.526 1.00 0.00 H new ATOM 0 HB3 SER A 4 1.789 10.311 -23.652 1.00 0.00 H new ATOM 0 HG SER A 4 -0.402 10.630 -22.964 1.00 0.00 H new ATOM 62 N LYS A 5 3.452 9.073 -22.486 1.00 0.00 N ATOM 63 CA LYS A 5 4.450 8.052 -22.782 1.00 0.00 C ATOM 64 C LYS A 5 5.360 7.817 -21.579 1.00 0.00 C ATOM 65 O LYS A 5 5.197 6.841 -20.846 1.00 0.00 O ATOM 66 CB LYS A 5 5.284 8.454 -24.001 1.00 0.00 C ATOM 67 CG LYS A 5 4.747 7.902 -25.313 1.00 0.00 C ATOM 68 CD LYS A 5 4.048 8.980 -26.132 1.00 0.00 C ATOM 69 CE LYS A 5 2.574 8.662 -26.333 1.00 0.00 C ATOM 70 NZ LYS A 5 2.125 8.973 -27.718 1.00 0.00 N ATOM 0 H LYS A 5 2.490 8.735 -22.493 1.00 0.00 H new ATOM 0 HA LYS A 5 3.926 7.123 -23.006 1.00 0.00 H new ATOM 0 HB2 LYS A 5 5.322 9.542 -24.062 1.00 0.00 H new ATOM 0 HB3 LYS A 5 6.308 8.106 -23.862 1.00 0.00 H new ATOM 0 HG2 LYS A 5 5.567 7.479 -25.893 1.00 0.00 H new ATOM 0 HG3 LYS A 5 4.049 7.090 -25.108 1.00 0.00 H new ATOM 0 HD2 LYS A 5 4.148 9.942 -25.629 1.00 0.00 H new ATOM 0 HD3 LYS A 5 4.536 9.075 -27.102 1.00 0.00 H new ATOM 0 HE2 LYS A 5 2.398 7.607 -26.122 1.00 0.00 H new ATOM 0 HE3 LYS A 5 1.979 9.233 -25.621 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 1.115 8.743 -27.816 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 2.270 9.985 -27.911 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 2.676 8.409 -28.396 1.00 0.00 H new ATOM 84 N LYS A 6 6.315 8.719 -21.379 1.00 0.00 N ATOM 85 CA LYS A 6 7.247 8.613 -20.263 1.00 0.00 C ATOM 86 C LYS A 6 6.884 9.597 -19.155 1.00 0.00 C ATOM 87 O LYS A 6 7.227 9.389 -17.991 1.00 0.00 O ATOM 88 CB LYS A 6 8.678 8.867 -20.739 1.00 0.00 C ATOM 89 CG LYS A 6 8.826 10.127 -21.577 1.00 0.00 C ATOM 90 CD LYS A 6 8.794 9.815 -23.063 1.00 0.00 C ATOM 91 CE LYS A 6 8.532 11.063 -23.890 1.00 0.00 C ATOM 92 NZ LYS A 6 9.247 11.026 -25.195 1.00 0.00 N ATOM 0 H LYS A 6 6.464 9.532 -21.976 1.00 0.00 H new ATOM 0 HA LYS A 6 7.180 7.602 -19.862 1.00 0.00 H new ATOM 0 HB2 LYS A 6 9.333 8.939 -19.871 1.00 0.00 H new ATOM 0 HB3 LYS A 6 9.015 8.011 -21.323 1.00 0.00 H new ATOM 0 HG2 LYS A 6 8.024 10.823 -21.333 1.00 0.00 H new ATOM 0 HG3 LYS A 6 9.765 10.622 -21.328 1.00 0.00 H new ATOM 0 HD2 LYS A 6 9.743 9.371 -23.363 1.00 0.00 H new ATOM 0 HD3 LYS A 6 8.019 9.075 -23.264 1.00 0.00 H new ATOM 0 HE2 LYS A 6 7.461 11.163 -24.066 1.00 0.00 H new ATOM 0 HE3 LYS A 6 8.847 11.943 -23.329 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 9.042 11.895 -25.728 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 10.271 10.956 -25.028 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 8.928 10.201 -25.742 1.00 0.00 H new ATOM 106 N ILE A 7 6.188 10.669 -19.522 1.00 0.00 N ATOM 107 CA ILE A 7 5.779 11.685 -18.558 1.00 0.00 C ATOM 108 C ILE A 7 4.368 11.418 -18.046 1.00 0.00 C ATOM 109 O ILE A 7 3.623 10.632 -18.632 1.00 0.00 O ATOM 110 CB ILE A 7 5.831 13.101 -19.173 1.00 0.00 C ATOM 111 CG1 ILE A 7 7.041 13.243 -20.100 1.00 0.00 C ATOM 112 CG2 ILE A 7 5.872 14.153 -18.074 1.00 0.00 C ATOM 113 CD1 ILE A 7 6.686 13.179 -21.569 1.00 0.00 C ATOM 0 H ILE A 7 5.895 10.857 -20.481 1.00 0.00 H new ATOM 0 HA ILE A 7 6.482 11.633 -17.727 1.00 0.00 H new ATOM 0 HB ILE A 7 4.929 13.254 -19.765 1.00 0.00 H new ATOM 0 HG12 ILE A 7 7.536 14.192 -19.895 1.00 0.00 H new ATOM 0 HG13 ILE A 7 7.758 12.454 -19.873 1.00 0.00 H new ATOM 0 HG21 ILE A 7 5.908 15.146 -18.522 1.00 0.00 H new ATOM 0 HG22 ILE A 7 4.979 14.067 -17.454 1.00 0.00 H new ATOM 0 HG23 ILE A 7 6.758 14.001 -17.457 1.00 0.00 H new ATOM 0 HD11 ILE A 7 7.591 13.286 -22.167 1.00 0.00 H new ATOM 0 HD12 ILE A 7 6.218 12.220 -21.789 1.00 0.00 H new ATOM 0 HD13 ILE A 7 5.993 13.985 -21.811 1.00 0.00 H new ATOM 125 N ALA A 8 4.006 12.077 -16.948 1.00 0.00 N ATOM 126 CA ALA A 8 2.682 11.915 -16.353 1.00 0.00 C ATOM 127 C ALA A 8 2.547 10.560 -15.667 1.00 0.00 C ATOM 128 O ALA A 8 3.482 9.759 -15.657 1.00 0.00 O ATOM 129 CB ALA A 8 1.598 12.084 -17.408 1.00 0.00 C ATOM 0 H ALA A 8 4.613 12.730 -16.451 1.00 0.00 H new ATOM 0 HA ALA A 8 2.559 12.690 -15.597 1.00 0.00 H new ATOM 0 HB1 ALA A 8 0.618 11.960 -16.946 1.00 0.00 H new ATOM 0 HB2 ALA A 8 1.669 13.079 -17.846 1.00 0.00 H new ATOM 0 HB3 ALA A 8 1.729 11.334 -18.188 1.00 0.00 H new ATOM 135 N LYS A 9 1.375 10.309 -15.096 1.00 0.00 N ATOM 136 CA LYS A 9 1.114 9.052 -14.402 1.00 0.00 C ATOM 137 C LYS A 9 0.934 7.918 -15.399 1.00 0.00 C ATOM 138 O LYS A 9 0.309 8.093 -16.445 1.00 0.00 O ATOM 139 CB LYS A 9 -0.133 9.183 -13.538 1.00 0.00 C ATOM 140 CG LYS A 9 -1.331 9.617 -14.336 1.00 0.00 C ATOM 141 CD LYS A 9 -2.144 10.675 -13.608 1.00 0.00 C ATOM 142 CE LYS A 9 -3.504 10.877 -14.256 1.00 0.00 C ATOM 143 NZ LYS A 9 -4.358 11.814 -13.474 1.00 0.00 N ATOM 0 H LYS A 9 0.589 10.959 -15.099 1.00 0.00 H new ATOM 0 HA LYS A 9 1.970 8.825 -13.766 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -0.344 8.227 -13.059 1.00 0.00 H new ATOM 0 HB3 LYS A 9 0.052 9.904 -12.742 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -1.003 10.010 -15.299 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -1.962 8.753 -14.543 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -2.276 10.381 -12.567 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -1.597 11.618 -13.606 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -3.371 11.264 -15.266 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -4.009 9.915 -14.347 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -5.277 11.925 -13.949 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -4.506 11.433 -12.518 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -3.888 12.739 -13.408 1.00 0.00 H new ATOM 157 N LYS A 10 1.487 6.755 -15.075 1.00 0.00 N ATOM 158 CA LYS A 10 1.385 5.600 -15.954 1.00 0.00 C ATOM 159 C LYS A 10 0.730 4.435 -15.222 1.00 0.00 C ATOM 160 O LYS A 10 1.049 4.163 -14.070 1.00 0.00 O ATOM 161 CB LYS A 10 2.775 5.198 -16.455 1.00 0.00 C ATOM 162 CG LYS A 10 3.482 6.287 -17.243 1.00 0.00 C ATOM 163 CD LYS A 10 4.938 6.423 -16.816 1.00 0.00 C ATOM 164 CE LYS A 10 5.851 6.652 -18.009 1.00 0.00 C ATOM 165 NZ LYS A 10 6.011 5.421 -18.831 1.00 0.00 N ATOM 0 H LYS A 10 2.008 6.589 -14.214 1.00 0.00 H new ATOM 0 HA LYS A 10 0.765 5.864 -16.811 1.00 0.00 H new ATOM 0 HB2 LYS A 10 3.393 4.922 -15.601 1.00 0.00 H new ATOM 0 HB3 LYS A 10 2.682 4.311 -17.082 1.00 0.00 H new ATOM 0 HG2 LYS A 10 3.433 6.059 -18.308 1.00 0.00 H new ATOM 0 HG3 LYS A 10 2.968 7.237 -17.097 1.00 0.00 H new ATOM 0 HD2 LYS A 10 5.037 7.253 -16.117 1.00 0.00 H new ATOM 0 HD3 LYS A 10 5.248 5.522 -16.287 1.00 0.00 H new ATOM 0 HE2 LYS A 10 5.445 7.452 -18.628 1.00 0.00 H new ATOM 0 HE3 LYS A 10 6.828 6.985 -17.659 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 7.023 5.217 -18.958 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 5.554 4.620 -18.349 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 5.568 5.564 -19.761 1.00 0.00 H new ATOM 179 N LYS A 11 -0.189 3.740 -15.881 1.00 0.00 N ATOM 180 CA LYS A 11 -0.853 2.616 -15.239 1.00 0.00 C ATOM 181 C LYS A 11 0.168 1.539 -14.904 1.00 0.00 C ATOM 182 O LYS A 11 0.679 0.853 -15.789 1.00 0.00 O ATOM 183 CB LYS A 11 -1.952 2.042 -16.137 1.00 0.00 C ATOM 184 CG LYS A 11 -3.032 3.050 -16.495 1.00 0.00 C ATOM 185 CD LYS A 11 -2.702 3.794 -17.781 1.00 0.00 C ATOM 186 CE LYS A 11 -2.434 5.270 -17.521 1.00 0.00 C ATOM 187 NZ LYS A 11 -3.683 6.082 -17.574 1.00 0.00 N ATOM 0 H LYS A 11 -0.486 3.930 -16.838 1.00 0.00 H new ATOM 0 HA LYS A 11 -1.319 2.969 -14.319 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -1.500 1.665 -17.054 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -2.413 1.191 -15.635 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -3.987 2.536 -16.606 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -3.148 3.765 -15.680 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -1.828 3.342 -18.250 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -3.529 3.692 -18.484 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -1.967 5.387 -16.543 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -1.726 5.646 -18.260 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -3.456 7.080 -17.392 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -4.116 5.992 -18.515 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -4.350 5.741 -16.852 1.00 0.00 H new ATOM 201 N THR A 12 0.472 1.410 -13.619 1.00 0.00 N ATOM 202 CA THR A 12 1.444 0.432 -13.164 1.00 0.00 C ATOM 203 C THR A 12 0.765 -0.736 -12.462 1.00 0.00 C ATOM 204 O THR A 12 -0.271 -0.565 -11.825 1.00 0.00 O ATOM 205 CB THR A 12 2.460 1.085 -12.227 1.00 0.00 C ATOM 206 OG1 THR A 12 2.708 2.425 -12.614 1.00 0.00 O ATOM 207 CG2 THR A 12 3.791 0.366 -12.190 1.00 0.00 C ATOM 0 H THR A 12 0.058 1.972 -12.875 1.00 0.00 H new ATOM 0 HA THR A 12 1.964 0.047 -14.041 1.00 0.00 H new ATOM 0 HB THR A 12 2.011 1.035 -11.235 1.00 0.00 H new ATOM 0 HG1 THR A 12 3.423 2.799 -12.058 1.00 0.00 H new ATOM 0 HG21 THR A 12 4.465 0.882 -11.506 1.00 0.00 H new ATOM 0 HG22 THR A 12 3.642 -0.658 -11.848 1.00 0.00 H new ATOM 0 HG23 THR A 12 4.227 0.355 -13.189 1.00 0.00 H new ATOM 215 N THR A 13 1.348 -1.928 -12.579 1.00 0.00 N ATOM 216 CA THR A 13 0.772 -3.109 -11.946 1.00 0.00 C ATOM 217 C THR A 13 1.734 -3.760 -10.960 1.00 0.00 C ATOM 218 O THR A 13 2.948 -3.782 -11.167 1.00 0.00 O ATOM 219 CB THR A 13 0.358 -4.142 -12.993 1.00 0.00 C ATOM 220 OG1 THR A 13 0.102 -3.527 -14.243 1.00 0.00 O ATOM 221 CG2 THR A 13 -0.877 -4.920 -12.594 1.00 0.00 C ATOM 0 H THR A 13 2.208 -2.099 -13.100 1.00 0.00 H new ATOM 0 HA THR A 13 -0.106 -2.768 -11.397 1.00 0.00 H new ATOM 0 HB THR A 13 1.198 -4.832 -13.070 1.00 0.00 H new ATOM 0 HG1 THR A 13 -0.159 -4.209 -14.896 1.00 0.00 H new ATOM 0 HG21 THR A 13 -1.123 -5.638 -13.376 1.00 0.00 H new ATOM 0 HG22 THR A 13 -0.687 -5.450 -11.661 1.00 0.00 H new ATOM 0 HG23 THR A 13 -1.712 -4.233 -12.457 1.00 0.00 H new ATOM 229 N LEU A 14 1.161 -4.315 -9.901 1.00 0.00 N ATOM 230 CA LEU A 14 1.917 -5.013 -8.872 1.00 0.00 C ATOM 231 C LEU A 14 1.115 -6.223 -8.427 1.00 0.00 C ATOM 232 O LEU A 14 -0.095 -6.121 -8.235 1.00 0.00 O ATOM 233 CB LEU A 14 2.194 -4.108 -7.664 1.00 0.00 C ATOM 234 CG LEU A 14 2.161 -2.600 -7.934 1.00 0.00 C ATOM 235 CD1 LEU A 14 1.405 -1.880 -6.830 1.00 0.00 C ATOM 236 CD2 LEU A 14 3.574 -2.046 -8.061 1.00 0.00 C ATOM 0 H LEU A 14 0.155 -4.293 -9.731 1.00 0.00 H new ATOM 0 HA LEU A 14 2.879 -5.315 -9.286 1.00 0.00 H new ATOM 0 HB2 LEU A 14 1.461 -4.335 -6.890 1.00 0.00 H new ATOM 0 HB3 LEU A 14 3.174 -4.364 -7.260 1.00 0.00 H new ATOM 0 HG LEU A 14 1.641 -2.431 -8.877 1.00 0.00 H new ATOM 0 HD11 LEU A 14 1.391 -0.810 -7.037 1.00 0.00 H new ATOM 0 HD12 LEU A 14 0.382 -2.255 -6.785 1.00 0.00 H new ATOM 0 HD13 LEU A 14 1.899 -2.058 -5.875 1.00 0.00 H new ATOM 0 HD21 LEU A 14 3.529 -0.974 -8.253 1.00 0.00 H new ATOM 0 HD22 LEU A 14 4.120 -2.226 -7.135 1.00 0.00 H new ATOM 0 HD23 LEU A 14 4.086 -2.541 -8.886 1.00 0.00 H new ATOM 248 N ALA A 15 1.762 -7.370 -8.274 1.00 0.00 N ATOM 249 CA ALA A 15 1.029 -8.558 -7.870 1.00 0.00 C ATOM 250 C ALA A 15 0.930 -8.666 -6.359 1.00 0.00 C ATOM 251 O ALA A 15 1.800 -9.236 -5.701 1.00 0.00 O ATOM 252 CB ALA A 15 1.679 -9.803 -8.455 1.00 0.00 C ATOM 0 H ALA A 15 2.763 -7.501 -8.419 1.00 0.00 H new ATOM 0 HA ALA A 15 0.015 -8.474 -8.260 1.00 0.00 H new ATOM 0 HB1 ALA A 15 1.120 -10.686 -8.144 1.00 0.00 H new ATOM 0 HB2 ALA A 15 1.678 -9.737 -9.543 1.00 0.00 H new ATOM 0 HB3 ALA A 15 2.706 -9.880 -8.097 1.00 0.00 H new ATOM 258 N PHE A 16 -0.171 -8.141 -5.833 1.00 0.00 N ATOM 259 CA PHE A 16 -0.467 -8.184 -4.414 1.00 0.00 C ATOM 260 C PHE A 16 -1.927 -7.917 -4.176 1.00 0.00 C ATOM 261 O PHE A 16 -2.667 -7.565 -5.088 1.00 0.00 O ATOM 262 CB PHE A 16 0.354 -7.182 -3.616 1.00 0.00 C ATOM 263 CG PHE A 16 1.823 -7.207 -3.929 1.00 0.00 C ATOM 264 CD1 PHE A 16 2.671 -8.076 -3.264 1.00 0.00 C ATOM 265 CD2 PHE A 16 2.353 -6.361 -4.890 1.00 0.00 C ATOM 266 CE1 PHE A 16 4.023 -8.104 -3.552 1.00 0.00 C ATOM 267 CE2 PHE A 16 3.704 -6.384 -5.182 1.00 0.00 C ATOM 268 CZ PHE A 16 4.539 -7.256 -4.512 1.00 0.00 C ATOM 0 H PHE A 16 -0.886 -7.671 -6.388 1.00 0.00 H new ATOM 0 HA PHE A 16 -0.204 -9.185 -4.072 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -0.030 -6.180 -3.806 1.00 0.00 H new ATOM 0 HB3 PHE A 16 0.216 -7.380 -2.553 1.00 0.00 H new ATOM 0 HD1 PHE A 16 2.272 -8.740 -2.511 1.00 0.00 H new ATOM 0 HD2 PHE A 16 1.704 -5.677 -5.416 1.00 0.00 H new ATOM 0 HE1 PHE A 16 4.674 -8.788 -3.027 1.00 0.00 H new ATOM 0 HE2 PHE A 16 4.106 -5.721 -5.933 1.00 0.00 H new ATOM 0 HZ PHE A 16 5.595 -7.275 -4.739 1.00 0.00 H new ATOM 278 N ASP A 17 -2.322 -8.058 -2.933 1.00 0.00 N ATOM 279 CA ASP A 17 -3.682 -7.803 -2.518 1.00 0.00 C ATOM 280 C ASP A 17 -3.973 -8.556 -1.258 1.00 0.00 C ATOM 281 O ASP A 17 -4.638 -8.055 -0.358 1.00 0.00 O ATOM 282 CB ASP A 17 -4.700 -8.188 -3.582 1.00 0.00 C ATOM 283 CG ASP A 17 -5.172 -6.997 -4.395 1.00 0.00 C ATOM 284 OD1 ASP A 17 -6.201 -7.125 -5.093 1.00 0.00 O ATOM 285 OD2 ASP A 17 -4.513 -5.938 -4.336 1.00 0.00 O ATOM 0 H ASP A 17 -1.706 -8.355 -2.176 1.00 0.00 H new ATOM 0 HA ASP A 17 -3.772 -6.729 -2.352 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -4.260 -8.928 -4.250 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -5.558 -8.661 -3.104 1.00 0.00 H new ATOM 290 N GLU A 18 -3.467 -9.765 -1.180 1.00 0.00 N ATOM 291 CA GLU A 18 -3.696 -10.553 0.004 1.00 0.00 C ATOM 292 C GLU A 18 -3.382 -9.714 1.241 1.00 0.00 C ATOM 293 O GLU A 18 -4.267 -9.410 2.049 1.00 0.00 O ATOM 294 CB GLU A 18 -2.850 -11.825 -0.008 1.00 0.00 C ATOM 295 CG GLU A 18 -3.157 -12.768 1.143 1.00 0.00 C ATOM 296 CD GLU A 18 -2.342 -12.459 2.385 1.00 0.00 C ATOM 297 OE1 GLU A 18 -2.755 -11.570 3.158 1.00 0.00 O ATOM 298 OE2 GLU A 18 -1.293 -13.106 2.584 1.00 0.00 O ATOM 0 H GLU A 18 -2.907 -10.214 -1.905 1.00 0.00 H new ATOM 0 HA GLU A 18 -4.743 -10.854 0.027 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -3.010 -12.350 -0.950 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -1.796 -11.551 0.029 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -4.218 -12.707 1.385 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -2.960 -13.793 0.830 1.00 0.00 H new ATOM 305 N ASP A 19 -2.123 -9.308 1.360 1.00 0.00 N ATOM 306 CA ASP A 19 -1.698 -8.487 2.485 1.00 0.00 C ATOM 307 C ASP A 19 -1.939 -7.009 2.218 1.00 0.00 C ATOM 308 O ASP A 19 -2.479 -6.301 3.066 1.00 0.00 O ATOM 309 CB ASP A 19 -0.222 -8.732 2.799 1.00 0.00 C ATOM 310 CG ASP A 19 0.035 -8.885 4.284 1.00 0.00 C ATOM 311 OD1 ASP A 19 0.226 -7.854 4.963 1.00 0.00 O ATOM 312 OD2 ASP A 19 0.044 -10.036 4.771 1.00 0.00 O ATOM 0 H ASP A 19 -1.383 -9.533 0.695 1.00 0.00 H new ATOM 0 HA ASP A 19 -2.297 -8.775 3.349 1.00 0.00 H new ATOM 0 HB2 ASP A 19 0.113 -9.631 2.281 1.00 0.00 H new ATOM 0 HB3 ASP A 19 0.371 -7.902 2.414 1.00 0.00 H new ATOM 317 N VAL A 20 -1.535 -6.539 1.044 1.00 0.00 N ATOM 318 CA VAL A 20 -1.717 -5.137 0.703 1.00 0.00 C ATOM 319 C VAL A 20 -3.198 -4.767 0.693 1.00 0.00 C ATOM 320 O VAL A 20 -3.580 -3.748 1.255 1.00 0.00 O ATOM 321 CB VAL A 20 -1.069 -4.774 -0.649 1.00 0.00 C ATOM 322 CG1 VAL A 20 0.368 -5.262 -0.694 1.00 0.00 C ATOM 323 CG2 VAL A 20 -1.857 -5.355 -1.805 1.00 0.00 C ATOM 0 H VAL A 20 -1.085 -7.101 0.322 1.00 0.00 H new ATOM 0 HA VAL A 20 -1.211 -4.558 1.475 1.00 0.00 H new ATOM 0 HB VAL A 20 -1.076 -3.688 -0.746 1.00 0.00 H new ATOM 0 HG11 VAL A 20 0.812 -4.999 -1.654 1.00 0.00 H new ATOM 0 HG12 VAL A 20 0.937 -4.794 0.109 1.00 0.00 H new ATOM 0 HG13 VAL A 20 0.389 -6.345 -0.570 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -1.377 -5.083 -2.745 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -1.889 -6.441 -1.714 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -2.873 -4.960 -1.788 1.00 0.00 H new ATOM 333 N TYR A 21 -4.037 -5.602 0.075 1.00 0.00 N ATOM 334 CA TYR A 21 -5.471 -5.319 0.040 1.00 0.00 C ATOM 335 C TYR A 21 -6.056 -5.391 1.444 1.00 0.00 C ATOM 336 O TYR A 21 -6.825 -4.516 1.841 1.00 0.00 O ATOM 337 CB TYR A 21 -6.230 -6.269 -0.899 1.00 0.00 C ATOM 338 CG TYR A 21 -7.466 -5.650 -1.513 1.00 0.00 C ATOM 339 CD1 TYR A 21 -7.441 -4.357 -2.019 1.00 0.00 C ATOM 340 CD2 TYR A 21 -8.658 -6.360 -1.586 1.00 0.00 C ATOM 341 CE1 TYR A 21 -8.568 -3.789 -2.581 1.00 0.00 C ATOM 342 CE2 TYR A 21 -9.790 -5.799 -2.147 1.00 0.00 C ATOM 343 CZ TYR A 21 -9.739 -4.514 -2.642 1.00 0.00 C ATOM 344 OH TYR A 21 -10.864 -3.951 -3.201 1.00 0.00 O ATOM 0 H TYR A 21 -3.755 -6.461 -0.398 1.00 0.00 H new ATOM 0 HA TYR A 21 -5.592 -4.310 -0.353 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -5.560 -6.591 -1.696 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -6.518 -7.162 -0.344 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -6.525 -3.786 -1.972 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -8.701 -7.367 -1.198 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -8.532 -2.782 -2.970 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -10.709 -6.364 -2.197 1.00 0.00 H new ATOM 0 HH TYR A 21 -11.603 -4.594 -3.167 1.00 0.00 H new ATOM 354 N HIS A 22 -5.687 -6.422 2.212 1.00 0.00 N ATOM 355 CA HIS A 22 -6.195 -6.541 3.572 1.00 0.00 C ATOM 356 C HIS A 22 -5.679 -5.388 4.421 1.00 0.00 C ATOM 357 O HIS A 22 -6.443 -4.754 5.148 1.00 0.00 O ATOM 358 CB HIS A 22 -5.792 -7.881 4.189 1.00 0.00 C ATOM 359 CG HIS A 22 -6.730 -9.000 3.856 1.00 0.00 C ATOM 360 ND1 HIS A 22 -7.117 -9.955 4.773 1.00 0.00 N ATOM 361 CD2 HIS A 22 -7.361 -9.314 2.700 1.00 0.00 C ATOM 362 CE1 HIS A 22 -7.944 -10.807 4.194 1.00 0.00 C ATOM 363 NE2 HIS A 22 -8.109 -10.440 2.938 1.00 0.00 N ATOM 0 H HIS A 22 -5.054 -7.166 1.920 1.00 0.00 H new ATOM 0 HA HIS A 22 -7.284 -6.499 3.540 1.00 0.00 H new ATOM 0 HB2 HIS A 22 -4.791 -8.143 3.846 1.00 0.00 H new ATOM 0 HB3 HIS A 22 -5.740 -7.772 5.272 1.00 0.00 H new ATOM 0 HD2 HIS A 22 -7.289 -8.778 1.765 1.00 0.00 H new ATOM 0 HE1 HIS A 22 -8.407 -11.660 4.669 1.00 0.00 H new ATOM 0 HE2 HIS A 22 -8.697 -10.916 2.254 1.00 0.00 H new ATOM 372 N THR A 23 -4.386 -5.100 4.310 1.00 0.00 N ATOM 373 CA THR A 23 -3.801 -3.998 5.059 1.00 0.00 C ATOM 374 C THR A 23 -4.395 -2.682 4.579 1.00 0.00 C ATOM 375 O THR A 23 -4.744 -1.814 5.378 1.00 0.00 O ATOM 376 CB THR A 23 -2.285 -3.966 4.913 1.00 0.00 C ATOM 377 OG1 THR A 23 -1.912 -3.795 3.558 1.00 0.00 O ATOM 378 CG2 THR A 23 -1.603 -5.215 5.427 1.00 0.00 C ATOM 0 H THR A 23 -3.732 -5.609 3.716 1.00 0.00 H new ATOM 0 HA THR A 23 -4.032 -4.145 6.114 1.00 0.00 H new ATOM 0 HB THR A 23 -1.958 -3.122 5.520 1.00 0.00 H new ATOM 0 HG1 THR A 23 -2.146 -4.600 3.050 1.00 0.00 H new ATOM 0 HG21 THR A 23 -0.525 -5.123 5.291 1.00 0.00 H new ATOM 0 HG22 THR A 23 -1.826 -5.342 6.486 1.00 0.00 H new ATOM 0 HG23 THR A 23 -1.966 -6.081 4.874 1.00 0.00 H new ATOM 386 N LEU A 24 -4.541 -2.552 3.261 1.00 0.00 N ATOM 387 CA LEU A 24 -5.131 -1.353 2.678 1.00 0.00 C ATOM 388 C LEU A 24 -6.514 -1.119 3.276 1.00 0.00 C ATOM 389 O LEU A 24 -7.055 -0.020 3.201 1.00 0.00 O ATOM 390 CB LEU A 24 -5.241 -1.476 1.152 1.00 0.00 C ATOM 391 CG LEU A 24 -4.198 -0.686 0.350 1.00 0.00 C ATOM 392 CD1 LEU A 24 -4.107 0.748 0.846 1.00 0.00 C ATOM 393 CD2 LEU A 24 -2.836 -1.358 0.422 1.00 0.00 C ATOM 0 H LEU A 24 -4.260 -3.259 2.582 1.00 0.00 H new ATOM 0 HA LEU A 24 -4.483 -0.507 2.906 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -5.160 -2.529 0.883 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -6.234 -1.145 0.849 1.00 0.00 H new ATOM 0 HG LEU A 24 -4.519 -0.670 -0.692 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -3.361 1.288 0.263 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -5.076 1.234 0.735 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -3.818 0.752 1.897 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -2.114 -0.779 -0.154 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -2.511 -1.412 1.461 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -2.905 -2.365 0.011 1.00 0.00 H new ATOM 405 N LYS A 25 -7.083 -2.172 3.862 1.00 0.00 N ATOM 406 CA LYS A 25 -8.401 -2.088 4.461 1.00 0.00 C ATOM 407 C LYS A 25 -8.423 -1.167 5.674 1.00 0.00 C ATOM 408 O LYS A 25 -9.302 -0.313 5.785 1.00 0.00 O ATOM 409 CB LYS A 25 -8.903 -3.480 4.848 1.00 0.00 C ATOM 410 CG LYS A 25 -10.392 -3.529 5.154 1.00 0.00 C ATOM 411 CD LYS A 25 -11.219 -2.972 4.005 1.00 0.00 C ATOM 412 CE LYS A 25 -11.820 -1.620 4.353 1.00 0.00 C ATOM 413 NZ LYS A 25 -13.209 -1.479 3.834 1.00 0.00 N ATOM 0 H LYS A 25 -6.646 -3.091 3.931 1.00 0.00 H new ATOM 0 HA LYS A 25 -9.067 -1.660 3.712 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -8.685 -4.174 4.036 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -8.350 -3.826 5.721 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -10.690 -4.559 5.351 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -10.597 -2.959 6.060 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -10.592 -2.875 3.118 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -12.016 -3.672 3.757 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -11.822 -1.492 5.435 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -11.196 -0.828 3.939 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -13.583 -0.544 4.092 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -13.204 -1.576 2.799 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -13.811 -2.219 4.248 1.00 0.00 H new ATOM 427 N LEU A 26 -7.464 -1.325 6.586 1.00 0.00 N ATOM 428 CA LEU A 26 -7.431 -0.468 7.768 1.00 0.00 C ATOM 429 C LEU A 26 -7.015 0.934 7.368 1.00 0.00 C ATOM 430 O LEU A 26 -7.621 1.916 7.785 1.00 0.00 O ATOM 431 CB LEU A 26 -6.493 -0.999 8.856 1.00 0.00 C ATOM 432 CG LEU A 26 -6.225 -2.497 8.820 1.00 0.00 C ATOM 433 CD1 LEU A 26 -5.076 -2.779 7.877 1.00 0.00 C ATOM 434 CD2 LEU A 26 -5.924 -3.022 10.216 1.00 0.00 C ATOM 0 H LEU A 26 -6.719 -2.019 6.532 1.00 0.00 H new ATOM 0 HA LEU A 26 -8.436 -0.458 8.190 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -5.540 -0.476 8.776 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -6.915 -0.747 9.829 1.00 0.00 H new ATOM 0 HG LEU A 26 -7.115 -3.012 8.458 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -4.882 -3.851 7.850 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -5.333 -2.431 6.876 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -4.184 -2.258 8.224 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -5.735 -4.094 10.169 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -5.044 -2.516 10.613 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -6.777 -2.832 10.868 1.00 0.00 H new ATOM 446 N VAL A 27 -5.982 1.012 6.542 1.00 0.00 N ATOM 447 CA VAL A 27 -5.486 2.296 6.065 1.00 0.00 C ATOM 448 C VAL A 27 -6.541 3.009 5.244 1.00 0.00 C ATOM 449 O VAL A 27 -6.737 4.212 5.386 1.00 0.00 O ATOM 450 CB VAL A 27 -4.218 2.157 5.203 1.00 0.00 C ATOM 451 CG1 VAL A 27 -2.973 2.522 5.991 1.00 0.00 C ATOM 452 CG2 VAL A 27 -4.100 0.772 4.657 1.00 0.00 C ATOM 0 H VAL A 27 -5.471 0.203 6.188 1.00 0.00 H new ATOM 0 HA VAL A 27 -5.241 2.873 6.957 1.00 0.00 H new ATOM 0 HB VAL A 27 -4.306 2.854 4.370 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -2.095 2.414 5.355 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -3.048 3.554 6.333 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -2.881 1.861 6.852 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -3.197 0.696 4.051 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -4.046 0.060 5.480 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -4.971 0.548 4.041 1.00 0.00 H new ATOM 462 N SER A 28 -7.213 2.278 4.370 1.00 0.00 N ATOM 463 CA SER A 28 -8.224 2.898 3.535 1.00 0.00 C ATOM 464 C SER A 28 -9.379 3.429 4.374 1.00 0.00 C ATOM 465 O SER A 28 -9.931 4.491 4.081 1.00 0.00 O ATOM 466 CB SER A 28 -8.741 1.922 2.477 1.00 0.00 C ATOM 467 OG SER A 28 -9.389 0.814 3.077 1.00 0.00 O ATOM 0 H SER A 28 -7.081 1.277 4.223 1.00 0.00 H new ATOM 0 HA SER A 28 -7.755 3.739 3.025 1.00 0.00 H new ATOM 0 HB2 SER A 28 -9.435 2.436 1.812 1.00 0.00 H new ATOM 0 HB3 SER A 28 -7.911 1.573 1.863 1.00 0.00 H new ATOM 0 HG SER A 28 -8.758 0.343 3.661 1.00 0.00 H new ATOM 473 N VAL A 29 -9.735 2.691 5.419 1.00 0.00 N ATOM 474 CA VAL A 29 -10.817 3.088 6.301 1.00 0.00 C ATOM 475 C VAL A 29 -10.342 4.157 7.274 1.00 0.00 C ATOM 476 O VAL A 29 -11.011 5.168 7.489 1.00 0.00 O ATOM 477 CB VAL A 29 -11.358 1.861 7.072 1.00 0.00 C ATOM 478 CG1 VAL A 29 -11.135 1.983 8.571 1.00 0.00 C ATOM 479 CG2 VAL A 29 -12.830 1.637 6.761 1.00 0.00 C ATOM 0 H VAL A 29 -9.286 1.811 5.674 1.00 0.00 H new ATOM 0 HA VAL A 29 -11.624 3.503 5.697 1.00 0.00 H new ATOM 0 HB VAL A 29 -10.794 0.992 6.733 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -11.531 1.099 9.071 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -10.067 2.067 8.774 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -11.647 2.870 8.944 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -13.191 0.769 7.313 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -13.402 2.517 7.054 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -12.954 1.464 5.692 1.00 0.00 H new ATOM 489 N TYR A 30 -9.182 3.912 7.866 1.00 0.00 N ATOM 490 CA TYR A 30 -8.604 4.838 8.830 1.00 0.00 C ATOM 491 C TYR A 30 -8.055 6.085 8.146 1.00 0.00 C ATOM 492 O TYR A 30 -7.959 7.142 8.770 1.00 0.00 O ATOM 493 CB TYR A 30 -7.495 4.155 9.630 1.00 0.00 C ATOM 494 CG TYR A 30 -8.005 3.294 10.763 1.00 0.00 C ATOM 495 CD1 TYR A 30 -8.815 3.830 11.757 1.00 0.00 C ATOM 496 CD2 TYR A 30 -7.678 1.947 10.838 1.00 0.00 C ATOM 497 CE1 TYR A 30 -9.283 3.047 12.795 1.00 0.00 C ATOM 498 CE2 TYR A 30 -8.143 1.157 11.873 1.00 0.00 C ATOM 499 CZ TYR A 30 -8.944 1.712 12.848 1.00 0.00 C ATOM 500 OH TYR A 30 -9.409 0.928 13.879 1.00 0.00 O ATOM 0 H TYR A 30 -8.621 3.077 7.695 1.00 0.00 H new ATOM 0 HA TYR A 30 -9.400 5.144 9.509 1.00 0.00 H new ATOM 0 HB2 TYR A 30 -6.900 3.538 8.956 1.00 0.00 H new ATOM 0 HB3 TYR A 30 -6.830 4.917 10.036 1.00 0.00 H new ATOM 0 HD1 TYR A 30 -9.083 4.875 11.718 1.00 0.00 H new ATOM 0 HD2 TYR A 30 -7.050 1.509 10.076 1.00 0.00 H new ATOM 0 HE1 TYR A 30 -9.911 3.479 13.560 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -7.880 0.110 11.917 1.00 0.00 H new ATOM 0 HH TYR A 30 -9.080 0.012 13.767 1.00 0.00 H new ATOM 510 N LEU A 31 -7.695 5.973 6.868 1.00 0.00 N ATOM 511 CA LEU A 31 -7.164 7.118 6.143 1.00 0.00 C ATOM 512 C LEU A 31 -8.184 7.636 5.132 1.00 0.00 C ATOM 513 O LEU A 31 -7.936 8.627 4.445 1.00 0.00 O ATOM 514 CB LEU A 31 -5.856 6.758 5.420 1.00 0.00 C ATOM 515 CG LEU A 31 -4.809 5.952 6.219 1.00 0.00 C ATOM 516 CD1 LEU A 31 -3.412 6.496 5.958 1.00 0.00 C ATOM 517 CD2 LEU A 31 -5.100 5.955 7.715 1.00 0.00 C ATOM 0 H LEU A 31 -7.761 5.113 6.323 1.00 0.00 H new ATOM 0 HA LEU A 31 -6.955 7.901 6.872 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -6.110 6.189 4.525 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -5.388 7.684 5.087 1.00 0.00 H new ATOM 0 HG LEU A 31 -4.866 4.919 5.876 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -2.684 5.918 6.528 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -3.184 6.419 4.895 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -3.365 7.541 6.264 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -4.337 5.376 8.235 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -5.092 6.980 8.085 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -6.079 5.511 7.896 1.00 0.00 H new ATOM 529 N ASN A 32 -9.329 6.958 5.031 1.00 0.00 N ATOM 530 CA ASN A 32 -10.367 7.356 4.087 1.00 0.00 C ATOM 531 C ASN A 32 -9.762 7.538 2.703 1.00 0.00 C ATOM 532 O ASN A 32 -10.163 8.419 1.942 1.00 0.00 O ATOM 533 CB ASN A 32 -11.039 8.653 4.542 1.00 0.00 C ATOM 534 CG ASN A 32 -12.395 8.861 3.895 1.00 0.00 C ATOM 535 OD1 ASN A 32 -13.013 7.916 3.405 1.00 0.00 O ATOM 536 ND2 ASN A 32 -12.865 10.103 3.891 1.00 0.00 N ATOM 0 H ASN A 32 -9.557 6.136 5.589 1.00 0.00 H new ATOM 0 HA ASN A 32 -11.123 6.572 4.048 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -11.155 8.638 5.626 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -10.392 9.497 4.303 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -13.772 10.304 3.470 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -12.319 10.856 4.309 1.00 0.00 H new ATOM 543 N ARG A 33 -8.775 6.704 2.398 1.00 0.00 N ATOM 544 CA ARG A 33 -8.082 6.771 1.117 1.00 0.00 C ATOM 545 C ARG A 33 -8.134 5.438 0.383 1.00 0.00 C ATOM 546 O ARG A 33 -7.862 4.388 0.964 1.00 0.00 O ATOM 547 CB ARG A 33 -6.620 7.172 1.339 1.00 0.00 C ATOM 548 CG ARG A 33 -6.448 8.604 1.818 1.00 0.00 C ATOM 549 CD ARG A 33 -5.206 9.246 1.222 1.00 0.00 C ATOM 550 NE ARG A 33 -5.510 10.013 0.017 1.00 0.00 N ATOM 551 CZ ARG A 33 -4.583 10.509 -0.800 1.00 0.00 C ATOM 552 NH1 ARG A 33 -3.294 10.320 -0.545 1.00 0.00 N ATOM 553 NH2 ARG A 33 -4.945 11.196 -1.875 1.00 0.00 N ATOM 0 H ARG A 33 -8.436 5.972 3.022 1.00 0.00 H new ATOM 0 HA ARG A 33 -8.586 7.518 0.504 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -6.174 6.497 2.070 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -6.070 7.041 0.407 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -7.327 9.188 1.545 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -6.380 8.619 2.906 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -4.746 9.901 1.962 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -4.476 8.472 0.984 1.00 0.00 H new ATOM 0 HE ARG A 33 -6.490 10.178 -0.212 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -3.009 9.792 0.280 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -2.588 10.702 -1.174 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -5.934 11.345 -2.076 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -4.235 11.576 -2.501 1.00 0.00 H new ATOM 567 N ASP A 34 -8.460 5.486 -0.906 1.00 0.00 N ATOM 568 CA ASP A 34 -8.514 4.277 -1.717 1.00 0.00 C ATOM 569 C ASP A 34 -7.184 3.543 -1.624 1.00 0.00 C ATOM 570 O ASP A 34 -6.183 4.122 -1.200 1.00 0.00 O ATOM 571 CB ASP A 34 -8.828 4.621 -3.174 1.00 0.00 C ATOM 572 CG ASP A 34 -9.560 3.501 -3.888 1.00 0.00 C ATOM 573 OD1 ASP A 34 -9.292 3.287 -5.089 1.00 0.00 O ATOM 574 OD2 ASP A 34 -10.400 2.837 -3.245 1.00 0.00 O ATOM 0 H ASP A 34 -8.689 6.344 -1.407 1.00 0.00 H new ATOM 0 HA ASP A 34 -9.308 3.633 -1.340 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -9.433 5.527 -3.208 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -7.899 4.838 -3.701 1.00 0.00 H new ATOM 579 N MET A 35 -7.161 2.275 -2.012 1.00 0.00 N ATOM 580 CA MET A 35 -5.939 1.502 -1.951 1.00 0.00 C ATOM 581 C MET A 35 -4.851 2.165 -2.796 1.00 0.00 C ATOM 582 O MET A 35 -3.691 2.230 -2.392 1.00 0.00 O ATOM 583 CB MET A 35 -6.200 0.069 -2.419 1.00 0.00 C ATOM 584 CG MET A 35 -5.107 -0.480 -3.308 1.00 0.00 C ATOM 585 SD MET A 35 -5.366 -2.205 -3.763 1.00 0.00 S ATOM 586 CE MET A 35 -4.232 -3.024 -2.644 1.00 0.00 C ATOM 0 H MET A 35 -7.971 1.768 -2.369 1.00 0.00 H new ATOM 0 HA MET A 35 -5.591 1.466 -0.919 1.00 0.00 H new ATOM 0 HB2 MET A 35 -6.308 -0.576 -1.547 1.00 0.00 H new ATOM 0 HB3 MET A 35 -7.147 0.037 -2.958 1.00 0.00 H new ATOM 0 HG2 MET A 35 -5.046 0.123 -4.214 1.00 0.00 H new ATOM 0 HG3 MET A 35 -4.149 -0.385 -2.797 1.00 0.00 H new ATOM 0 HE1 MET A 35 -4.316 -4.104 -2.767 1.00 0.00 H new ATOM 0 HE2 MET A 35 -3.212 -2.711 -2.867 1.00 0.00 H new ATOM 0 HE3 MET A 35 -4.477 -2.756 -1.616 1.00 0.00 H new ATOM 596 N THR A 36 -5.239 2.658 -3.968 1.00 0.00 N ATOM 597 CA THR A 36 -4.298 3.319 -4.863 1.00 0.00 C ATOM 598 C THR A 36 -3.832 4.638 -4.261 1.00 0.00 C ATOM 599 O THR A 36 -2.696 5.058 -4.468 1.00 0.00 O ATOM 600 CB THR A 36 -4.936 3.559 -6.239 1.00 0.00 C ATOM 601 OG1 THR A 36 -6.169 2.868 -6.350 1.00 0.00 O ATOM 602 CG2 THR A 36 -4.064 3.124 -7.397 1.00 0.00 C ATOM 0 H THR A 36 -6.196 2.612 -4.319 1.00 0.00 H new ATOM 0 HA THR A 36 -3.433 2.668 -4.993 1.00 0.00 H new ATOM 0 HB THR A 36 -5.077 4.638 -6.300 1.00 0.00 H new ATOM 0 HG1 THR A 36 -6.560 3.036 -7.233 1.00 0.00 H new ATOM 0 HG21 THR A 36 -4.580 3.324 -8.336 1.00 0.00 H new ATOM 0 HG22 THR A 36 -3.125 3.677 -7.374 1.00 0.00 H new ATOM 0 HG23 THR A 36 -3.858 2.057 -7.316 1.00 0.00 H new ATOM 610 N GLU A 37 -4.714 5.282 -3.507 1.00 0.00 N ATOM 611 CA GLU A 37 -4.386 6.548 -2.866 1.00 0.00 C ATOM 612 C GLU A 37 -3.438 6.321 -1.694 1.00 0.00 C ATOM 613 O GLU A 37 -2.541 7.124 -1.444 1.00 0.00 O ATOM 614 CB GLU A 37 -5.659 7.249 -2.387 1.00 0.00 C ATOM 615 CG GLU A 37 -6.105 8.385 -3.292 1.00 0.00 C ATOM 616 CD GLU A 37 -7.404 9.019 -2.835 1.00 0.00 C ATOM 617 OE1 GLU A 37 -8.367 9.039 -3.632 1.00 0.00 O ATOM 618 OE2 GLU A 37 -7.460 9.494 -1.682 1.00 0.00 O ATOM 0 H GLU A 37 -5.661 4.949 -3.325 1.00 0.00 H new ATOM 0 HA GLU A 37 -3.890 7.186 -3.597 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -6.462 6.516 -2.315 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -5.493 7.639 -1.383 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -5.325 9.146 -3.325 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -6.226 8.009 -4.308 1.00 0.00 H new ATOM 625 N ILE A 38 -3.644 5.218 -0.981 1.00 0.00 N ATOM 626 CA ILE A 38 -2.811 4.878 0.168 1.00 0.00 C ATOM 627 C ILE A 38 -1.479 4.277 -0.274 1.00 0.00 C ATOM 628 O ILE A 38 -0.423 4.669 0.222 1.00 0.00 O ATOM 629 CB ILE A 38 -3.531 3.878 1.104 1.00 0.00 C ATOM 630 CG1 ILE A 38 -4.526 4.590 2.028 1.00 0.00 C ATOM 631 CG2 ILE A 38 -2.534 3.099 1.945 1.00 0.00 C ATOM 632 CD1 ILE A 38 -3.948 5.810 2.715 1.00 0.00 C ATOM 0 H ILE A 38 -4.382 4.543 -1.179 1.00 0.00 H new ATOM 0 HA ILE A 38 -2.623 5.805 0.710 1.00 0.00 H new ATOM 0 HB ILE A 38 -4.079 3.185 0.465 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -5.398 4.889 1.447 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -4.873 3.887 2.785 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -3.069 2.404 2.593 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -1.863 2.542 1.291 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -1.954 3.791 2.556 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -4.708 6.263 3.352 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -3.093 5.514 3.323 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -3.627 6.532 1.964 1.00 0.00 H new ATOM 644 N ILE A 39 -1.526 3.320 -1.200 1.00 0.00 N ATOM 645 CA ILE A 39 -0.307 2.680 -1.680 1.00 0.00 C ATOM 646 C ILE A 39 0.639 3.713 -2.271 1.00 0.00 C ATOM 647 O ILE A 39 1.855 3.632 -2.100 1.00 0.00 O ATOM 648 CB ILE A 39 -0.606 1.607 -2.741 1.00 0.00 C ATOM 649 CG1 ILE A 39 -1.205 2.257 -3.986 1.00 0.00 C ATOM 650 CG2 ILE A 39 -1.542 0.546 -2.180 1.00 0.00 C ATOM 651 CD1 ILE A 39 -0.183 2.555 -5.061 1.00 0.00 C ATOM 0 H ILE A 39 -2.386 2.975 -1.627 1.00 0.00 H new ATOM 0 HA ILE A 39 0.161 2.198 -0.822 1.00 0.00 H new ATOM 0 HB ILE A 39 0.327 1.118 -3.020 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -1.972 1.600 -4.396 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -1.701 3.185 -3.699 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -1.742 -0.204 -2.945 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -1.076 0.069 -1.317 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -2.479 1.012 -1.875 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -0.678 3.016 -5.916 1.00 0.00 H new ATOM 0 HD12 ILE A 39 0.571 3.237 -4.667 1.00 0.00 H new ATOM 0 HD13 ILE A 39 0.296 1.627 -5.375 1.00 0.00 H new ATOM 663 N GLU A 40 0.065 4.689 -2.965 1.00 0.00 N ATOM 664 CA GLU A 40 0.852 5.744 -3.577 1.00 0.00 C ATOM 665 C GLU A 40 1.142 6.842 -2.564 1.00 0.00 C ATOM 666 O GLU A 40 2.093 7.609 -2.726 1.00 0.00 O ATOM 667 CB GLU A 40 0.129 6.320 -4.796 1.00 0.00 C ATOM 668 CG GLU A 40 1.006 6.416 -6.033 1.00 0.00 C ATOM 669 CD GLU A 40 1.366 5.055 -6.597 1.00 0.00 C ATOM 670 OE1 GLU A 40 0.496 4.429 -7.238 1.00 0.00 O ATOM 671 OE2 GLU A 40 2.518 4.616 -6.399 1.00 0.00 O ATOM 0 H GLU A 40 -0.941 4.769 -3.116 1.00 0.00 H new ATOM 0 HA GLU A 40 1.798 5.318 -3.910 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -0.737 5.698 -5.022 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -0.247 7.313 -4.549 1.00 0.00 H new ATOM 0 HG2 GLU A 40 0.489 6.997 -6.797 1.00 0.00 H new ATOM 0 HG3 GLU A 40 1.920 6.956 -5.786 1.00 0.00 H new ATOM 678 N GLU A 41 0.338 6.905 -1.503 1.00 0.00 N ATOM 679 CA GLU A 41 0.553 7.903 -0.466 1.00 0.00 C ATOM 680 C GLU A 41 1.597 7.398 0.522 1.00 0.00 C ATOM 681 O GLU A 41 2.340 8.181 1.115 1.00 0.00 O ATOM 682 CB GLU A 41 -0.759 8.220 0.260 1.00 0.00 C ATOM 683 CG GLU A 41 -0.591 9.100 1.489 1.00 0.00 C ATOM 684 CD GLU A 41 -1.669 8.862 2.527 1.00 0.00 C ATOM 685 OE1 GLU A 41 -2.520 9.757 2.718 1.00 0.00 O ATOM 686 OE2 GLU A 41 -1.666 7.779 3.150 1.00 0.00 O ATOM 0 H GLU A 41 -0.456 6.285 -1.343 1.00 0.00 H new ATOM 0 HA GLU A 41 0.914 8.821 -0.930 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -1.437 8.713 -0.437 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -1.232 7.284 0.558 1.00 0.00 H new ATOM 0 HG2 GLU A 41 0.386 8.912 1.935 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -0.607 10.147 1.187 1.00 0.00 H new ATOM 693 N ALA A 42 1.652 6.080 0.684 1.00 0.00 N ATOM 694 CA ALA A 42 2.611 5.468 1.592 1.00 0.00 C ATOM 695 C ALA A 42 4.003 5.466 0.978 1.00 0.00 C ATOM 696 O ALA A 42 4.989 5.792 1.638 1.00 0.00 O ATOM 697 CB ALA A 42 2.182 4.050 1.936 1.00 0.00 C ATOM 0 H ALA A 42 1.045 5.418 0.199 1.00 0.00 H new ATOM 0 HA ALA A 42 2.641 6.056 2.510 1.00 0.00 H new ATOM 0 HB1 ALA A 42 2.909 3.605 2.616 1.00 0.00 H new ATOM 0 HB2 ALA A 42 1.203 4.072 2.415 1.00 0.00 H new ATOM 0 HB3 ALA A 42 2.126 3.455 1.024 1.00 0.00 H new ATOM 703 N VAL A 43 4.070 5.099 -0.298 1.00 0.00 N ATOM 704 CA VAL A 43 5.337 5.053 -1.021 1.00 0.00 C ATOM 705 C VAL A 43 6.104 6.351 -0.870 1.00 0.00 C ATOM 706 O VAL A 43 7.210 6.384 -0.333 1.00 0.00 O ATOM 707 CB VAL A 43 5.112 4.791 -2.532 1.00 0.00 C ATOM 708 CG1 VAL A 43 4.005 5.657 -3.092 1.00 0.00 C ATOM 709 CG2 VAL A 43 6.385 5.024 -3.323 1.00 0.00 C ATOM 0 H VAL A 43 3.259 4.828 -0.854 1.00 0.00 H new ATOM 0 HA VAL A 43 5.914 4.235 -0.589 1.00 0.00 H new ATOM 0 HB VAL A 43 4.817 3.746 -2.629 1.00 0.00 H new ATOM 0 HG11 VAL A 43 3.878 5.444 -4.153 1.00 0.00 H new ATOM 0 HG12 VAL A 43 3.075 5.444 -2.565 1.00 0.00 H new ATOM 0 HG13 VAL A 43 4.264 6.708 -2.961 1.00 0.00 H new ATOM 0 HG21 VAL A 43 6.197 4.833 -4.379 1.00 0.00 H new ATOM 0 HG22 VAL A 43 6.710 6.056 -3.193 1.00 0.00 H new ATOM 0 HG23 VAL A 43 7.164 4.351 -2.965 1.00 0.00 H new ATOM 719 N VAL A 44 5.500 7.413 -1.360 1.00 0.00 N ATOM 720 CA VAL A 44 6.099 8.729 -1.306 1.00 0.00 C ATOM 721 C VAL A 44 6.421 9.109 0.130 1.00 0.00 C ATOM 722 O VAL A 44 7.530 9.542 0.435 1.00 0.00 O ATOM 723 CB VAL A 44 5.161 9.772 -1.945 1.00 0.00 C ATOM 724 CG1 VAL A 44 5.193 11.104 -1.199 1.00 0.00 C ATOM 725 CG2 VAL A 44 5.502 9.969 -3.412 1.00 0.00 C ATOM 0 H VAL A 44 4.583 7.388 -1.806 1.00 0.00 H new ATOM 0 HA VAL A 44 7.030 8.709 -1.872 1.00 0.00 H new ATOM 0 HB VAL A 44 4.145 9.385 -1.870 1.00 0.00 H new ATOM 0 HG11 VAL A 44 4.517 11.809 -1.684 1.00 0.00 H new ATOM 0 HG12 VAL A 44 4.878 10.951 -0.167 1.00 0.00 H new ATOM 0 HG13 VAL A 44 6.207 11.505 -1.213 1.00 0.00 H new ATOM 0 HG21 VAL A 44 4.829 10.709 -3.846 1.00 0.00 H new ATOM 0 HG22 VAL A 44 6.531 10.317 -3.503 1.00 0.00 H new ATOM 0 HG23 VAL A 44 5.391 9.023 -3.942 1.00 0.00 H new ATOM 735 N MET A 45 5.448 8.937 1.010 1.00 0.00 N ATOM 736 CA MET A 45 5.638 9.259 2.413 1.00 0.00 C ATOM 737 C MET A 45 6.805 8.468 2.992 1.00 0.00 C ATOM 738 O MET A 45 7.508 8.950 3.878 1.00 0.00 O ATOM 739 CB MET A 45 4.366 8.979 3.212 1.00 0.00 C ATOM 740 CG MET A 45 4.466 9.398 4.670 1.00 0.00 C ATOM 741 SD MET A 45 4.973 8.046 5.747 1.00 0.00 S ATOM 742 CE MET A 45 5.410 8.944 7.234 1.00 0.00 C ATOM 0 H MET A 45 4.522 8.577 0.778 1.00 0.00 H new ATOM 0 HA MET A 45 5.865 10.323 2.486 1.00 0.00 H new ATOM 0 HB2 MET A 45 3.531 9.503 2.747 1.00 0.00 H new ATOM 0 HB3 MET A 45 4.141 7.914 3.162 1.00 0.00 H new ATOM 0 HG2 MET A 45 5.180 10.217 4.761 1.00 0.00 H new ATOM 0 HG3 MET A 45 3.500 9.779 5.002 1.00 0.00 H new ATOM 0 HE1 MET A 45 5.608 8.238 8.040 1.00 0.00 H new ATOM 0 HE2 MET A 45 6.302 9.543 7.049 1.00 0.00 H new ATOM 0 HE3 MET A 45 4.586 9.598 7.519 1.00 0.00 H new ATOM 752 N TRP A 46 7.022 7.255 2.480 1.00 0.00 N ATOM 753 CA TRP A 46 8.125 6.436 2.962 1.00 0.00 C ATOM 754 C TRP A 46 9.447 7.052 2.531 1.00 0.00 C ATOM 755 O TRP A 46 10.308 7.340 3.361 1.00 0.00 O ATOM 756 CB TRP A 46 8.002 5.000 2.443 1.00 0.00 C ATOM 757 CG TRP A 46 9.199 4.145 2.747 1.00 0.00 C ATOM 758 CD1 TRP A 46 9.794 3.248 1.907 1.00 0.00 C ATOM 759 CD2 TRP A 46 9.943 4.104 3.972 1.00 0.00 C ATOM 760 NE1 TRP A 46 10.862 2.652 2.534 1.00 0.00 N ATOM 761 CE2 TRP A 46 10.974 3.161 3.801 1.00 0.00 C ATOM 762 CE3 TRP A 46 9.840 4.774 5.196 1.00 0.00 C ATOM 763 CZ2 TRP A 46 11.894 2.871 4.807 1.00 0.00 C ATOM 764 CZ3 TRP A 46 10.754 4.484 6.193 1.00 0.00 C ATOM 765 CH2 TRP A 46 11.768 3.541 5.993 1.00 0.00 C ATOM 0 H TRP A 46 6.458 6.828 1.745 1.00 0.00 H new ATOM 0 HA TRP A 46 8.089 6.402 4.051 1.00 0.00 H new ATOM 0 HB2 TRP A 46 7.116 4.539 2.881 1.00 0.00 H new ATOM 0 HB3 TRP A 46 7.848 5.025 1.364 1.00 0.00 H new ATOM 0 HD1 TRP A 46 9.472 3.038 0.898 1.00 0.00 H new ATOM 0 HE1 TRP A 46 11.472 1.946 2.123 1.00 0.00 H new ATOM 0 HE3 TRP A 46 9.061 5.504 5.359 1.00 0.00 H new ATOM 0 HZ2 TRP A 46 12.678 2.144 4.656 1.00 0.00 H new ATOM 0 HZ3 TRP A 46 10.684 4.994 7.142 1.00 0.00 H new ATOM 0 HH2 TRP A 46 12.466 3.338 6.792 1.00 0.00 H new ATOM 776 N LEU A 47 9.594 7.273 1.230 1.00 0.00 N ATOM 777 CA LEU A 47 10.807 7.883 0.705 1.00 0.00 C ATOM 778 C LEU A 47 11.007 9.248 1.323 1.00 0.00 C ATOM 779 O LEU A 47 12.101 9.606 1.747 1.00 0.00 O ATOM 780 CB LEU A 47 10.743 8.063 -0.811 1.00 0.00 C ATOM 781 CG LEU A 47 9.363 8.361 -1.395 1.00 0.00 C ATOM 782 CD1 LEU A 47 9.226 9.851 -1.664 1.00 0.00 C ATOM 783 CD2 LEU A 47 9.136 7.560 -2.671 1.00 0.00 C ATOM 0 H LEU A 47 8.894 7.041 0.525 1.00 0.00 H new ATOM 0 HA LEU A 47 11.632 7.215 0.952 1.00 0.00 H new ATOM 0 HB2 LEU A 47 11.416 8.875 -1.089 1.00 0.00 H new ATOM 0 HB3 LEU A 47 11.126 7.157 -1.281 1.00 0.00 H new ATOM 0 HG LEU A 47 8.603 8.064 -0.672 1.00 0.00 H new ATOM 0 HD11 LEU A 47 8.240 10.056 -2.080 1.00 0.00 H new ATOM 0 HD12 LEU A 47 9.348 10.402 -0.731 1.00 0.00 H new ATOM 0 HD13 LEU A 47 9.992 10.165 -2.373 1.00 0.00 H new ATOM 0 HD21 LEU A 47 8.148 7.786 -3.072 1.00 0.00 H new ATOM 0 HD22 LEU A 47 9.895 7.825 -3.407 1.00 0.00 H new ATOM 0 HD23 LEU A 47 9.202 6.495 -2.449 1.00 0.00 H new ATOM 795 N ILE A 48 9.933 10.015 1.351 1.00 0.00 N ATOM 796 CA ILE A 48 9.973 11.350 1.887 1.00 0.00 C ATOM 797 C ILE A 48 10.486 11.357 3.318 1.00 0.00 C ATOM 798 O ILE A 48 11.296 12.206 3.690 1.00 0.00 O ATOM 799 CB ILE A 48 8.579 11.996 1.803 1.00 0.00 C ATOM 800 CG1 ILE A 48 8.618 13.147 0.816 1.00 0.00 C ATOM 801 CG2 ILE A 48 8.090 12.460 3.163 1.00 0.00 C ATOM 802 CD1 ILE A 48 8.755 12.709 -0.625 1.00 0.00 C ATOM 0 H ILE A 48 9.018 9.727 1.004 1.00 0.00 H new ATOM 0 HA ILE A 48 10.669 11.937 1.287 1.00 0.00 H new ATOM 0 HB ILE A 48 7.870 11.246 1.454 1.00 0.00 H new ATOM 0 HG12 ILE A 48 7.707 13.736 0.922 1.00 0.00 H new ATOM 0 HG13 ILE A 48 9.452 13.802 1.068 1.00 0.00 H new ATOM 0 HG21 ILE A 48 7.103 12.910 3.060 1.00 0.00 H new ATOM 0 HG22 ILE A 48 8.031 11.607 3.839 1.00 0.00 H new ATOM 0 HG23 ILE A 48 8.784 13.196 3.567 1.00 0.00 H new ATOM 0 HD11 ILE A 48 8.776 13.586 -1.272 1.00 0.00 H new ATOM 0 HD12 ILE A 48 9.680 12.146 -0.748 1.00 0.00 H new ATOM 0 HD13 ILE A 48 7.908 12.079 -0.896 1.00 0.00 H new ATOM 814 N GLN A 49 10.007 10.419 4.121 1.00 0.00 N ATOM 815 CA GLN A 49 10.427 10.350 5.506 1.00 0.00 C ATOM 816 C GLN A 49 11.745 9.588 5.658 1.00 0.00 C ATOM 817 O GLN A 49 12.461 9.769 6.643 1.00 0.00 O ATOM 818 CB GLN A 49 9.337 9.695 6.362 1.00 0.00 C ATOM 819 CG GLN A 49 9.261 8.183 6.211 1.00 0.00 C ATOM 820 CD GLN A 49 8.224 7.554 7.121 1.00 0.00 C ATOM 821 OE1 GLN A 49 7.402 6.749 6.681 1.00 0.00 O ATOM 822 NE2 GLN A 49 8.257 7.916 8.399 1.00 0.00 N ATOM 0 H GLN A 49 9.336 9.705 3.839 1.00 0.00 H new ATOM 0 HA GLN A 49 10.589 11.371 5.853 1.00 0.00 H new ATOM 0 HB2 GLN A 49 9.517 9.937 7.409 1.00 0.00 H new ATOM 0 HB3 GLN A 49 8.372 10.126 6.096 1.00 0.00 H new ATOM 0 HG2 GLN A 49 9.026 7.937 5.175 1.00 0.00 H new ATOM 0 HG3 GLN A 49 10.238 7.751 6.428 1.00 0.00 H new ATOM 0 HE21 GLN A 49 8.955 8.586 8.721 1.00 0.00 H new ATOM 0 HE22 GLN A 49 7.584 7.524 9.058 1.00 0.00 H new ATOM 831 N ASN A 50 12.050 8.717 4.697 1.00 0.00 N ATOM 832 CA ASN A 50 13.272 7.915 4.763 1.00 0.00 C ATOM 833 C ASN A 50 14.415 8.509 3.941 1.00 0.00 C ATOM 834 O ASN A 50 15.471 8.838 4.479 1.00 0.00 O ATOM 835 CB ASN A 50 12.986 6.489 4.290 1.00 0.00 C ATOM 836 CG ASN A 50 14.159 5.557 4.521 1.00 0.00 C ATOM 837 OD1 ASN A 50 14.966 5.769 5.426 1.00 0.00 O ATOM 838 ND2 ASN A 50 14.258 4.517 3.701 1.00 0.00 N ATOM 0 H ASN A 50 11.475 8.549 3.871 1.00 0.00 H new ATOM 0 HA ASN A 50 13.592 7.910 5.805 1.00 0.00 H new ATOM 0 HB2 ASN A 50 12.111 6.104 4.814 1.00 0.00 H new ATOM 0 HB3 ASN A 50 12.741 6.504 3.228 1.00 0.00 H new ATOM 0 HD21 ASN A 50 15.026 3.855 3.808 1.00 0.00 H new ATOM 0 HD22 ASN A 50 13.566 4.381 2.964 1.00 0.00 H new ATOM 845 N LYS A 51 14.202 8.623 2.638 1.00 0.00 N ATOM 846 CA LYS A 51 15.219 9.153 1.725 1.00 0.00 C ATOM 847 C LYS A 51 15.871 10.424 2.263 1.00 0.00 C ATOM 848 O LYS A 51 17.097 10.538 2.284 1.00 0.00 O ATOM 849 CB LYS A 51 14.610 9.428 0.350 1.00 0.00 C ATOM 850 CG LYS A 51 14.205 8.168 -0.391 1.00 0.00 C ATOM 851 CD LYS A 51 15.423 7.403 -0.886 1.00 0.00 C ATOM 852 CE LYS A 51 15.211 5.900 -0.811 1.00 0.00 C ATOM 853 NZ LYS A 51 14.677 5.477 0.513 1.00 0.00 N ATOM 0 H LYS A 51 13.330 8.355 2.182 1.00 0.00 H new ATOM 0 HA LYS A 51 15.995 8.393 1.636 1.00 0.00 H new ATOM 0 HB2 LYS A 51 13.736 10.068 0.469 1.00 0.00 H new ATOM 0 HB3 LYS A 51 15.329 9.981 -0.254 1.00 0.00 H new ATOM 0 HG2 LYS A 51 13.615 7.530 0.267 1.00 0.00 H new ATOM 0 HG3 LYS A 51 13.569 8.429 -1.236 1.00 0.00 H new ATOM 0 HD2 LYS A 51 15.639 7.689 -1.915 1.00 0.00 H new ATOM 0 HD3 LYS A 51 16.293 7.678 -0.289 1.00 0.00 H new ATOM 0 HE2 LYS A 51 14.520 5.592 -1.596 1.00 0.00 H new ATOM 0 HE3 LYS A 51 16.156 5.391 -1.000 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 15.173 4.619 0.829 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 14.825 6.238 1.206 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 13.660 5.278 0.429 1.00 0.00 H new ATOM 867 N GLU A 52 15.050 11.379 2.683 1.00 0.00 N ATOM 868 CA GLU A 52 15.553 12.647 3.206 1.00 0.00 C ATOM 869 C GLU A 52 16.695 12.433 4.198 1.00 0.00 C ATOM 870 O GLU A 52 17.677 13.174 4.198 1.00 0.00 O ATOM 871 CB GLU A 52 14.419 13.428 3.876 1.00 0.00 C ATOM 872 CG GLU A 52 14.394 14.902 3.503 1.00 0.00 C ATOM 873 CD GLU A 52 12.998 15.398 3.182 1.00 0.00 C ATOM 874 OE1 GLU A 52 12.080 15.156 3.994 1.00 0.00 O ATOM 875 OE2 GLU A 52 12.822 16.030 2.119 1.00 0.00 O ATOM 0 H GLU A 52 14.033 11.301 2.672 1.00 0.00 H new ATOM 0 HA GLU A 52 15.942 13.221 2.365 1.00 0.00 H new ATOM 0 HB2 GLU A 52 13.466 12.976 3.602 1.00 0.00 H new ATOM 0 HB3 GLU A 52 14.516 13.337 4.958 1.00 0.00 H new ATOM 0 HG2 GLU A 52 14.804 15.488 4.326 1.00 0.00 H new ATOM 0 HG3 GLU A 52 15.041 15.066 2.641 1.00 0.00 H new ATOM 882 N LYS A 53 16.551 11.421 5.045 1.00 0.00 N ATOM 883 CA LYS A 53 17.566 11.114 6.049 1.00 0.00 C ATOM 884 C LYS A 53 18.022 9.659 5.959 1.00 0.00 C ATOM 885 O LYS A 53 18.413 9.069 6.965 1.00 0.00 O ATOM 886 CB LYS A 53 17.025 11.403 7.450 1.00 0.00 C ATOM 887 CG LYS A 53 15.878 10.493 7.859 1.00 0.00 C ATOM 888 CD LYS A 53 16.249 9.625 9.052 1.00 0.00 C ATOM 889 CE LYS A 53 15.793 8.187 8.859 1.00 0.00 C ATOM 890 NZ LYS A 53 16.022 7.364 10.078 1.00 0.00 N ATOM 0 H LYS A 53 15.743 10.799 5.058 1.00 0.00 H new ATOM 0 HA LYS A 53 18.429 11.751 5.854 1.00 0.00 H new ATOM 0 HB2 LYS A 53 17.835 11.299 8.172 1.00 0.00 H new ATOM 0 HB3 LYS A 53 16.689 12.439 7.494 1.00 0.00 H new ATOM 0 HG2 LYS A 53 15.004 11.096 8.105 1.00 0.00 H new ATOM 0 HG3 LYS A 53 15.600 9.857 7.018 1.00 0.00 H new ATOM 0 HD2 LYS A 53 17.329 9.649 9.199 1.00 0.00 H new ATOM 0 HD3 LYS A 53 15.796 10.033 9.955 1.00 0.00 H new ATOM 0 HE2 LYS A 53 14.733 8.173 8.605 1.00 0.00 H new ATOM 0 HE3 LYS A 53 16.328 7.746 8.018 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 15.229 6.703 10.205 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 16.906 6.827 9.973 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 16.091 7.986 10.909 1.00 0.00 H new ATOM 904 N LEU A 54 17.964 9.082 4.759 1.00 0.00 N ATOM 905 CA LEU A 54 18.361 7.688 4.555 1.00 0.00 C ATOM 906 C LEU A 54 19.774 7.431 5.074 1.00 0.00 C ATOM 907 O LEU A 54 20.758 7.760 4.412 1.00 0.00 O ATOM 908 CB LEU A 54 18.293 7.326 3.071 1.00 0.00 C ATOM 909 CG LEU A 54 18.375 5.827 2.764 1.00 0.00 C ATOM 910 CD1 LEU A 54 16.985 5.211 2.745 1.00 0.00 C ATOM 911 CD2 LEU A 54 19.080 5.594 1.436 1.00 0.00 C ATOM 0 H LEU A 54 17.646 9.557 3.914 1.00 0.00 H new ATOM 0 HA LEU A 54 17.665 7.063 5.116 1.00 0.00 H new ATOM 0 HB2 LEU A 54 17.361 7.715 2.660 1.00 0.00 H new ATOM 0 HB3 LEU A 54 19.106 7.833 2.552 1.00 0.00 H new ATOM 0 HG LEU A 54 18.954 5.344 3.551 1.00 0.00 H new ATOM 0 HD11 LEU A 54 17.062 4.146 2.525 1.00 0.00 H new ATOM 0 HD12 LEU A 54 16.513 5.348 3.718 1.00 0.00 H new ATOM 0 HD13 LEU A 54 16.382 5.697 1.978 1.00 0.00 H new ATOM 0 HD21 LEU A 54 19.130 4.524 1.233 1.00 0.00 H new ATOM 0 HD22 LEU A 54 18.526 6.089 0.638 1.00 0.00 H new ATOM 0 HD23 LEU A 54 20.090 6.002 1.484 1.00 0.00 H new ATOM 923 N PRO A 55 19.893 6.832 6.274 1.00 0.00 N ATOM 924 CA PRO A 55 21.186 6.525 6.888 1.00 0.00 C ATOM 925 C PRO A 55 21.833 5.286 6.281 1.00 0.00 C ATOM 926 O PRO A 55 21.159 4.462 5.662 1.00 0.00 O ATOM 927 CB PRO A 55 20.841 6.264 8.366 1.00 0.00 C ATOM 928 CG PRO A 55 19.380 6.554 8.506 1.00 0.00 C ATOM 929 CD PRO A 55 18.789 6.403 7.136 1.00 0.00 C ATOM 0 HA PRO A 55 21.901 7.334 6.739 1.00 0.00 H new ATOM 0 HB2 PRO A 55 21.062 5.233 8.642 1.00 0.00 H new ATOM 0 HB3 PRO A 55 21.430 6.904 9.023 1.00 0.00 H new ATOM 0 HG2 PRO A 55 18.912 5.865 9.210 1.00 0.00 H new ATOM 0 HG3 PRO A 55 19.218 7.561 8.891 1.00 0.00 H new ATOM 0 HD2 PRO A 55 18.490 5.375 6.933 1.00 0.00 H new ATOM 0 HD3 PRO A 55 17.904 7.025 7.004 1.00 0.00 H new ATOM 937 N ASN A 56 23.138 5.152 6.478 1.00 0.00 N ATOM 938 CA ASN A 56 23.872 4.002 5.966 1.00 0.00 C ATOM 939 C ASN A 56 23.585 2.765 6.814 1.00 0.00 C ATOM 940 O ASN A 56 23.760 1.634 6.359 1.00 0.00 O ATOM 941 CB ASN A 56 25.374 4.291 5.955 1.00 0.00 C ATOM 942 CG ASN A 56 25.796 5.113 4.754 1.00 0.00 C ATOM 943 OD1 ASN A 56 25.163 5.064 3.700 1.00 0.00 O ATOM 944 ND2 ASN A 56 26.872 5.877 4.908 1.00 0.00 N ATOM 0 H ASN A 56 23.710 5.825 6.988 1.00 0.00 H new ATOM 0 HA ASN A 56 23.542 3.811 4.945 1.00 0.00 H new ATOM 0 HB2 ASN A 56 25.646 4.821 6.868 1.00 0.00 H new ATOM 0 HB3 ASN A 56 25.922 3.349 5.958 1.00 0.00 H new ATOM 0 HD21 ASN A 56 27.203 6.453 4.134 1.00 0.00 H new ATOM 0 HD22 ASN A 56 27.367 5.887 5.800 1.00 0.00 H new ATOM 951 N GLU A 57 23.145 2.990 8.050 1.00 0.00 N ATOM 952 CA GLU A 57 22.835 1.899 8.966 1.00 0.00 C ATOM 953 C GLU A 57 21.422 1.363 8.738 1.00 0.00 C ATOM 954 O GLU A 57 21.083 0.276 9.208 1.00 0.00 O ATOM 955 CB GLU A 57 22.986 2.367 10.415 1.00 0.00 C ATOM 956 CG GLU A 57 22.127 3.573 10.757 1.00 0.00 C ATOM 957 CD GLU A 57 21.562 3.507 12.162 1.00 0.00 C ATOM 958 OE1 GLU A 57 22.173 2.829 13.017 1.00 0.00 O ATOM 959 OE2 GLU A 57 20.509 4.132 12.410 1.00 0.00 O ATOM 0 H GLU A 57 22.995 3.921 8.439 1.00 0.00 H new ATOM 0 HA GLU A 57 23.540 1.091 8.771 1.00 0.00 H new ATOM 0 HB2 GLU A 57 22.726 1.545 11.082 1.00 0.00 H new ATOM 0 HB3 GLU A 57 24.032 2.611 10.602 1.00 0.00 H new ATOM 0 HG2 GLU A 57 22.722 4.480 10.651 1.00 0.00 H new ATOM 0 HG3 GLU A 57 21.307 3.645 10.043 1.00 0.00 H new ATOM 966 N LEU A 58 20.598 2.126 8.020 1.00 0.00 N ATOM 967 CA LEU A 58 19.228 1.707 7.741 1.00 0.00 C ATOM 968 C LEU A 58 19.175 0.766 6.545 1.00 0.00 C ATOM 969 O LEU A 58 18.204 0.028 6.375 1.00 0.00 O ATOM 970 CB LEU A 58 18.331 2.916 7.481 1.00 0.00 C ATOM 971 CG LEU A 58 17.651 3.507 8.721 1.00 0.00 C ATOM 972 CD1 LEU A 58 16.667 4.600 8.325 1.00 0.00 C ATOM 973 CD2 LEU A 58 16.945 2.417 9.515 1.00 0.00 C ATOM 0 H LEU A 58 20.854 3.031 7.624 1.00 0.00 H new ATOM 0 HA LEU A 58 18.863 1.177 8.621 1.00 0.00 H new ATOM 0 HB2 LEU A 58 18.928 3.696 7.008 1.00 0.00 H new ATOM 0 HB3 LEU A 58 17.560 2.628 6.767 1.00 0.00 H new ATOM 0 HG LEU A 58 18.420 3.950 9.353 1.00 0.00 H new ATOM 0 HD11 LEU A 58 16.195 5.006 9.220 1.00 0.00 H new ATOM 0 HD12 LEU A 58 17.198 5.395 7.802 1.00 0.00 H new ATOM 0 HD13 LEU A 58 15.903 4.182 7.670 1.00 0.00 H new ATOM 0 HD21 LEU A 58 16.468 2.856 10.391 1.00 0.00 H new ATOM 0 HD22 LEU A 58 16.188 1.943 8.889 1.00 0.00 H new ATOM 0 HD23 LEU A 58 17.672 1.670 9.833 1.00 0.00 H new ATOM 985 N LYS A 59 20.223 0.793 5.718 1.00 0.00 N ATOM 986 CA LYS A 59 20.293 -0.067 4.539 1.00 0.00 C ATOM 987 C LYS A 59 19.754 -1.463 4.852 1.00 0.00 C ATOM 988 O LYS A 59 18.868 -1.963 4.160 1.00 0.00 O ATOM 989 CB LYS A 59 21.735 -0.165 4.035 1.00 0.00 C ATOM 990 CG LYS A 59 21.852 -0.138 2.519 1.00 0.00 C ATOM 991 CD LYS A 59 22.640 -1.328 1.997 1.00 0.00 C ATOM 992 CE LYS A 59 24.092 -1.277 2.446 1.00 0.00 C ATOM 993 NZ LYS A 59 24.929 -2.282 1.734 1.00 0.00 N ATOM 0 H LYS A 59 21.032 1.401 5.845 1.00 0.00 H new ATOM 0 HA LYS A 59 19.674 0.377 3.759 1.00 0.00 H new ATOM 0 HB2 LYS A 59 22.313 0.660 4.451 1.00 0.00 H new ATOM 0 HB3 LYS A 59 22.180 -1.087 4.409 1.00 0.00 H new ATOM 0 HG2 LYS A 59 20.856 -0.138 2.077 1.00 0.00 H new ATOM 0 HG3 LYS A 59 22.339 0.786 2.208 1.00 0.00 H new ATOM 0 HD2 LYS A 59 22.182 -2.252 2.350 1.00 0.00 H new ATOM 0 HD3 LYS A 59 22.595 -1.345 0.908 1.00 0.00 H new ATOM 0 HE2 LYS A 59 24.492 -0.279 2.267 1.00 0.00 H new ATOM 0 HE3 LYS A 59 24.146 -1.455 3.520 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 25.912 -2.215 2.068 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 24.563 -3.237 1.925 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 24.898 -2.097 0.711 1.00 0.00 H new ATOM 1007 N PRO A 60 20.270 -2.106 5.917 1.00 0.00 N ATOM 1008 CA PRO A 60 19.816 -3.437 6.322 1.00 0.00 C ATOM 1009 C PRO A 60 18.426 -3.396 6.945 1.00 0.00 C ATOM 1010 O PRO A 60 17.678 -4.372 6.880 1.00 0.00 O ATOM 1011 CB PRO A 60 20.858 -3.871 7.353 1.00 0.00 C ATOM 1012 CG PRO A 60 21.375 -2.598 7.927 1.00 0.00 C ATOM 1013 CD PRO A 60 21.323 -1.584 6.816 1.00 0.00 C ATOM 0 HA PRO A 60 19.733 -4.121 5.477 1.00 0.00 H new ATOM 0 HB2 PRO A 60 20.414 -4.501 8.124 1.00 0.00 H new ATOM 0 HB3 PRO A 60 21.657 -4.450 6.889 1.00 0.00 H new ATOM 0 HG2 PRO A 60 20.768 -2.278 8.774 1.00 0.00 H new ATOM 0 HG3 PRO A 60 22.394 -2.722 8.293 1.00 0.00 H new ATOM 0 HD2 PRO A 60 21.074 -0.591 7.191 1.00 0.00 H new ATOM 0 HD3 PRO A 60 22.282 -1.500 6.304 1.00 0.00 H new ATOM 1021 N LYS A 61 18.079 -2.256 7.539 1.00 0.00 N ATOM 1022 CA LYS A 61 16.769 -2.095 8.158 1.00 0.00 C ATOM 1023 C LYS A 61 15.671 -2.186 7.108 1.00 0.00 C ATOM 1024 O LYS A 61 14.538 -2.551 7.414 1.00 0.00 O ATOM 1025 CB LYS A 61 16.672 -0.767 8.908 1.00 0.00 C ATOM 1026 CG LYS A 61 16.121 -0.915 10.320 1.00 0.00 C ATOM 1027 CD LYS A 61 17.019 -1.789 11.182 1.00 0.00 C ATOM 1028 CE LYS A 61 18.460 -1.303 11.163 1.00 0.00 C ATOM 1029 NZ LYS A 61 19.331 -2.108 12.064 1.00 0.00 N ATOM 0 H LYS A 61 18.683 -1.437 7.604 1.00 0.00 H new ATOM 0 HA LYS A 61 16.638 -2.902 8.879 1.00 0.00 H new ATOM 0 HB2 LYS A 61 17.661 -0.311 8.957 1.00 0.00 H new ATOM 0 HB3 LYS A 61 16.034 -0.085 8.346 1.00 0.00 H new ATOM 0 HG2 LYS A 61 16.022 0.069 10.778 1.00 0.00 H new ATOM 0 HG3 LYS A 61 15.122 -1.349 10.278 1.00 0.00 H new ATOM 0 HD2 LYS A 61 16.649 -1.792 12.207 1.00 0.00 H new ATOM 0 HD3 LYS A 61 16.977 -2.818 10.825 1.00 0.00 H new ATOM 0 HE2 LYS A 61 18.846 -1.353 10.145 1.00 0.00 H new ATOM 0 HE3 LYS A 61 18.494 -0.256 11.466 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 20.304 -1.744 12.022 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 18.978 -2.040 13.040 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 19.320 -3.103 11.760 1.00 0.00 H new ATOM 1043 N ILE A 62 16.012 -1.875 5.861 1.00 0.00 N ATOM 1044 CA ILE A 62 15.043 -1.957 4.778 1.00 0.00 C ATOM 1045 C ILE A 62 14.395 -3.339 4.802 1.00 0.00 C ATOM 1046 O ILE A 62 13.190 -3.487 4.580 1.00 0.00 O ATOM 1047 CB ILE A 62 15.711 -1.682 3.409 1.00 0.00 C ATOM 1048 CG1 ILE A 62 15.730 -0.178 3.128 1.00 0.00 C ATOM 1049 CG2 ILE A 62 14.998 -2.422 2.282 1.00 0.00 C ATOM 1050 CD1 ILE A 62 16.310 0.644 4.262 1.00 0.00 C ATOM 0 H ILE A 62 16.943 -1.567 5.579 1.00 0.00 H new ATOM 0 HA ILE A 62 14.278 -1.194 4.920 1.00 0.00 H new ATOM 0 HB ILE A 62 16.735 -2.052 3.453 1.00 0.00 H new ATOM 0 HG12 ILE A 62 16.309 0.007 2.223 1.00 0.00 H new ATOM 0 HG13 ILE A 62 14.713 0.159 2.930 1.00 0.00 H new ATOM 0 HG21 ILE A 62 15.493 -2.207 1.335 1.00 0.00 H new ATOM 0 HG22 ILE A 62 15.031 -3.495 2.473 1.00 0.00 H new ATOM 0 HG23 ILE A 62 13.960 -2.094 2.231 1.00 0.00 H new ATOM 0 HD11 ILE A 62 16.291 1.700 3.992 1.00 0.00 H new ATOM 0 HD12 ILE A 62 15.717 0.489 5.164 1.00 0.00 H new ATOM 0 HD13 ILE A 62 17.339 0.335 4.446 1.00 0.00 H new ATOM 1062 N ASP A 63 15.205 -4.342 5.131 1.00 0.00 N ATOM 1063 CA ASP A 63 14.721 -5.701 5.249 1.00 0.00 C ATOM 1064 C ASP A 63 13.771 -5.764 6.433 1.00 0.00 C ATOM 1065 O ASP A 63 12.722 -6.404 6.378 1.00 0.00 O ATOM 1066 CB ASP A 63 15.890 -6.671 5.441 1.00 0.00 C ATOM 1067 CG ASP A 63 15.930 -7.746 4.373 1.00 0.00 C ATOM 1068 OD1 ASP A 63 17.032 -8.261 4.092 1.00 0.00 O ATOM 1069 OD2 ASP A 63 14.860 -8.073 3.819 1.00 0.00 O ATOM 0 H ASP A 63 16.201 -4.231 5.320 1.00 0.00 H new ATOM 0 HA ASP A 63 14.198 -5.993 4.338 1.00 0.00 H new ATOM 0 HB2 ASP A 63 16.827 -6.114 5.427 1.00 0.00 H new ATOM 0 HB3 ASP A 63 15.812 -7.140 6.422 1.00 0.00 H new ATOM 1074 N GLU A 64 14.143 -5.052 7.498 1.00 0.00 N ATOM 1075 CA GLU A 64 13.324 -4.979 8.695 1.00 0.00 C ATOM 1076 C GLU A 64 11.975 -4.360 8.346 1.00 0.00 C ATOM 1077 O GLU A 64 10.930 -4.860 8.743 1.00 0.00 O ATOM 1078 CB GLU A 64 14.026 -4.158 9.782 1.00 0.00 C ATOM 1079 CG GLU A 64 15.107 -4.928 10.524 1.00 0.00 C ATOM 1080 CD GLU A 64 16.262 -5.333 9.627 1.00 0.00 C ATOM 1081 OE1 GLU A 64 16.061 -6.207 8.759 1.00 0.00 O ATOM 1082 OE2 GLU A 64 17.367 -4.777 9.796 1.00 0.00 O ATOM 0 H GLU A 64 15.011 -4.518 7.550 1.00 0.00 H new ATOM 0 HA GLU A 64 13.169 -5.986 9.083 1.00 0.00 H new ATOM 0 HB2 GLU A 64 14.470 -3.273 9.327 1.00 0.00 H new ATOM 0 HB3 GLU A 64 13.283 -3.809 10.499 1.00 0.00 H new ATOM 0 HG2 GLU A 64 15.486 -4.316 11.342 1.00 0.00 H new ATOM 0 HG3 GLU A 64 14.669 -5.821 10.970 1.00 0.00 H new ATOM 1089 N ILE A 65 12.014 -3.283 7.566 1.00 0.00 N ATOM 1090 CA ILE A 65 10.797 -2.608 7.124 1.00 0.00 C ATOM 1091 C ILE A 65 9.817 -3.611 6.535 1.00 0.00 C ATOM 1092 O ILE A 65 8.621 -3.551 6.802 1.00 0.00 O ATOM 1093 CB ILE A 65 11.115 -1.531 6.063 1.00 0.00 C ATOM 1094 CG1 ILE A 65 12.141 -0.530 6.603 1.00 0.00 C ATOM 1095 CG2 ILE A 65 9.846 -0.813 5.628 1.00 0.00 C ATOM 1096 CD1 ILE A 65 11.722 0.127 7.901 1.00 0.00 C ATOM 0 H ILE A 65 12.877 -2.858 7.226 1.00 0.00 H new ATOM 0 HA ILE A 65 10.351 -2.128 7.995 1.00 0.00 H new ATOM 0 HB ILE A 65 11.543 -2.026 5.192 1.00 0.00 H new ATOM 0 HG12 ILE A 65 13.091 -1.042 6.755 1.00 0.00 H new ATOM 0 HG13 ILE A 65 12.312 0.242 5.853 1.00 0.00 H new ATOM 0 HG21 ILE A 65 10.093 -0.059 4.881 1.00 0.00 H new ATOM 0 HG22 ILE A 65 9.149 -1.533 5.200 1.00 0.00 H new ATOM 0 HG23 ILE A 65 9.386 -0.332 6.491 1.00 0.00 H new ATOM 0 HD11 ILE A 65 12.497 0.823 8.223 1.00 0.00 H new ATOM 0 HD12 ILE A 65 10.788 0.668 7.750 1.00 0.00 H new ATOM 0 HD13 ILE A 65 11.579 -0.636 8.666 1.00 0.00 H new ATOM 1108 N SER A 66 10.329 -4.528 5.725 1.00 0.00 N ATOM 1109 CA SER A 66 9.484 -5.534 5.094 1.00 0.00 C ATOM 1110 C SER A 66 9.217 -6.728 6.012 1.00 0.00 C ATOM 1111 O SER A 66 8.068 -7.112 6.215 1.00 0.00 O ATOM 1112 CB SER A 66 10.120 -6.017 3.789 1.00 0.00 C ATOM 1113 OG SER A 66 9.133 -6.474 2.880 1.00 0.00 O ATOM 0 H SER A 66 11.319 -4.597 5.490 1.00 0.00 H new ATOM 0 HA SER A 66 8.525 -5.060 4.884 1.00 0.00 H new ATOM 0 HB2 SER A 66 10.689 -5.205 3.336 1.00 0.00 H new ATOM 0 HB3 SER A 66 10.825 -6.821 4.000 1.00 0.00 H new ATOM 0 HG SER A 66 9.298 -7.416 2.664 1.00 0.00 H new ATOM 1119 N LYS A 67 10.273 -7.326 6.546 1.00 0.00 N ATOM 1120 CA LYS A 67 10.126 -8.492 7.415 1.00 0.00 C ATOM 1121 C LYS A 67 9.447 -8.142 8.741 1.00 0.00 C ATOM 1122 O LYS A 67 8.850 -9.006 9.383 1.00 0.00 O ATOM 1123 CB LYS A 67 11.490 -9.131 7.679 1.00 0.00 C ATOM 1124 CG LYS A 67 12.459 -8.210 8.399 1.00 0.00 C ATOM 1125 CD LYS A 67 12.969 -8.831 9.691 1.00 0.00 C ATOM 1126 CE LYS A 67 14.175 -9.722 9.442 1.00 0.00 C ATOM 1127 NZ LYS A 67 13.777 -11.078 8.976 1.00 0.00 N ATOM 0 H LYS A 67 11.237 -7.027 6.396 1.00 0.00 H new ATOM 0 HA LYS A 67 9.484 -9.204 6.895 1.00 0.00 H new ATOM 0 HB2 LYS A 67 11.351 -10.035 8.272 1.00 0.00 H new ATOM 0 HB3 LYS A 67 11.929 -9.437 6.730 1.00 0.00 H new ATOM 0 HG2 LYS A 67 13.302 -7.985 7.745 1.00 0.00 H new ATOM 0 HG3 LYS A 67 11.966 -7.263 8.620 1.00 0.00 H new ATOM 0 HD2 LYS A 67 13.237 -8.042 10.394 1.00 0.00 H new ATOM 0 HD3 LYS A 67 12.173 -9.415 10.154 1.00 0.00 H new ATOM 0 HE2 LYS A 67 14.822 -9.258 8.697 1.00 0.00 H new ATOM 0 HE3 LYS A 67 14.757 -9.810 10.359 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 14.607 -11.704 8.980 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 13.050 -11.464 9.611 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 13.395 -11.015 8.011 1.00 0.00 H new ATOM 1141 N ARG A 68 9.548 -6.882 9.158 1.00 0.00 N ATOM 1142 CA ARG A 68 8.947 -6.450 10.419 1.00 0.00 C ATOM 1143 C ARG A 68 7.577 -5.815 10.216 1.00 0.00 C ATOM 1144 O ARG A 68 6.714 -5.908 11.089 1.00 0.00 O ATOM 1145 CB ARG A 68 9.867 -5.474 11.148 1.00 0.00 C ATOM 1146 CG ARG A 68 11.262 -6.028 11.373 1.00 0.00 C ATOM 1147 CD ARG A 68 12.087 -5.115 12.268 1.00 0.00 C ATOM 1148 NE ARG A 68 12.043 -5.534 13.667 1.00 0.00 N ATOM 1149 CZ ARG A 68 12.599 -4.849 14.664 1.00 0.00 C ATOM 1150 NH1 ARG A 68 13.235 -3.710 14.421 1.00 0.00 N ATOM 1151 NH2 ARG A 68 12.518 -5.304 15.907 1.00 0.00 N ATOM 0 H ARG A 68 10.036 -6.147 8.646 1.00 0.00 H new ATOM 0 HA ARG A 68 8.812 -7.344 11.028 1.00 0.00 H new ATOM 0 HB2 ARG A 68 9.937 -4.551 10.572 1.00 0.00 H new ATOM 0 HB3 ARG A 68 9.425 -5.217 12.110 1.00 0.00 H new ATOM 0 HG2 ARG A 68 11.193 -7.017 11.825 1.00 0.00 H new ATOM 0 HG3 ARG A 68 11.765 -6.150 10.414 1.00 0.00 H new ATOM 0 HD2 ARG A 68 13.121 -5.108 11.924 1.00 0.00 H new ATOM 0 HD3 ARG A 68 11.716 -4.093 12.184 1.00 0.00 H new ATOM 0 HE ARG A 68 11.558 -6.402 13.893 1.00 0.00 H new ATOM 0 HH11 ARG A 68 13.300 -3.355 13.467 1.00 0.00 H new ATOM 0 HH12 ARG A 68 13.659 -3.189 15.188 1.00 0.00 H new ATOM 0 HH21 ARG A 68 12.030 -6.179 16.099 1.00 0.00 H new ATOM 0 HH22 ARG A 68 12.944 -4.779 16.671 1.00 0.00 H new ATOM 1165 N PHE A 69 7.365 -5.174 9.069 1.00 0.00 N ATOM 1166 CA PHE A 69 6.079 -4.545 8.794 1.00 0.00 C ATOM 1167 C PHE A 69 5.225 -5.458 7.926 1.00 0.00 C ATOM 1168 O PHE A 69 4.006 -5.312 7.855 1.00 0.00 O ATOM 1169 CB PHE A 69 6.259 -3.164 8.147 1.00 0.00 C ATOM 1170 CG PHE A 69 7.138 -2.221 8.942 1.00 0.00 C ATOM 1171 CD1 PHE A 69 6.692 -0.948 9.263 1.00 0.00 C ATOM 1172 CD2 PHE A 69 8.403 -2.603 9.369 1.00 0.00 C ATOM 1173 CE1 PHE A 69 7.482 -0.080 9.992 1.00 0.00 C ATOM 1174 CE2 PHE A 69 9.197 -1.736 10.096 1.00 0.00 C ATOM 1175 CZ PHE A 69 8.735 -0.474 10.408 1.00 0.00 C ATOM 0 H PHE A 69 8.057 -5.078 8.326 1.00 0.00 H new ATOM 0 HA PHE A 69 5.562 -4.389 9.741 1.00 0.00 H new ATOM 0 HB2 PHE A 69 6.688 -3.293 7.153 1.00 0.00 H new ATOM 0 HB3 PHE A 69 5.279 -2.706 8.014 1.00 0.00 H new ATOM 0 HD1 PHE A 69 5.712 -0.630 8.938 1.00 0.00 H new ATOM 0 HD2 PHE A 69 8.771 -3.590 9.130 1.00 0.00 H new ATOM 0 HE1 PHE A 69 7.117 0.907 10.236 1.00 0.00 H new ATOM 0 HE2 PHE A 69 10.179 -2.047 10.420 1.00 0.00 H new ATOM 0 HZ PHE A 69 9.354 0.204 10.977 1.00 0.00 H new ATOM 1185 N PHE A 70 5.879 -6.446 7.324 1.00 0.00 N ATOM 1186 CA PHE A 70 5.202 -7.446 6.520 1.00 0.00 C ATOM 1187 C PHE A 70 5.544 -8.826 7.084 1.00 0.00 C ATOM 1188 O PHE A 70 5.916 -9.737 6.344 1.00 0.00 O ATOM 1189 CB PHE A 70 5.637 -7.347 5.053 1.00 0.00 C ATOM 1190 CG PHE A 70 4.603 -7.830 4.075 1.00 0.00 C ATOM 1191 CD1 PHE A 70 3.836 -8.952 4.348 1.00 0.00 C ATOM 1192 CD2 PHE A 70 4.404 -7.163 2.877 1.00 0.00 C ATOM 1193 CE1 PHE A 70 2.890 -9.398 3.445 1.00 0.00 C ATOM 1194 CE2 PHE A 70 3.459 -7.604 1.970 1.00 0.00 C ATOM 1195 CZ PHE A 70 2.702 -8.723 2.254 1.00 0.00 C ATOM 0 H PHE A 70 6.890 -6.572 7.382 1.00 0.00 H new ATOM 0 HA PHE A 70 4.125 -7.282 6.557 1.00 0.00 H new ATOM 0 HB2 PHE A 70 5.880 -6.309 4.826 1.00 0.00 H new ATOM 0 HB3 PHE A 70 6.550 -7.926 4.916 1.00 0.00 H new ATOM 0 HD1 PHE A 70 3.979 -9.484 5.277 1.00 0.00 H new ATOM 0 HD2 PHE A 70 4.994 -6.288 2.649 1.00 0.00 H new ATOM 0 HE1 PHE A 70 2.298 -10.273 3.670 1.00 0.00 H new ATOM 0 HE2 PHE A 70 3.313 -7.074 1.040 1.00 0.00 H new ATOM 0 HZ PHE A 70 1.964 -9.070 1.546 1.00 0.00 H new ATOM 1205 N PRO A 71 5.435 -8.988 8.426 1.00 0.00 N ATOM 1206 CA PRO A 71 5.745 -10.240 9.113 1.00 0.00 C ATOM 1207 C PRO A 71 5.301 -11.475 8.332 1.00 0.00 C ATOM 1208 O PRO A 71 4.207 -11.508 7.770 1.00 0.00 O ATOM 1209 CB PRO A 71 4.947 -10.108 10.407 1.00 0.00 C ATOM 1210 CG PRO A 71 4.969 -8.656 10.714 1.00 0.00 C ATOM 1211 CD PRO A 71 5.015 -7.944 9.389 1.00 0.00 C ATOM 0 HA PRO A 71 6.817 -10.381 9.253 1.00 0.00 H new ATOM 0 HB2 PRO A 71 3.927 -10.471 10.282 1.00 0.00 H new ATOM 0 HB3 PRO A 71 5.397 -10.690 11.211 1.00 0.00 H new ATOM 0 HG2 PRO A 71 4.085 -8.365 11.281 1.00 0.00 H new ATOM 0 HG3 PRO A 71 5.836 -8.401 11.323 1.00 0.00 H new ATOM 0 HD2 PRO A 71 4.042 -7.529 9.126 1.00 0.00 H new ATOM 0 HD3 PRO A 71 5.721 -7.114 9.408 1.00 0.00 H new ATOM 1219 N ALA A 72 6.159 -12.489 8.305 1.00 0.00 N ATOM 1220 CA ALA A 72 5.858 -13.727 7.597 1.00 0.00 C ATOM 1221 C ALA A 72 5.375 -14.804 8.561 1.00 0.00 C ATOM 1222 O ALA A 72 4.569 -15.661 8.199 1.00 0.00 O ATOM 1223 CB ALA A 72 7.082 -14.209 6.833 1.00 0.00 C ATOM 0 H ALA A 72 7.069 -12.478 8.766 1.00 0.00 H new ATOM 0 HA ALA A 72 5.057 -13.526 6.886 1.00 0.00 H new ATOM 0 HB1 ALA A 72 6.843 -15.134 6.309 1.00 0.00 H new ATOM 0 HB2 ALA A 72 7.382 -13.450 6.110 1.00 0.00 H new ATOM 0 HB3 ALA A 72 7.899 -14.388 7.531 1.00 0.00 H new ATOM 1229 N LYS A 73 5.872 -14.753 9.794 1.00 0.00 N ATOM 1230 CA LYS A 73 5.492 -15.723 10.813 1.00 0.00 C ATOM 1231 C LYS A 73 5.662 -15.138 12.211 1.00 0.00 C ATOM 1232 O LYS A 73 5.014 -15.648 13.149 1.00 0.00 O ATOM 1233 CB LYS A 73 6.330 -16.996 10.676 1.00 0.00 C ATOM 1234 CG LYS A 73 5.696 -18.215 11.327 1.00 0.00 C ATOM 1235 CD LYS A 73 6.699 -18.983 12.174 1.00 0.00 C ATOM 1236 CE LYS A 73 6.066 -19.508 13.454 1.00 0.00 C ATOM 1237 NZ LYS A 73 6.582 -18.800 14.658 1.00 0.00 N ATOM 1238 OXT LYS A 73 6.441 -14.173 12.356 1.00 0.00 O ATOM 0 H LYS A 73 6.539 -14.049 10.110 1.00 0.00 H new ATOM 0 HA LYS A 73 4.441 -15.971 10.667 1.00 0.00 H new ATOM 0 HB2 LYS A 73 6.492 -17.202 9.618 1.00 0.00 H new ATOM 0 HB3 LYS A 73 7.310 -16.825 11.121 1.00 0.00 H new ATOM 0 HG2 LYS A 73 4.858 -17.901 11.950 1.00 0.00 H new ATOM 0 HG3 LYS A 73 5.292 -18.871 10.556 1.00 0.00 H new ATOM 0 HD2 LYS A 73 7.100 -19.817 11.597 1.00 0.00 H new ATOM 0 HD3 LYS A 73 7.539 -18.334 12.422 1.00 0.00 H new ATOM 0 HE2 LYS A 73 4.984 -19.390 13.399 1.00 0.00 H new ATOM 0 HE3 LYS A 73 6.266 -20.576 13.547 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 6.127 -19.186 15.510 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 7.611 -18.934 14.725 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 6.369 -17.785 14.582 1.00 0.00 H new TER 1252 LYS A 73 ATOM 1253 N MET B 1 3.847 -22.016 0.202 1.00 0.00 N ATOM 1254 CA MET B 1 3.837 -21.222 -1.055 1.00 0.00 C ATOM 1255 C MET B 1 3.208 -19.850 -0.834 1.00 0.00 C ATOM 1256 O MET B 1 2.538 -19.618 0.172 1.00 0.00 O ATOM 1257 CB MET B 1 3.055 -21.998 -2.116 1.00 0.00 C ATOM 1258 CG MET B 1 1.587 -22.193 -1.769 1.00 0.00 C ATOM 1259 SD MET B 1 0.943 -23.776 -2.344 1.00 0.00 S ATOM 1260 CE MET B 1 -0.090 -23.247 -3.708 1.00 0.00 C ATOM 0 H1 MET B 1 3.987 -23.022 -0.024 1.00 0.00 H new ATOM 0 H2 MET B 1 4.621 -21.687 0.814 1.00 0.00 H new ATOM 0 H3 MET B 1 2.940 -21.895 0.696 1.00 0.00 H new ATOM 0 HA MET B 1 4.863 -21.063 -1.387 1.00 0.00 H new ATOM 0 HB2 MET B 1 3.128 -21.471 -3.067 1.00 0.00 H new ATOM 0 HB3 MET B 1 3.519 -22.974 -2.256 1.00 0.00 H new ATOM 0 HG2 MET B 1 1.461 -22.124 -0.689 1.00 0.00 H new ATOM 0 HG3 MET B 1 1.003 -21.385 -2.210 1.00 0.00 H new ATOM 0 HE1 MET B 1 -0.227 -24.075 -4.403 1.00 0.00 H new ATOM 0 HE2 MET B 1 -1.061 -22.929 -3.327 1.00 0.00 H new ATOM 0 HE3 MET B 1 0.388 -22.415 -4.225 1.00 0.00 H new ATOM 1272 N VAL B 2 3.429 -18.944 -1.781 1.00 0.00 N ATOM 1273 CA VAL B 2 2.883 -17.594 -1.691 1.00 0.00 C ATOM 1274 C VAL B 2 1.634 -17.447 -2.554 1.00 0.00 C ATOM 1275 O VAL B 2 1.466 -16.449 -3.257 1.00 0.00 O ATOM 1276 CB VAL B 2 3.922 -16.541 -2.119 1.00 0.00 C ATOM 1277 CG1 VAL B 2 4.980 -16.363 -1.041 1.00 0.00 C ATOM 1278 CG2 VAL B 2 4.560 -16.928 -3.445 1.00 0.00 C ATOM 0 H VAL B 2 3.982 -19.120 -2.620 1.00 0.00 H new ATOM 0 HA VAL B 2 2.618 -17.427 -0.647 1.00 0.00 H new ATOM 0 HB VAL B 2 3.411 -15.588 -2.253 1.00 0.00 H new ATOM 0 HG11 VAL B 2 5.705 -15.615 -1.362 1.00 0.00 H new ATOM 0 HG12 VAL B 2 4.506 -16.035 -0.116 1.00 0.00 H new ATOM 0 HG13 VAL B 2 5.489 -17.312 -0.871 1.00 0.00 H new ATOM 0 HG21 VAL B 2 5.291 -16.172 -3.731 1.00 0.00 H new ATOM 0 HG22 VAL B 2 5.057 -17.893 -3.342 1.00 0.00 H new ATOM 0 HG23 VAL B 2 3.790 -16.997 -4.213 1.00 0.00 H new ATOM 1288 N GLU B 3 0.759 -18.445 -2.496 1.00 0.00 N ATOM 1289 CA GLU B 3 -0.475 -18.425 -3.272 1.00 0.00 C ATOM 1290 C GLU B 3 -1.555 -19.268 -2.601 1.00 0.00 C ATOM 1291 O GLU B 3 -1.481 -20.496 -2.589 1.00 0.00 O ATOM 1292 CB GLU B 3 -0.220 -18.937 -4.691 1.00 0.00 C ATOM 1293 CG GLU B 3 -0.995 -18.185 -5.759 1.00 0.00 C ATOM 1294 CD GLU B 3 -0.985 -18.895 -7.098 1.00 0.00 C ATOM 1295 OE1 GLU B 3 -1.942 -19.650 -7.377 1.00 0.00 O ATOM 1296 OE2 GLU B 3 -0.022 -18.698 -7.868 1.00 0.00 O ATOM 0 H GLU B 3 0.882 -19.278 -1.920 1.00 0.00 H new ATOM 0 HA GLU B 3 -0.824 -17.394 -3.323 1.00 0.00 H new ATOM 0 HB2 GLU B 3 0.846 -18.864 -4.908 1.00 0.00 H new ATOM 0 HB3 GLU B 3 -0.483 -19.994 -4.739 1.00 0.00 H new ATOM 0 HG2 GLU B 3 -2.026 -18.054 -5.430 1.00 0.00 H new ATOM 0 HG3 GLU B 3 -0.569 -17.189 -5.877 1.00 0.00 H new ATOM 1303 N SER B 4 -2.560 -18.598 -2.043 1.00 0.00 N ATOM 1304 CA SER B 4 -3.657 -19.284 -1.369 1.00 0.00 C ATOM 1305 C SER B 4 -3.149 -20.070 -0.165 1.00 0.00 C ATOM 1306 O SER B 4 -1.964 -20.026 0.164 1.00 0.00 O ATOM 1307 CB SER B 4 -4.374 -20.223 -2.341 1.00 0.00 C ATOM 1308 OG SER B 4 -5.756 -20.311 -2.040 1.00 0.00 O ATOM 0 H SER B 4 -2.637 -17.581 -2.045 1.00 0.00 H new ATOM 0 HA SER B 4 -4.362 -18.531 -1.017 1.00 0.00 H new ATOM 0 HB2 SER B 4 -4.243 -19.864 -3.362 1.00 0.00 H new ATOM 0 HB3 SER B 4 -3.924 -21.215 -2.292 1.00 0.00 H new ATOM 0 HG SER B 4 -6.192 -20.916 -2.676 1.00 0.00 H new ATOM 1314 N LYS B 5 -4.057 -20.790 0.489 1.00 0.00 N ATOM 1315 CA LYS B 5 -3.708 -21.589 1.659 1.00 0.00 C ATOM 1316 C LYS B 5 -3.200 -20.706 2.796 1.00 0.00 C ATOM 1317 O LYS B 5 -3.942 -20.390 3.726 1.00 0.00 O ATOM 1318 CB LYS B 5 -2.653 -22.637 1.295 1.00 0.00 C ATOM 1319 CG LYS B 5 -3.187 -23.764 0.425 1.00 0.00 C ATOM 1320 CD LYS B 5 -2.540 -25.095 0.774 1.00 0.00 C ATOM 1321 CE LYS B 5 -3.579 -26.187 0.979 1.00 0.00 C ATOM 1322 NZ LYS B 5 -3.208 -27.445 0.275 1.00 0.00 N ATOM 0 H LYS B 5 -5.042 -20.836 0.227 1.00 0.00 H new ATOM 0 HA LYS B 5 -4.610 -22.098 1.999 1.00 0.00 H new ATOM 0 HB2 LYS B 5 -1.831 -22.146 0.775 1.00 0.00 H new ATOM 0 HB3 LYS B 5 -2.243 -23.061 2.212 1.00 0.00 H new ATOM 0 HG2 LYS B 5 -4.267 -23.840 0.550 1.00 0.00 H new ATOM 0 HG3 LYS B 5 -3.003 -23.533 -0.624 1.00 0.00 H new ATOM 0 HD2 LYS B 5 -1.856 -25.388 -0.023 1.00 0.00 H new ATOM 0 HD3 LYS B 5 -1.945 -24.984 1.680 1.00 0.00 H new ATOM 0 HE2 LYS B 5 -3.690 -26.387 2.045 1.00 0.00 H new ATOM 0 HE3 LYS B 5 -4.547 -25.840 0.617 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 -3.941 -28.164 0.439 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 -3.126 -27.261 -0.745 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 -2.297 -27.790 0.638 1.00 0.00 H new ATOM 1336 N LYS B 6 -1.934 -20.310 2.716 1.00 0.00 N ATOM 1337 CA LYS B 6 -1.332 -19.464 3.740 1.00 0.00 C ATOM 1338 C LYS B 6 -1.244 -18.016 3.267 1.00 0.00 C ATOM 1339 O LYS B 6 -1.853 -17.122 3.856 1.00 0.00 O ATOM 1340 CB LYS B 6 0.063 -19.977 4.105 1.00 0.00 C ATOM 1341 CG LYS B 6 0.136 -21.489 4.259 1.00 0.00 C ATOM 1342 CD LYS B 6 1.153 -22.101 3.307 1.00 0.00 C ATOM 1343 CE LYS B 6 2.560 -21.610 3.604 1.00 0.00 C ATOM 1344 NZ LYS B 6 2.918 -20.421 2.783 1.00 0.00 N ATOM 0 H LYS B 6 -1.305 -20.561 1.953 1.00 0.00 H new ATOM 0 HA LYS B 6 -1.968 -19.503 4.624 1.00 0.00 H new ATOM 0 HB2 LYS B 6 0.769 -19.664 3.335 1.00 0.00 H new ATOM 0 HB3 LYS B 6 0.380 -19.510 5.037 1.00 0.00 H new ATOM 0 HG2 LYS B 6 0.403 -21.738 5.286 1.00 0.00 H new ATOM 0 HG3 LYS B 6 -0.846 -21.922 4.071 1.00 0.00 H new ATOM 0 HD2 LYS B 6 1.121 -23.188 3.388 1.00 0.00 H new ATOM 0 HD3 LYS B 6 0.888 -21.850 2.280 1.00 0.00 H new ATOM 0 HE2 LYS B 6 2.641 -21.359 4.662 1.00 0.00 H new ATOM 0 HE3 LYS B 6 3.273 -22.412 3.411 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 3.941 -20.424 2.595 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 2.400 -20.453 1.882 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 2.664 -19.554 3.298 1.00 0.00 H new ATOM 1358 N ILE B 7 -0.484 -17.793 2.200 1.00 0.00 N ATOM 1359 CA ILE B 7 -0.316 -16.454 1.646 1.00 0.00 C ATOM 1360 C ILE B 7 -0.824 -16.389 0.211 1.00 0.00 C ATOM 1361 O ILE B 7 -0.885 -17.404 -0.482 1.00 0.00 O ATOM 1362 CB ILE B 7 1.161 -16.011 1.676 1.00 0.00 C ATOM 1363 CG1 ILE B 7 1.810 -16.392 3.008 1.00 0.00 C ATOM 1364 CG2 ILE B 7 1.269 -14.512 1.442 1.00 0.00 C ATOM 1365 CD1 ILE B 7 3.312 -16.208 3.021 1.00 0.00 C ATOM 0 H ILE B 7 0.026 -18.522 1.701 1.00 0.00 H new ATOM 0 HA ILE B 7 -0.901 -15.778 2.270 1.00 0.00 H new ATOM 0 HB ILE B 7 1.692 -16.527 0.876 1.00 0.00 H new ATOM 0 HG12 ILE B 7 1.371 -15.789 3.803 1.00 0.00 H new ATOM 0 HG13 ILE B 7 1.577 -17.433 3.232 1.00 0.00 H new ATOM 0 HG21 ILE B 7 2.317 -14.215 1.466 1.00 0.00 H new ATOM 0 HG22 ILE B 7 0.844 -14.264 0.470 1.00 0.00 H new ATOM 0 HG23 ILE B 7 0.723 -13.982 2.223 1.00 0.00 H new ATOM 0 HD11 ILE B 7 3.706 -16.497 3.996 1.00 0.00 H new ATOM 0 HD12 ILE B 7 3.762 -16.832 2.249 1.00 0.00 H new ATOM 0 HD13 ILE B 7 3.552 -15.162 2.828 1.00 0.00 H new ATOM 1377 N ALA B 8 -1.189 -15.189 -0.231 1.00 0.00 N ATOM 1378 CA ALA B 8 -1.696 -14.996 -1.585 1.00 0.00 C ATOM 1379 C ALA B 8 -1.336 -13.612 -2.118 1.00 0.00 C ATOM 1380 O ALA B 8 -0.719 -12.807 -1.421 1.00 0.00 O ATOM 1381 CB ALA B 8 -3.202 -15.200 -1.617 1.00 0.00 C ATOM 0 H ALA B 8 -1.143 -14.337 0.328 1.00 0.00 H new ATOM 0 HA ALA B 8 -1.225 -15.737 -2.231 1.00 0.00 H new ATOM 0 HB1 ALA B 8 -3.568 -15.053 -2.633 1.00 0.00 H new ATOM 0 HB2 ALA B 8 -3.439 -16.212 -1.289 1.00 0.00 H new ATOM 0 HB3 ALA B 8 -3.681 -14.481 -0.952 1.00 0.00 H new ATOM 1387 N LYS B 9 -1.728 -13.346 -3.361 1.00 0.00 N ATOM 1388 CA LYS B 9 -1.452 -12.062 -3.998 1.00 0.00 C ATOM 1389 C LYS B 9 -2.287 -11.905 -5.266 1.00 0.00 C ATOM 1390 O LYS B 9 -2.586 -12.885 -5.948 1.00 0.00 O ATOM 1391 CB LYS B 9 0.039 -11.951 -4.330 1.00 0.00 C ATOM 1392 CG LYS B 9 0.794 -10.992 -3.422 1.00 0.00 C ATOM 1393 CD LYS B 9 2.158 -11.536 -3.025 1.00 0.00 C ATOM 1394 CE LYS B 9 2.045 -12.805 -2.197 1.00 0.00 C ATOM 1395 NZ LYS B 9 2.084 -12.518 -0.736 1.00 0.00 N ATOM 0 H LYS B 9 -2.239 -14.005 -3.948 1.00 0.00 H new ATOM 0 HA LYS B 9 -1.721 -11.264 -3.306 1.00 0.00 H new ATOM 0 HB2 LYS B 9 0.493 -12.939 -4.259 1.00 0.00 H new ATOM 0 HB3 LYS B 9 0.149 -11.623 -5.364 1.00 0.00 H new ATOM 0 HG2 LYS B 9 0.919 -10.035 -3.929 1.00 0.00 H new ATOM 0 HG3 LYS B 9 0.204 -10.802 -2.525 1.00 0.00 H new ATOM 0 HD2 LYS B 9 2.743 -11.739 -3.922 1.00 0.00 H new ATOM 0 HD3 LYS B 9 2.699 -10.779 -2.457 1.00 0.00 H new ATOM 0 HE2 LYS B 9 1.115 -13.317 -2.442 1.00 0.00 H new ATOM 0 HE3 LYS B 9 2.859 -13.482 -2.456 1.00 0.00 H new ATOM 0 HZ1 LYS B 9 2.652 -13.244 -0.255 1.00 0.00 H new ATOM 0 HZ2 LYS B 9 2.510 -11.583 -0.577 1.00 0.00 H new ATOM 0 HZ3 LYS B 9 1.117 -12.527 -0.355 1.00 0.00 H new ATOM 1409 N LYS B 10 -2.676 -10.670 -5.570 1.00 0.00 N ATOM 1410 CA LYS B 10 -3.492 -10.394 -6.750 1.00 0.00 C ATOM 1411 C LYS B 10 -2.865 -9.299 -7.612 1.00 0.00 C ATOM 1412 O LYS B 10 -2.304 -8.342 -7.093 1.00 0.00 O ATOM 1413 CB LYS B 10 -4.887 -9.957 -6.308 1.00 0.00 C ATOM 1414 CG LYS B 10 -5.691 -11.050 -5.624 1.00 0.00 C ATOM 1415 CD LYS B 10 -6.499 -10.498 -4.458 1.00 0.00 C ATOM 1416 CE LYS B 10 -7.874 -11.142 -4.377 1.00 0.00 C ATOM 1417 NZ LYS B 10 -8.860 -10.263 -3.690 1.00 0.00 N ATOM 0 H LYS B 10 -2.440 -9.846 -5.017 1.00 0.00 H new ATOM 0 HA LYS B 10 -3.554 -11.304 -7.346 1.00 0.00 H new ATOM 0 HB2 LYS B 10 -4.793 -9.110 -5.628 1.00 0.00 H new ATOM 0 HB3 LYS B 10 -5.439 -9.606 -7.180 1.00 0.00 H new ATOM 0 HG2 LYS B 10 -6.362 -11.516 -6.346 1.00 0.00 H new ATOM 0 HG3 LYS B 10 -5.018 -11.829 -5.266 1.00 0.00 H new ATOM 0 HD2 LYS B 10 -5.960 -10.671 -3.527 1.00 0.00 H new ATOM 0 HD3 LYS B 10 -6.608 -9.419 -4.568 1.00 0.00 H new ATOM 0 HE2 LYS B 10 -8.228 -11.368 -5.383 1.00 0.00 H new ATOM 0 HE3 LYS B 10 -7.800 -12.090 -3.844 1.00 0.00 H new ATOM 0 HZ1 LYS B 10 -9.784 -10.739 -3.656 1.00 0.00 H new ATOM 0 HZ2 LYS B 10 -8.535 -10.067 -2.722 1.00 0.00 H new ATOM 0 HZ3 LYS B 10 -8.950 -9.368 -4.212 1.00 0.00 H new ATOM 1431 N LYS B 11 -2.972 -9.423 -8.931 1.00 0.00 N ATOM 1432 CA LYS B 11 -2.413 -8.404 -9.812 1.00 0.00 C ATOM 1433 C LYS B 11 -3.178 -7.097 -9.637 1.00 0.00 C ATOM 1434 O LYS B 11 -4.325 -6.974 -10.068 1.00 0.00 O ATOM 1435 CB LYS B 11 -2.459 -8.848 -11.276 1.00 0.00 C ATOM 1436 CG LYS B 11 -1.798 -10.195 -11.524 1.00 0.00 C ATOM 1437 CD LYS B 11 -2.793 -11.340 -11.403 1.00 0.00 C ATOM 1438 CE LYS B 11 -2.419 -12.294 -10.279 1.00 0.00 C ATOM 1439 NZ LYS B 11 -2.498 -13.717 -10.710 1.00 0.00 N ATOM 0 H LYS B 11 -3.430 -10.201 -9.406 1.00 0.00 H new ATOM 0 HA LYS B 11 -1.368 -8.254 -9.541 1.00 0.00 H new ATOM 0 HB2 LYS B 11 -3.499 -8.898 -11.600 1.00 0.00 H new ATOM 0 HB3 LYS B 11 -1.969 -8.093 -11.892 1.00 0.00 H new ATOM 0 HG2 LYS B 11 -1.352 -10.204 -12.518 1.00 0.00 H new ATOM 0 HG3 LYS B 11 -0.988 -10.340 -10.810 1.00 0.00 H new ATOM 0 HD2 LYS B 11 -3.790 -10.938 -11.223 1.00 0.00 H new ATOM 0 HD3 LYS B 11 -2.835 -11.886 -12.345 1.00 0.00 H new ATOM 0 HE2 LYS B 11 -1.408 -12.074 -9.937 1.00 0.00 H new ATOM 0 HE3 LYS B 11 -3.084 -12.134 -9.430 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 -2.236 -14.335 -9.916 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 -3.469 -13.935 -11.012 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 -1.844 -13.876 -11.503 1.00 0.00 H new ATOM 1453 N THR B 12 -2.538 -6.130 -8.991 1.00 0.00 N ATOM 1454 CA THR B 12 -3.159 -4.836 -8.745 1.00 0.00 C ATOM 1455 C THR B 12 -2.558 -3.762 -9.642 1.00 0.00 C ATOM 1456 O THR B 12 -1.378 -3.821 -9.984 1.00 0.00 O ATOM 1457 CB THR B 12 -2.999 -4.440 -7.277 1.00 0.00 C ATOM 1458 OG1 THR B 12 -3.223 -5.552 -6.430 1.00 0.00 O ATOM 1459 CG2 THR B 12 -3.943 -3.338 -6.849 1.00 0.00 C ATOM 0 H THR B 12 -1.589 -6.218 -8.628 1.00 0.00 H new ATOM 0 HA THR B 12 -4.221 -4.923 -8.977 1.00 0.00 H new ATOM 0 HB THR B 12 -1.976 -4.075 -7.186 1.00 0.00 H new ATOM 0 HG1 THR B 12 -3.805 -5.286 -5.688 1.00 0.00 H new ATOM 0 HG21 THR B 12 -3.777 -3.105 -5.797 1.00 0.00 H new ATOM 0 HG22 THR B 12 -3.760 -2.448 -7.451 1.00 0.00 H new ATOM 0 HG23 THR B 12 -4.973 -3.666 -6.990 1.00 0.00 H new ATOM 1467 N THR B 13 -3.372 -2.783 -10.024 1.00 0.00 N ATOM 1468 CA THR B 13 -2.903 -1.705 -10.887 1.00 0.00 C ATOM 1469 C THR B 13 -3.075 -0.339 -10.234 1.00 0.00 C ATOM 1470 O THR B 13 -4.035 -0.095 -9.503 1.00 0.00 O ATOM 1471 CB THR B 13 -3.640 -1.717 -12.226 1.00 0.00 C ATOM 1472 OG1 THR B 13 -4.065 -3.026 -12.557 1.00 0.00 O ATOM 1473 CG2 THR B 13 -2.796 -1.199 -13.368 1.00 0.00 C ATOM 0 H THR B 13 -4.353 -2.714 -9.752 1.00 0.00 H new ATOM 0 HA THR B 13 -1.840 -1.878 -11.054 1.00 0.00 H new ATOM 0 HB THR B 13 -4.495 -1.054 -12.095 1.00 0.00 H new ATOM 0 HG1 THR B 13 -4.536 -3.010 -13.416 1.00 0.00 H new ATOM 0 HG21 THR B 13 -3.374 -1.232 -14.292 1.00 0.00 H new ATOM 0 HG22 THR B 13 -2.498 -0.171 -13.163 1.00 0.00 H new ATOM 0 HG23 THR B 13 -1.907 -1.820 -13.474 1.00 0.00 H new ATOM 1481 N LEU B 14 -2.138 0.550 -10.532 1.00 0.00 N ATOM 1482 CA LEU B 14 -2.156 1.910 -10.018 1.00 0.00 C ATOM 1483 C LEU B 14 -1.741 2.864 -11.127 1.00 0.00 C ATOM 1484 O LEU B 14 -0.744 2.632 -11.804 1.00 0.00 O ATOM 1485 CB LEU B 14 -1.207 2.064 -8.827 1.00 0.00 C ATOM 1486 CG LEU B 14 -1.013 0.812 -7.971 1.00 0.00 C ATOM 1487 CD1 LEU B 14 0.382 0.804 -7.371 1.00 0.00 C ATOM 1488 CD2 LEU B 14 -2.070 0.738 -6.878 1.00 0.00 C ATOM 0 H LEU B 14 -1.343 0.347 -11.138 1.00 0.00 H new ATOM 0 HA LEU B 14 -3.166 2.141 -9.678 1.00 0.00 H new ATOM 0 HB2 LEU B 14 -0.233 2.382 -9.200 1.00 0.00 H new ATOM 0 HB3 LEU B 14 -1.581 2.865 -8.189 1.00 0.00 H new ATOM 0 HG LEU B 14 -1.125 -0.067 -8.606 1.00 0.00 H new ATOM 0 HD11 LEU B 14 0.511 -0.091 -6.763 1.00 0.00 H new ATOM 0 HD12 LEU B 14 1.122 0.809 -8.171 1.00 0.00 H new ATOM 0 HD13 LEU B 14 0.515 1.688 -6.748 1.00 0.00 H new ATOM 0 HD21 LEU B 14 -1.914 -0.160 -6.281 1.00 0.00 H new ATOM 0 HD22 LEU B 14 -1.994 1.617 -6.238 1.00 0.00 H new ATOM 0 HD23 LEU B 14 -3.061 0.704 -7.332 1.00 0.00 H new ATOM 1500 N ALA B 15 -2.507 3.924 -11.328 1.00 0.00 N ATOM 1501 CA ALA B 15 -2.194 4.873 -12.384 1.00 0.00 C ATOM 1502 C ALA B 15 -1.225 5.946 -11.903 1.00 0.00 C ATOM 1503 O ALA B 15 -1.631 7.009 -11.439 1.00 0.00 O ATOM 1504 CB ALA B 15 -3.469 5.505 -12.920 1.00 0.00 C ATOM 0 H ALA B 15 -3.339 4.147 -10.782 1.00 0.00 H new ATOM 0 HA ALA B 15 -1.705 4.327 -13.191 1.00 0.00 H new ATOM 0 HB1 ALA B 15 -3.220 6.213 -13.710 1.00 0.00 H new ATOM 0 HB2 ALA B 15 -4.119 4.728 -13.321 1.00 0.00 H new ATOM 0 HB3 ALA B 15 -3.983 6.027 -12.113 1.00 0.00 H new ATOM 1510 N PHE B 16 0.060 5.644 -12.051 1.00 0.00 N ATOM 1511 CA PHE B 16 1.146 6.540 -11.669 1.00 0.00 C ATOM 1512 C PHE B 16 2.447 5.958 -12.166 1.00 0.00 C ATOM 1513 O PHE B 16 2.477 4.857 -12.693 1.00 0.00 O ATOM 1514 CB PHE B 16 1.233 6.743 -10.151 1.00 0.00 C ATOM 1515 CG PHE B 16 0.046 7.440 -9.553 1.00 0.00 C ATOM 1516 CD1 PHE B 16 -0.902 6.730 -8.834 1.00 0.00 C ATOM 1517 CD2 PHE B 16 -0.122 8.807 -9.711 1.00 0.00 C ATOM 1518 CE1 PHE B 16 -1.997 7.369 -8.283 1.00 0.00 C ATOM 1519 CE2 PHE B 16 -1.215 9.452 -9.163 1.00 0.00 C ATOM 1520 CZ PHE B 16 -2.153 8.732 -8.448 1.00 0.00 C ATOM 0 H PHE B 16 0.381 4.759 -12.444 1.00 0.00 H new ATOM 0 HA PHE B 16 0.950 7.514 -12.117 1.00 0.00 H new ATOM 0 HB2 PHE B 16 1.348 5.771 -9.672 1.00 0.00 H new ATOM 0 HB3 PHE B 16 2.130 7.319 -9.924 1.00 0.00 H new ATOM 0 HD1 PHE B 16 -0.784 5.665 -8.702 1.00 0.00 H new ATOM 0 HD2 PHE B 16 0.609 9.374 -10.268 1.00 0.00 H new ATOM 0 HE1 PHE B 16 -2.729 6.804 -7.725 1.00 0.00 H new ATOM 0 HE2 PHE B 16 -1.336 10.517 -9.294 1.00 0.00 H new ATOM 0 HZ PHE B 16 -3.007 9.234 -8.019 1.00 0.00 H new ATOM 1530 N ASP B 17 3.514 6.701 -12.010 1.00 0.00 N ATOM 1531 CA ASP B 17 4.824 6.259 -12.449 1.00 0.00 C ATOM 1532 C ASP B 17 5.729 7.447 -12.561 1.00 0.00 C ATOM 1533 O ASP B 17 6.917 7.372 -12.267 1.00 0.00 O ATOM 1534 CB ASP B 17 4.757 5.541 -13.794 1.00 0.00 C ATOM 1535 CG ASP B 17 4.869 4.035 -13.660 1.00 0.00 C ATOM 1536 OD1 ASP B 17 4.907 3.541 -12.512 1.00 0.00 O ATOM 1537 OD2 ASP B 17 4.920 3.348 -14.701 1.00 0.00 O ATOM 0 H ASP B 17 3.505 7.625 -11.578 1.00 0.00 H new ATOM 0 HA ASP B 17 5.210 5.553 -11.714 1.00 0.00 H new ATOM 0 HB2 ASP B 17 3.817 5.789 -14.287 1.00 0.00 H new ATOM 0 HB3 ASP B 17 5.559 5.905 -14.436 1.00 0.00 H new ATOM 1542 N GLU B 18 5.164 8.561 -12.973 1.00 0.00 N ATOM 1543 CA GLU B 18 5.957 9.759 -13.098 1.00 0.00 C ATOM 1544 C GLU B 18 6.808 9.932 -11.842 1.00 0.00 C ATOM 1545 O GLU B 18 8.040 9.861 -11.886 1.00 0.00 O ATOM 1546 CB GLU B 18 5.068 10.988 -13.307 1.00 0.00 C ATOM 1547 CG GLU B 18 5.841 12.297 -13.381 1.00 0.00 C ATOM 1548 CD GLU B 18 5.082 13.456 -12.764 1.00 0.00 C ATOM 1549 OE1 GLU B 18 4.415 13.245 -11.729 1.00 0.00 O ATOM 1550 OE2 GLU B 18 5.157 14.574 -13.315 1.00 0.00 O ATOM 0 H GLU B 18 4.180 8.660 -13.222 1.00 0.00 H new ATOM 0 HA GLU B 18 6.604 9.663 -13.970 1.00 0.00 H new ATOM 0 HB2 GLU B 18 4.498 10.861 -14.227 1.00 0.00 H new ATOM 0 HB3 GLU B 18 4.348 11.047 -12.491 1.00 0.00 H new ATOM 0 HG2 GLU B 18 6.797 12.180 -12.870 1.00 0.00 H new ATOM 0 HG3 GLU B 18 6.062 12.526 -14.423 1.00 0.00 H new ATOM 1557 N ASP B 19 6.129 10.117 -10.714 1.00 0.00 N ATOM 1558 CA ASP B 19 6.809 10.281 -9.436 1.00 0.00 C ATOM 1559 C ASP B 19 7.121 8.939 -8.789 1.00 0.00 C ATOM 1560 O ASP B 19 8.244 8.708 -8.344 1.00 0.00 O ATOM 1561 CB ASP B 19 5.964 11.135 -8.489 1.00 0.00 C ATOM 1562 CG ASP B 19 6.274 12.614 -8.612 1.00 0.00 C ATOM 1563 OD1 ASP B 19 5.954 13.368 -7.669 1.00 0.00 O ATOM 1564 OD2 ASP B 19 6.838 13.018 -9.650 1.00 0.00 O ATOM 0 H ASP B 19 5.111 10.157 -10.660 1.00 0.00 H new ATOM 0 HA ASP B 19 7.755 10.787 -9.630 1.00 0.00 H new ATOM 0 HB2 ASP B 19 4.908 10.969 -8.700 1.00 0.00 H new ATOM 0 HB3 ASP B 19 6.138 10.814 -7.462 1.00 0.00 H new ATOM 1569 N VAL B 20 6.130 8.057 -8.722 1.00 0.00 N ATOM 1570 CA VAL B 20 6.337 6.753 -8.111 1.00 0.00 C ATOM 1571 C VAL B 20 7.423 5.967 -8.844 1.00 0.00 C ATOM 1572 O VAL B 20 8.267 5.344 -8.210 1.00 0.00 O ATOM 1573 CB VAL B 20 5.034 5.925 -8.034 1.00 0.00 C ATOM 1574 CG1 VAL B 20 3.915 6.753 -7.422 1.00 0.00 C ATOM 1575 CG2 VAL B 20 4.626 5.411 -9.402 1.00 0.00 C ATOM 0 H VAL B 20 5.188 8.219 -9.078 1.00 0.00 H new ATOM 0 HA VAL B 20 6.667 6.938 -7.089 1.00 0.00 H new ATOM 0 HB VAL B 20 5.222 5.062 -7.395 1.00 0.00 H new ATOM 0 HG11 VAL B 20 3.004 6.156 -7.375 1.00 0.00 H new ATOM 0 HG12 VAL B 20 4.199 7.062 -6.416 1.00 0.00 H new ATOM 0 HG13 VAL B 20 3.738 7.636 -8.036 1.00 0.00 H new ATOM 0 HG21 VAL B 20 3.706 4.833 -9.314 1.00 0.00 H new ATOM 0 HG22 VAL B 20 4.462 6.254 -10.073 1.00 0.00 H new ATOM 0 HG23 VAL B 20 5.416 4.777 -9.803 1.00 0.00 H new ATOM 1585 N TYR B 21 7.417 6.011 -10.178 1.00 0.00 N ATOM 1586 CA TYR B 21 8.435 5.301 -10.949 1.00 0.00 C ATOM 1587 C TYR B 21 9.798 5.949 -10.744 1.00 0.00 C ATOM 1588 O TYR B 21 10.782 5.254 -10.488 1.00 0.00 O ATOM 1589 CB TYR B 21 8.096 5.241 -12.446 1.00 0.00 C ATOM 1590 CG TYR B 21 8.708 4.052 -13.153 1.00 0.00 C ATOM 1591 CD1 TYR B 21 10.015 4.096 -13.621 1.00 0.00 C ATOM 1592 CD2 TYR B 21 7.979 2.886 -13.351 1.00 0.00 C ATOM 1593 CE1 TYR B 21 10.579 3.013 -14.267 1.00 0.00 C ATOM 1594 CE2 TYR B 21 8.536 1.798 -13.997 1.00 0.00 C ATOM 1595 CZ TYR B 21 9.836 1.865 -14.453 1.00 0.00 C ATOM 1596 OH TYR B 21 10.392 0.784 -15.095 1.00 0.00 O ATOM 0 H TYR B 21 6.732 6.521 -10.736 1.00 0.00 H new ATOM 0 HA TYR B 21 8.461 4.275 -10.582 1.00 0.00 H new ATOM 0 HB2 TYR B 21 7.013 5.207 -12.565 1.00 0.00 H new ATOM 0 HB3 TYR B 21 8.441 6.157 -12.926 1.00 0.00 H new ATOM 0 HD1 TYR B 21 10.600 4.992 -13.477 1.00 0.00 H new ATOM 0 HD2 TYR B 21 6.961 2.829 -12.995 1.00 0.00 H new ATOM 0 HE1 TYR B 21 11.597 3.064 -14.625 1.00 0.00 H new ATOM 0 HE2 TYR B 21 7.956 0.899 -14.144 1.00 0.00 H new ATOM 0 HH TYR B 21 9.735 0.058 -15.142 1.00 0.00 H new ATOM 1606 N HIS B 22 9.867 7.283 -10.837 1.00 0.00 N ATOM 1607 CA HIS B 22 11.141 7.962 -10.630 1.00 0.00 C ATOM 1608 C HIS B 22 11.603 7.763 -9.194 1.00 0.00 C ATOM 1609 O HIS B 22 12.771 7.471 -8.944 1.00 0.00 O ATOM 1610 CB HIS B 22 11.029 9.454 -10.952 1.00 0.00 C ATOM 1611 CG HIS B 22 11.636 9.826 -12.269 1.00 0.00 C ATOM 1612 ND1 HIS B 22 11.389 11.028 -12.900 1.00 0.00 N ATOM 1613 CD2 HIS B 22 12.488 9.149 -13.075 1.00 0.00 C ATOM 1614 CE1 HIS B 22 12.061 11.071 -14.037 1.00 0.00 C ATOM 1615 NE2 HIS B 22 12.735 9.945 -14.166 1.00 0.00 N ATOM 0 H HIS B 22 9.078 7.894 -11.048 1.00 0.00 H new ATOM 0 HA HIS B 22 11.877 7.529 -11.307 1.00 0.00 H new ATOM 0 HB2 HIS B 22 9.977 9.740 -10.952 1.00 0.00 H new ATOM 0 HB3 HIS B 22 11.515 10.026 -10.162 1.00 0.00 H new ATOM 0 HD2 HIS B 22 12.897 8.166 -12.893 1.00 0.00 H new ATOM 0 HE1 HIS B 22 12.059 11.890 -14.741 1.00 0.00 H new ATOM 0 HE2 HIS B 22 13.342 9.704 -14.950 1.00 0.00 H new ATOM 1624 N THR B 23 10.677 7.898 -8.250 1.00 0.00 N ATOM 1625 CA THR B 23 11.009 7.701 -6.847 1.00 0.00 C ATOM 1626 C THR B 23 11.418 6.254 -6.618 1.00 0.00 C ATOM 1627 O THR B 23 12.430 5.979 -5.979 1.00 0.00 O ATOM 1628 CB THR B 23 9.835 8.056 -5.943 1.00 0.00 C ATOM 1629 OG1 THR B 23 8.696 7.278 -6.267 1.00 0.00 O ATOM 1630 CG2 THR B 23 9.436 9.514 -6.020 1.00 0.00 C ATOM 0 H THR B 23 9.703 8.140 -8.429 1.00 0.00 H new ATOM 0 HA THR B 23 11.838 8.363 -6.597 1.00 0.00 H new ATOM 0 HB THR B 23 10.179 7.846 -4.930 1.00 0.00 H new ATOM 0 HG1 THR B 23 8.170 7.739 -6.953 1.00 0.00 H new ATOM 0 HG21 THR B 23 8.595 9.697 -5.352 1.00 0.00 H new ATOM 0 HG22 THR B 23 10.279 10.138 -5.722 1.00 0.00 H new ATOM 0 HG23 THR B 23 9.147 9.759 -7.042 1.00 0.00 H new ATOM 1638 N LEU B 24 10.641 5.323 -7.176 1.00 0.00 N ATOM 1639 CA LEU B 24 10.958 3.906 -7.052 1.00 0.00 C ATOM 1640 C LEU B 24 12.372 3.648 -7.560 1.00 0.00 C ATOM 1641 O LEU B 24 12.985 2.634 -7.230 1.00 0.00 O ATOM 1642 CB LEU B 24 9.956 3.045 -7.829 1.00 0.00 C ATOM 1643 CG LEU B 24 8.910 2.334 -6.964 1.00 0.00 C ATOM 1644 CD1 LEU B 24 9.575 1.611 -5.803 1.00 0.00 C ATOM 1645 CD2 LEU B 24 7.877 3.325 -6.451 1.00 0.00 C ATOM 0 H LEU B 24 9.797 5.525 -7.712 1.00 0.00 H new ATOM 0 HA LEU B 24 10.894 3.631 -5.999 1.00 0.00 H new ATOM 0 HB2 LEU B 24 9.440 3.677 -8.552 1.00 0.00 H new ATOM 0 HB3 LEU B 24 10.507 2.295 -8.397 1.00 0.00 H new ATOM 0 HG LEU B 24 8.401 1.595 -7.583 1.00 0.00 H new ATOM 0 HD11 LEU B 24 8.815 1.113 -5.201 1.00 0.00 H new ATOM 0 HD12 LEU B 24 10.275 0.870 -6.189 1.00 0.00 H new ATOM 0 HD13 LEU B 24 10.112 2.331 -5.186 1.00 0.00 H new ATOM 0 HD21 LEU B 24 7.143 2.801 -5.839 1.00 0.00 H new ATOM 0 HD22 LEU B 24 8.372 4.088 -5.850 1.00 0.00 H new ATOM 0 HD23 LEU B 24 7.375 3.797 -7.295 1.00 0.00 H new ATOM 1657 N LYS B 25 12.885 4.580 -8.362 1.00 0.00 N ATOM 1658 CA LYS B 25 14.223 4.457 -8.907 1.00 0.00 C ATOM 1659 C LYS B 25 15.276 4.611 -7.816 1.00 0.00 C ATOM 1660 O LYS B 25 16.184 3.788 -7.708 1.00 0.00 O ATOM 1661 CB LYS B 25 14.456 5.490 -10.012 1.00 0.00 C ATOM 1662 CG LYS B 25 15.667 5.191 -10.882 1.00 0.00 C ATOM 1663 CD LYS B 25 15.617 3.782 -11.453 1.00 0.00 C ATOM 1664 CE LYS B 25 16.654 2.879 -10.803 1.00 0.00 C ATOM 1665 NZ LYS B 25 16.497 1.460 -11.225 1.00 0.00 N ATOM 0 H LYS B 25 12.389 5.426 -8.645 1.00 0.00 H new ATOM 0 HA LYS B 25 14.315 3.459 -9.336 1.00 0.00 H new ATOM 0 HB2 LYS B 25 13.569 5.540 -10.644 1.00 0.00 H new ATOM 0 HB3 LYS B 25 14.580 6.473 -9.558 1.00 0.00 H new ATOM 0 HG2 LYS B 25 15.716 5.912 -11.698 1.00 0.00 H new ATOM 0 HG3 LYS B 25 16.576 5.313 -10.294 1.00 0.00 H new ATOM 0 HD2 LYS B 25 14.622 3.362 -11.302 1.00 0.00 H new ATOM 0 HD3 LYS B 25 15.788 3.818 -12.529 1.00 0.00 H new ATOM 0 HE2 LYS B 25 17.653 3.227 -11.064 1.00 0.00 H new ATOM 0 HE3 LYS B 25 16.566 2.947 -9.719 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 17.222 0.877 -10.760 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 15.553 1.119 -10.953 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 16.606 1.391 -12.257 1.00 0.00 H new ATOM 1679 N LEU B 26 15.155 5.658 -7.000 1.00 0.00 N ATOM 1680 CA LEU B 26 16.121 5.869 -5.928 1.00 0.00 C ATOM 1681 C LEU B 26 15.986 4.772 -4.880 1.00 0.00 C ATOM 1682 O LEU B 26 16.979 4.205 -4.437 1.00 0.00 O ATOM 1683 CB LEU B 26 15.991 7.261 -5.299 1.00 0.00 C ATOM 1684 CG LEU B 26 14.572 7.732 -5.027 1.00 0.00 C ATOM 1685 CD1 LEU B 26 14.050 7.102 -3.750 1.00 0.00 C ATOM 1686 CD2 LEU B 26 14.521 9.251 -4.941 1.00 0.00 C ATOM 0 H LEU B 26 14.415 6.357 -7.059 1.00 0.00 H new ATOM 0 HA LEU B 26 17.120 5.818 -6.362 1.00 0.00 H new ATOM 0 HB2 LEU B 26 16.543 7.268 -4.359 1.00 0.00 H new ATOM 0 HB3 LEU B 26 16.474 7.983 -5.957 1.00 0.00 H new ATOM 0 HG LEU B 26 13.934 7.419 -5.853 1.00 0.00 H new ATOM 0 HD11 LEU B 26 13.033 7.446 -3.564 1.00 0.00 H new ATOM 0 HD12 LEU B 26 14.053 6.017 -3.852 1.00 0.00 H new ATOM 0 HD13 LEU B 26 14.689 7.390 -2.915 1.00 0.00 H new ATOM 0 HD21 LEU B 26 13.497 9.570 -4.746 1.00 0.00 H new ATOM 0 HD22 LEU B 26 15.168 9.592 -4.132 1.00 0.00 H new ATOM 0 HD23 LEU B 26 14.862 9.680 -5.883 1.00 0.00 H new ATOM 1698 N VAL B 27 14.750 4.456 -4.512 1.00 0.00 N ATOM 1699 CA VAL B 27 14.485 3.397 -3.538 1.00 0.00 C ATOM 1700 C VAL B 27 14.930 2.054 -4.070 1.00 0.00 C ATOM 1701 O VAL B 27 15.535 1.265 -3.352 1.00 0.00 O ATOM 1702 CB VAL B 27 12.993 3.290 -3.167 1.00 0.00 C ATOM 1703 CG1 VAL B 27 12.721 3.916 -1.815 1.00 0.00 C ATOM 1704 CG2 VAL B 27 12.133 3.917 -4.217 1.00 0.00 C ATOM 0 H VAL B 27 13.914 4.916 -4.872 1.00 0.00 H new ATOM 0 HA VAL B 27 15.051 3.666 -2.646 1.00 0.00 H new ATOM 0 HB VAL B 27 12.743 2.231 -3.108 1.00 0.00 H new ATOM 0 HG11 VAL B 27 11.661 3.826 -1.579 1.00 0.00 H new ATOM 0 HG12 VAL B 27 13.307 3.404 -1.052 1.00 0.00 H new ATOM 0 HG13 VAL B 27 12.999 4.970 -1.839 1.00 0.00 H new ATOM 0 HG21 VAL B 27 11.085 3.828 -3.930 1.00 0.00 H new ATOM 0 HG22 VAL B 27 12.393 4.971 -4.319 1.00 0.00 H new ATOM 0 HG23 VAL B 27 12.293 3.410 -5.169 1.00 0.00 H new ATOM 1714 N SER B 28 14.618 1.776 -5.324 1.00 0.00 N ATOM 1715 CA SER B 28 14.990 0.500 -5.896 1.00 0.00 C ATOM 1716 C SER B 28 16.504 0.347 -5.958 1.00 0.00 C ATOM 1717 O SER B 28 17.031 -0.754 -5.783 1.00 0.00 O ATOM 1718 CB SER B 28 14.378 0.321 -7.286 1.00 0.00 C ATOM 1719 OG SER B 28 12.974 0.143 -7.206 1.00 0.00 O ATOM 0 H SER B 28 14.118 2.405 -5.953 1.00 0.00 H new ATOM 0 HA SER B 28 14.595 -0.280 -5.245 1.00 0.00 H new ATOM 0 HB2 SER B 28 14.603 1.193 -7.901 1.00 0.00 H new ATOM 0 HB3 SER B 28 14.830 -0.541 -7.777 1.00 0.00 H new ATOM 0 HG SER B 28 12.526 0.997 -7.380 1.00 0.00 H new ATOM 1725 N VAL B 29 17.196 1.454 -6.193 1.00 0.00 N ATOM 1726 CA VAL B 29 18.646 1.448 -6.267 1.00 0.00 C ATOM 1727 C VAL B 29 19.246 1.474 -4.867 1.00 0.00 C ATOM 1728 O VAL B 29 20.139 0.691 -4.541 1.00 0.00 O ATOM 1729 CB VAL B 29 19.149 2.655 -7.095 1.00 0.00 C ATOM 1730 CG1 VAL B 29 19.968 3.625 -6.258 1.00 0.00 C ATOM 1731 CG2 VAL B 29 19.940 2.183 -8.306 1.00 0.00 C ATOM 0 H VAL B 29 16.771 2.370 -6.336 1.00 0.00 H new ATOM 0 HA VAL B 29 18.966 0.532 -6.764 1.00 0.00 H new ATOM 0 HB VAL B 29 18.269 3.197 -7.442 1.00 0.00 H new ATOM 0 HG11 VAL B 29 20.299 4.455 -6.882 1.00 0.00 H new ATOM 0 HG12 VAL B 29 19.356 4.007 -5.441 1.00 0.00 H new ATOM 0 HG13 VAL B 29 20.837 3.109 -5.850 1.00 0.00 H new ATOM 0 HG21 VAL B 29 20.285 3.047 -8.875 1.00 0.00 H new ATOM 0 HG22 VAL B 29 20.800 1.600 -7.975 1.00 0.00 H new ATOM 0 HG23 VAL B 29 19.303 1.563 -8.937 1.00 0.00 H new ATOM 1741 N TYR B 30 18.746 2.389 -4.046 1.00 0.00 N ATOM 1742 CA TYR B 30 19.227 2.531 -2.677 1.00 0.00 C ATOM 1743 C TYR B 30 18.762 1.372 -1.803 1.00 0.00 C ATOM 1744 O TYR B 30 19.395 1.065 -0.793 1.00 0.00 O ATOM 1745 CB TYR B 30 18.759 3.858 -2.070 1.00 0.00 C ATOM 1746 CG TYR B 30 19.797 4.955 -2.140 1.00 0.00 C ATOM 1747 CD1 TYR B 30 21.075 4.762 -1.629 1.00 0.00 C ATOM 1748 CD2 TYR B 30 19.499 6.184 -2.715 1.00 0.00 C ATOM 1749 CE1 TYR B 30 22.026 5.763 -1.689 1.00 0.00 C ATOM 1750 CE2 TYR B 30 20.445 7.190 -2.780 1.00 0.00 C ATOM 1751 CZ TYR B 30 21.706 6.974 -2.265 1.00 0.00 C ATOM 1752 OH TYR B 30 22.650 7.973 -2.327 1.00 0.00 O ATOM 0 H TYR B 30 18.008 3.044 -4.304 1.00 0.00 H new ATOM 0 HA TYR B 30 20.316 2.522 -2.712 1.00 0.00 H new ATOM 0 HB2 TYR B 30 17.859 4.188 -2.588 1.00 0.00 H new ATOM 0 HB3 TYR B 30 18.485 3.695 -1.028 1.00 0.00 H new ATOM 0 HD1 TYR B 30 21.329 3.814 -1.178 1.00 0.00 H new ATOM 0 HD2 TYR B 30 18.512 6.356 -3.118 1.00 0.00 H new ATOM 0 HE1 TYR B 30 23.015 5.597 -1.287 1.00 0.00 H new ATOM 0 HE2 TYR B 30 20.198 8.140 -3.231 1.00 0.00 H new ATOM 0 HH TYR B 30 22.264 8.761 -2.764 1.00 0.00 H new ATOM 1762 N LEU B 31 17.662 0.723 -2.184 1.00 0.00 N ATOM 1763 CA LEU B 31 17.153 -0.395 -1.405 1.00 0.00 C ATOM 1764 C LEU B 31 17.383 -1.710 -2.146 1.00 0.00 C ATOM 1765 O LEU B 31 17.148 -2.787 -1.598 1.00 0.00 O ATOM 1766 CB LEU B 31 15.655 -0.226 -1.108 1.00 0.00 C ATOM 1767 CG LEU B 31 15.180 1.169 -0.644 1.00 0.00 C ATOM 1768 CD1 LEU B 31 14.182 1.038 0.498 1.00 0.00 C ATOM 1769 CD2 LEU B 31 16.341 2.062 -0.222 1.00 0.00 C ATOM 0 H LEU B 31 17.116 0.951 -3.015 1.00 0.00 H new ATOM 0 HA LEU B 31 17.695 -0.415 -0.460 1.00 0.00 H new ATOM 0 HB2 LEU B 31 15.100 -0.489 -2.009 1.00 0.00 H new ATOM 0 HB3 LEU B 31 15.379 -0.949 -0.341 1.00 0.00 H new ATOM 0 HG LEU B 31 14.694 1.642 -1.497 1.00 0.00 H new ATOM 0 HD11 LEU B 31 13.857 2.030 0.813 1.00 0.00 H new ATOM 0 HD12 LEU B 31 13.319 0.463 0.163 1.00 0.00 H new ATOM 0 HD13 LEU B 31 14.654 0.527 1.337 1.00 0.00 H new ATOM 0 HD21 LEU B 31 15.957 3.032 0.096 1.00 0.00 H new ATOM 0 HD22 LEU B 31 16.877 1.595 0.604 1.00 0.00 H new ATOM 0 HD23 LEU B 31 17.020 2.199 -1.064 1.00 0.00 H new ATOM 1781 N ASN B 32 17.833 -1.619 -3.398 1.00 0.00 N ATOM 1782 CA ASN B 32 18.074 -2.805 -4.207 1.00 0.00 C ATOM 1783 C ASN B 32 16.808 -3.644 -4.273 1.00 0.00 C ATOM 1784 O ASN B 32 16.856 -4.874 -4.273 1.00 0.00 O ATOM 1785 CB ASN B 32 19.223 -3.631 -3.623 1.00 0.00 C ATOM 1786 CG ASN B 32 20.468 -2.798 -3.384 1.00 0.00 C ATOM 1787 OD1 ASN B 32 21.365 -2.745 -4.225 1.00 0.00 O ATOM 1788 ND2 ASN B 32 20.530 -2.143 -2.230 1.00 0.00 N ATOM 0 H ASN B 32 18.036 -0.737 -3.869 1.00 0.00 H new ATOM 0 HA ASN B 32 18.353 -2.493 -5.214 1.00 0.00 H new ATOM 0 HB2 ASN B 32 18.903 -4.080 -2.683 1.00 0.00 H new ATOM 0 HB3 ASN B 32 19.461 -4.449 -4.302 1.00 0.00 H new ATOM 0 HD21 ASN B 32 21.344 -1.568 -2.013 1.00 0.00 H new ATOM 0 HD22 ASN B 32 19.763 -2.215 -1.561 1.00 0.00 H new ATOM 1795 N ARG B 33 15.670 -2.959 -4.308 1.00 0.00 N ATOM 1796 CA ARG B 33 14.376 -3.630 -4.349 1.00 0.00 C ATOM 1797 C ARG B 33 13.531 -3.155 -5.524 1.00 0.00 C ATOM 1798 O ARG B 33 13.385 -1.955 -5.752 1.00 0.00 O ATOM 1799 CB ARG B 33 13.621 -3.381 -3.041 1.00 0.00 C ATOM 1800 CG ARG B 33 14.203 -4.140 -1.859 1.00 0.00 C ATOM 1801 CD ARG B 33 13.496 -3.791 -0.560 1.00 0.00 C ATOM 1802 NE ARG B 33 12.206 -4.470 -0.439 1.00 0.00 N ATOM 1803 CZ ARG B 33 11.877 -5.281 0.567 1.00 0.00 C ATOM 1804 NH1 ARG B 33 12.734 -5.524 1.551 1.00 0.00 N ATOM 1805 NH2 ARG B 33 10.680 -5.853 0.588 1.00 0.00 N ATOM 0 H ARG B 33 15.617 -1.940 -4.309 1.00 0.00 H new ATOM 0 HA ARG B 33 14.559 -4.697 -4.476 1.00 0.00 H new ATOM 0 HB2 ARG B 33 13.632 -2.314 -2.820 1.00 0.00 H new ATOM 0 HB3 ARG B 33 12.578 -3.669 -3.171 1.00 0.00 H new ATOM 0 HG2 ARG B 33 14.122 -5.212 -2.040 1.00 0.00 H new ATOM 0 HG3 ARG B 33 15.265 -3.911 -1.768 1.00 0.00 H new ATOM 0 HD2 ARG B 33 14.130 -4.065 0.283 1.00 0.00 H new ATOM 0 HD3 ARG B 33 13.345 -2.713 -0.508 1.00 0.00 H new ATOM 0 HE ARG B 33 11.514 -4.313 -1.171 1.00 0.00 H new ATOM 0 HH11 ARG B 33 13.656 -5.088 1.543 1.00 0.00 H new ATOM 0 HH12 ARG B 33 12.470 -6.146 2.315 1.00 0.00 H new ATOM 0 HH21 ARG B 33 10.015 -5.672 -0.164 1.00 0.00 H new ATOM 0 HH22 ARG B 33 10.425 -6.474 1.356 1.00 0.00 H new ATOM 1819 N ASP B 34 12.957 -4.105 -6.257 1.00 0.00 N ATOM 1820 CA ASP B 34 12.105 -3.776 -7.394 1.00 0.00 C ATOM 1821 C ASP B 34 11.048 -2.765 -6.972 1.00 0.00 C ATOM 1822 O ASP B 34 10.811 -2.573 -5.780 1.00 0.00 O ATOM 1823 CB ASP B 34 11.438 -5.037 -7.951 1.00 0.00 C ATOM 1824 CG ASP B 34 12.179 -5.603 -9.145 1.00 0.00 C ATOM 1825 OD1 ASP B 34 12.784 -4.811 -9.899 1.00 0.00 O ATOM 1826 OD2 ASP B 34 12.157 -6.839 -9.327 1.00 0.00 O ATOM 0 H ASP B 34 13.066 -5.104 -6.085 1.00 0.00 H new ATOM 0 HA ASP B 34 12.723 -3.340 -8.179 1.00 0.00 H new ATOM 0 HB2 ASP B 34 11.385 -5.793 -7.168 1.00 0.00 H new ATOM 0 HB3 ASP B 34 10.413 -4.805 -8.240 1.00 0.00 H new ATOM 1831 N MET B 35 10.418 -2.112 -7.938 1.00 0.00 N ATOM 1832 CA MET B 35 9.405 -1.126 -7.630 1.00 0.00 C ATOM 1833 C MET B 35 8.244 -1.771 -6.876 1.00 0.00 C ATOM 1834 O MET B 35 7.669 -1.169 -5.969 1.00 0.00 O ATOM 1835 CB MET B 35 8.924 -0.449 -8.914 1.00 0.00 C ATOM 1836 CG MET B 35 7.428 -0.220 -8.955 1.00 0.00 C ATOM 1837 SD MET B 35 6.925 0.926 -10.252 1.00 0.00 S ATOM 1838 CE MET B 35 7.264 -0.048 -11.715 1.00 0.00 C ATOM 0 H MET B 35 10.592 -2.249 -8.934 1.00 0.00 H new ATOM 0 HA MET B 35 9.838 -0.362 -6.984 1.00 0.00 H new ATOM 0 HB2 MET B 35 9.433 0.509 -9.022 1.00 0.00 H new ATOM 0 HB3 MET B 35 9.213 -1.062 -9.768 1.00 0.00 H new ATOM 0 HG2 MET B 35 6.924 -1.175 -9.106 1.00 0.00 H new ATOM 0 HG3 MET B 35 7.099 0.165 -7.990 1.00 0.00 H new ATOM 0 HE1 MET B 35 6.711 0.361 -12.561 1.00 0.00 H new ATOM 0 HE2 MET B 35 8.332 -0.019 -11.932 1.00 0.00 H new ATOM 0 HE3 MET B 35 6.956 -1.080 -11.545 1.00 0.00 H new ATOM 1848 N THR B 36 7.908 -3.002 -7.253 1.00 0.00 N ATOM 1849 CA THR B 36 6.821 -3.723 -6.602 1.00 0.00 C ATOM 1850 C THR B 36 7.191 -4.063 -5.166 1.00 0.00 C ATOM 1851 O THR B 36 6.377 -3.923 -4.256 1.00 0.00 O ATOM 1852 CB THR B 36 6.485 -5.011 -7.367 1.00 0.00 C ATOM 1853 OG1 THR B 36 7.634 -5.514 -8.027 1.00 0.00 O ATOM 1854 CG2 THR B 36 5.395 -4.852 -8.408 1.00 0.00 C ATOM 0 H THR B 36 8.371 -3.518 -8.002 1.00 0.00 H new ATOM 0 HA THR B 36 5.944 -3.076 -6.601 1.00 0.00 H new ATOM 0 HB THR B 36 6.123 -5.699 -6.603 1.00 0.00 H new ATOM 0 HG1 THR B 36 7.696 -5.120 -8.922 1.00 0.00 H new ATOM 0 HG21 THR B 36 5.220 -5.808 -8.901 1.00 0.00 H new ATOM 0 HG22 THR B 36 4.476 -4.520 -7.925 1.00 0.00 H new ATOM 0 HG23 THR B 36 5.703 -4.113 -9.148 1.00 0.00 H new ATOM 1862 N GLU B 37 8.425 -4.512 -4.969 1.00 0.00 N ATOM 1863 CA GLU B 37 8.899 -4.873 -3.638 1.00 0.00 C ATOM 1864 C GLU B 37 8.941 -3.651 -2.726 1.00 0.00 C ATOM 1865 O GLU B 37 8.599 -3.733 -1.549 1.00 0.00 O ATOM 1866 CB GLU B 37 10.287 -5.513 -3.727 1.00 0.00 C ATOM 1867 CG GLU B 37 10.418 -6.793 -2.916 1.00 0.00 C ATOM 1868 CD GLU B 37 11.628 -7.614 -3.316 1.00 0.00 C ATOM 1869 OE1 GLU B 37 12.730 -7.037 -3.420 1.00 0.00 O ATOM 1870 OE2 GLU B 37 11.472 -8.836 -3.527 1.00 0.00 O ATOM 0 H GLU B 37 9.114 -4.635 -5.711 1.00 0.00 H new ATOM 0 HA GLU B 37 8.202 -5.594 -3.211 1.00 0.00 H new ATOM 0 HB2 GLU B 37 10.512 -5.729 -4.771 1.00 0.00 H new ATOM 0 HB3 GLU B 37 11.032 -4.796 -3.382 1.00 0.00 H new ATOM 0 HG2 GLU B 37 10.487 -6.543 -1.857 1.00 0.00 H new ATOM 0 HG3 GLU B 37 9.517 -7.394 -3.044 1.00 0.00 H new ATOM 1877 N ILE B 38 9.363 -2.519 -3.277 1.00 0.00 N ATOM 1878 CA ILE B 38 9.450 -1.280 -2.511 1.00 0.00 C ATOM 1879 C ILE B 38 8.066 -0.685 -2.267 1.00 0.00 C ATOM 1880 O ILE B 38 7.737 -0.305 -1.145 1.00 0.00 O ATOM 1881 CB ILE B 38 10.325 -0.239 -3.240 1.00 0.00 C ATOM 1882 CG1 ILE B 38 11.822 -0.521 -3.042 1.00 0.00 C ATOM 1883 CG2 ILE B 38 10.014 1.170 -2.767 1.00 0.00 C ATOM 1884 CD1 ILE B 38 12.200 -0.810 -1.605 1.00 0.00 C ATOM 0 H ILE B 38 9.651 -2.433 -4.252 1.00 0.00 H new ATOM 0 HA ILE B 38 9.907 -1.527 -1.553 1.00 0.00 H new ATOM 0 HB ILE B 38 10.089 -0.320 -4.301 1.00 0.00 H new ATOM 0 HG12 ILE B 38 12.108 -1.371 -3.662 1.00 0.00 H new ATOM 0 HG13 ILE B 38 12.394 0.337 -3.394 1.00 0.00 H new ATOM 0 HG21 ILE B 38 10.647 1.880 -3.299 1.00 0.00 H new ATOM 0 HG22 ILE B 38 8.967 1.397 -2.965 1.00 0.00 H new ATOM 0 HG23 ILE B 38 10.205 1.245 -1.697 1.00 0.00 H new ATOM 0 HD11 ILE B 38 13.272 -1.000 -1.542 1.00 0.00 H new ATOM 0 HD12 ILE B 38 11.946 0.048 -0.982 1.00 0.00 H new ATOM 0 HD13 ILE B 38 11.655 -1.687 -1.255 1.00 0.00 H new ATOM 1896 N ILE B 39 7.254 -0.602 -3.317 1.00 0.00 N ATOM 1897 CA ILE B 39 5.916 -0.049 -3.180 1.00 0.00 C ATOM 1898 C ILE B 39 5.076 -0.939 -2.283 1.00 0.00 C ATOM 1899 O ILE B 39 4.214 -0.463 -1.544 1.00 0.00 O ATOM 1900 CB ILE B 39 5.213 0.086 -4.542 1.00 0.00 C ATOM 1901 CG1 ILE B 39 5.023 -1.295 -5.160 1.00 0.00 C ATOM 1902 CG2 ILE B 39 6.012 0.989 -5.468 1.00 0.00 C ATOM 1903 CD1 ILE B 39 3.658 -1.892 -4.894 1.00 0.00 C ATOM 0 H ILE B 39 7.497 -0.907 -4.259 1.00 0.00 H new ATOM 0 HA ILE B 39 6.018 0.944 -2.742 1.00 0.00 H new ATOM 0 HB ILE B 39 4.234 0.542 -4.395 1.00 0.00 H new ATOM 0 HG12 ILE B 39 5.178 -1.227 -6.237 1.00 0.00 H new ATOM 0 HG13 ILE B 39 5.787 -1.967 -4.770 1.00 0.00 H new ATOM 0 HG21 ILE B 39 5.499 1.072 -6.426 1.00 0.00 H new ATOM 0 HG22 ILE B 39 6.106 1.978 -5.020 1.00 0.00 H new ATOM 0 HG23 ILE B 39 7.004 0.565 -5.623 1.00 0.00 H new ATOM 0 HD11 ILE B 39 3.593 -2.874 -5.363 1.00 0.00 H new ATOM 0 HD12 ILE B 39 3.508 -1.992 -3.819 1.00 0.00 H new ATOM 0 HD13 ILE B 39 2.889 -1.240 -5.309 1.00 0.00 H new ATOM 1915 N GLU B 40 5.334 -2.239 -2.359 1.00 0.00 N ATOM 1916 CA GLU B 40 4.599 -3.197 -1.560 1.00 0.00 C ATOM 1917 C GLU B 40 5.208 -3.320 -0.170 1.00 0.00 C ATOM 1918 O GLU B 40 4.503 -3.634 0.789 1.00 0.00 O ATOM 1919 CB GLU B 40 4.550 -4.566 -2.251 1.00 0.00 C ATOM 1920 CG GLU B 40 5.836 -5.370 -2.133 1.00 0.00 C ATOM 1921 CD GLU B 40 5.773 -6.413 -1.035 1.00 0.00 C ATOM 1922 OE1 GLU B 40 5.896 -6.037 0.149 1.00 0.00 O ATOM 1923 OE2 GLU B 40 5.600 -7.607 -1.359 1.00 0.00 O ATOM 0 H GLU B 40 6.045 -2.648 -2.965 1.00 0.00 H new ATOM 0 HA GLU B 40 3.577 -2.833 -1.456 1.00 0.00 H new ATOM 0 HB2 GLU B 40 3.731 -5.146 -1.825 1.00 0.00 H new ATOM 0 HB3 GLU B 40 4.322 -4.420 -3.307 1.00 0.00 H new ATOM 0 HG2 GLU B 40 6.042 -5.861 -3.084 1.00 0.00 H new ATOM 0 HG3 GLU B 40 6.667 -4.692 -1.938 1.00 0.00 H new ATOM 1930 N GLU B 41 6.507 -3.051 -0.046 1.00 0.00 N ATOM 1931 CA GLU B 41 7.137 -3.125 1.267 1.00 0.00 C ATOM 1932 C GLU B 41 6.942 -1.810 2.009 1.00 0.00 C ATOM 1933 O GLU B 41 6.839 -1.783 3.239 1.00 0.00 O ATOM 1934 CB GLU B 41 8.628 -3.472 1.163 1.00 0.00 C ATOM 1935 CG GLU B 41 9.497 -2.329 0.666 1.00 0.00 C ATOM 1936 CD GLU B 41 10.239 -1.630 1.788 1.00 0.00 C ATOM 1937 OE1 GLU B 41 11.291 -2.147 2.218 1.00 0.00 O ATOM 1938 OE2 GLU B 41 9.766 -0.565 2.238 1.00 0.00 O ATOM 0 H GLU B 41 7.126 -2.788 -0.813 1.00 0.00 H new ATOM 0 HA GLU B 41 6.657 -3.927 1.827 1.00 0.00 H new ATOM 0 HB2 GLU B 41 8.986 -3.787 2.143 1.00 0.00 H new ATOM 0 HB3 GLU B 41 8.746 -4.323 0.492 1.00 0.00 H new ATOM 0 HG2 GLU B 41 10.217 -2.713 -0.057 1.00 0.00 H new ATOM 0 HG3 GLU B 41 8.873 -1.605 0.141 1.00 0.00 H new ATOM 1945 N ALA B 42 6.876 -0.718 1.252 1.00 0.00 N ATOM 1946 CA ALA B 42 6.681 0.598 1.842 1.00 0.00 C ATOM 1947 C ALA B 42 5.226 0.800 2.241 1.00 0.00 C ATOM 1948 O ALA B 42 4.934 1.359 3.298 1.00 0.00 O ATOM 1949 CB ALA B 42 7.127 1.686 0.877 1.00 0.00 C ATOM 0 H ALA B 42 6.954 -0.720 0.235 1.00 0.00 H new ATOM 0 HA ALA B 42 7.293 0.663 2.742 1.00 0.00 H new ATOM 0 HB1 ALA B 42 6.974 2.663 1.335 1.00 0.00 H new ATOM 0 HB2 ALA B 42 8.184 1.555 0.645 1.00 0.00 H new ATOM 0 HB3 ALA B 42 6.543 1.620 -0.041 1.00 0.00 H new ATOM 1955 N VAL B 43 4.312 0.330 1.396 1.00 0.00 N ATOM 1956 CA VAL B 43 2.885 0.449 1.673 1.00 0.00 C ATOM 1957 C VAL B 43 2.558 -0.137 3.031 1.00 0.00 C ATOM 1958 O VAL B 43 2.048 0.543 3.920 1.00 0.00 O ATOM 1959 CB VAL B 43 2.032 -0.286 0.612 1.00 0.00 C ATOM 1960 CG1 VAL B 43 2.546 -1.683 0.352 1.00 0.00 C ATOM 1961 CG2 VAL B 43 0.579 -0.356 1.038 1.00 0.00 C ATOM 0 H VAL B 43 4.534 -0.136 0.516 1.00 0.00 H new ATOM 0 HA VAL B 43 2.647 1.512 1.650 1.00 0.00 H new ATOM 0 HB VAL B 43 2.110 0.289 -0.311 1.00 0.00 H new ATOM 0 HG11 VAL B 43 1.921 -2.167 -0.399 1.00 0.00 H new ATOM 0 HG12 VAL B 43 3.573 -1.631 -0.009 1.00 0.00 H new ATOM 0 HG13 VAL B 43 2.515 -2.260 1.276 1.00 0.00 H new ATOM 0 HG21 VAL B 43 0.001 -0.877 0.275 1.00 0.00 H new ATOM 0 HG22 VAL B 43 0.502 -0.895 1.983 1.00 0.00 H new ATOM 0 HG23 VAL B 43 0.187 0.654 1.163 1.00 0.00 H new ATOM 1971 N VAL B 44 2.855 -1.411 3.163 1.00 0.00 N ATOM 1972 CA VAL B 44 2.603 -2.137 4.386 1.00 0.00 C ATOM 1973 C VAL B 44 3.294 -1.465 5.563 1.00 0.00 C ATOM 1974 O VAL B 44 2.723 -1.337 6.643 1.00 0.00 O ATOM 1975 CB VAL B 44 3.068 -3.601 4.236 1.00 0.00 C ATOM 1976 CG1 VAL B 44 3.904 -4.063 5.425 1.00 0.00 C ATOM 1977 CG2 VAL B 44 1.877 -4.521 4.029 1.00 0.00 C ATOM 0 H VAL B 44 3.278 -1.972 2.424 1.00 0.00 H new ATOM 0 HA VAL B 44 1.531 -2.132 4.582 1.00 0.00 H new ATOM 0 HB VAL B 44 3.707 -3.649 3.355 1.00 0.00 H new ATOM 0 HG11 VAL B 44 4.209 -5.099 5.275 1.00 0.00 H new ATOM 0 HG12 VAL B 44 4.789 -3.434 5.514 1.00 0.00 H new ATOM 0 HG13 VAL B 44 3.312 -3.987 6.337 1.00 0.00 H new ATOM 0 HG21 VAL B 44 2.225 -5.549 3.925 1.00 0.00 H new ATOM 0 HG22 VAL B 44 1.208 -4.449 4.887 1.00 0.00 H new ATOM 0 HG23 VAL B 44 1.342 -4.226 3.126 1.00 0.00 H new ATOM 1987 N MET B 45 4.524 -1.029 5.348 1.00 0.00 N ATOM 1988 CA MET B 45 5.273 -0.366 6.401 1.00 0.00 C ATOM 1989 C MET B 45 4.544 0.887 6.874 1.00 0.00 C ATOM 1990 O MET B 45 4.580 1.220 8.059 1.00 0.00 O ATOM 1991 CB MET B 45 6.677 -0.005 5.916 1.00 0.00 C ATOM 1992 CG MET B 45 7.500 0.761 6.943 1.00 0.00 C ATOM 1993 SD MET B 45 8.240 2.261 6.267 1.00 0.00 S ATOM 1994 CE MET B 45 6.891 3.424 6.460 1.00 0.00 C ATOM 0 H MET B 45 5.021 -1.121 4.462 1.00 0.00 H new ATOM 0 HA MET B 45 5.359 -1.056 7.241 1.00 0.00 H new ATOM 0 HB2 MET B 45 7.206 -0.920 5.648 1.00 0.00 H new ATOM 0 HB3 MET B 45 6.596 0.593 5.009 1.00 0.00 H new ATOM 0 HG2 MET B 45 6.864 1.024 7.788 1.00 0.00 H new ATOM 0 HG3 MET B 45 8.288 0.113 7.326 1.00 0.00 H new ATOM 0 HE1 MET B 45 7.127 4.346 5.930 1.00 0.00 H new ATOM 0 HE2 MET B 45 5.978 2.993 6.050 1.00 0.00 H new ATOM 0 HE3 MET B 45 6.746 3.641 7.518 1.00 0.00 H new ATOM 2004 N TRP B 46 3.877 1.579 5.953 1.00 0.00 N ATOM 2005 CA TRP B 46 3.146 2.785 6.315 1.00 0.00 C ATOM 2006 C TRP B 46 1.947 2.435 7.184 1.00 0.00 C ATOM 2007 O TRP B 46 1.807 2.943 8.296 1.00 0.00 O ATOM 2008 CB TRP B 46 2.691 3.545 5.067 1.00 0.00 C ATOM 2009 CG TRP B 46 1.825 4.730 5.373 1.00 0.00 C ATOM 2010 CD1 TRP B 46 0.636 5.051 4.782 1.00 0.00 C ATOM 2011 CD2 TRP B 46 2.077 5.750 6.348 1.00 0.00 C ATOM 2012 NE1 TRP B 46 0.136 6.210 5.327 1.00 0.00 N ATOM 2013 CE2 TRP B 46 1.001 6.657 6.290 1.00 0.00 C ATOM 2014 CE3 TRP B 46 3.107 5.986 7.264 1.00 0.00 C ATOM 2015 CZ2 TRP B 46 0.927 7.779 7.112 1.00 0.00 C ATOM 2016 CZ3 TRP B 46 3.031 7.099 8.079 1.00 0.00 C ATOM 2017 CH2 TRP B 46 1.948 7.984 7.999 1.00 0.00 C ATOM 0 H TRP B 46 3.829 1.328 4.965 1.00 0.00 H new ATOM 0 HA TRP B 46 3.817 3.431 6.882 1.00 0.00 H new ATOM 0 HB2 TRP B 46 3.569 3.879 4.514 1.00 0.00 H new ATOM 0 HB3 TRP B 46 2.144 2.864 4.415 1.00 0.00 H new ATOM 0 HD1 TRP B 46 0.159 4.478 4.001 1.00 0.00 H new ATOM 0 HE1 TRP B 46 -0.737 6.663 5.058 1.00 0.00 H new ATOM 0 HE3 TRP B 46 3.947 5.310 7.333 1.00 0.00 H new ATOM 0 HZ2 TRP B 46 0.093 8.463 7.051 1.00 0.00 H new ATOM 0 HZ3 TRP B 46 3.821 7.290 8.791 1.00 0.00 H new ATOM 0 HH2 TRP B 46 1.919 8.845 8.650 1.00 0.00 H new ATOM 2028 N LEU B 47 1.088 1.557 6.678 1.00 0.00 N ATOM 2029 CA LEU B 47 -0.091 1.143 7.430 1.00 0.00 C ATOM 2030 C LEU B 47 0.307 0.624 8.798 1.00 0.00 C ATOM 2031 O LEU B 47 -0.328 0.933 9.805 1.00 0.00 O ATOM 2032 CB LEU B 47 -0.866 0.039 6.713 1.00 0.00 C ATOM 2033 CG LEU B 47 -0.044 -0.918 5.853 1.00 0.00 C ATOM 2034 CD1 LEU B 47 0.178 -2.217 6.606 1.00 0.00 C ATOM 2035 CD2 LEU B 47 -0.740 -1.178 4.524 1.00 0.00 C ATOM 0 H LEU B 47 1.184 1.122 5.760 1.00 0.00 H new ATOM 0 HA LEU B 47 -0.726 2.024 7.523 1.00 0.00 H new ATOM 0 HB2 LEU B 47 -1.399 -0.547 7.462 1.00 0.00 H new ATOM 0 HB3 LEU B 47 -1.619 0.507 6.079 1.00 0.00 H new ATOM 0 HG LEU B 47 0.923 -0.463 5.641 1.00 0.00 H new ATOM 0 HD11 LEU B 47 0.765 -2.899 5.990 1.00 0.00 H new ATOM 0 HD12 LEU B 47 0.713 -2.013 7.533 1.00 0.00 H new ATOM 0 HD13 LEU B 47 -0.785 -2.673 6.836 1.00 0.00 H new ATOM 0 HD21 LEU B 47 -0.138 -1.862 3.926 1.00 0.00 H new ATOM 0 HD22 LEU B 47 -1.719 -1.621 4.707 1.00 0.00 H new ATOM 0 HD23 LEU B 47 -0.862 -0.237 3.987 1.00 0.00 H new ATOM 2047 N ILE B 48 1.352 -0.187 8.819 1.00 0.00 N ATOM 2048 CA ILE B 48 1.824 -0.773 10.046 1.00 0.00 C ATOM 2049 C ILE B 48 2.302 0.282 11.023 1.00 0.00 C ATOM 2050 O ILE B 48 1.935 0.264 12.197 1.00 0.00 O ATOM 2051 CB ILE B 48 2.955 -1.770 9.749 1.00 0.00 C ATOM 2052 CG1 ILE B 48 2.455 -3.189 9.925 1.00 0.00 C ATOM 2053 CG2 ILE B 48 4.158 -1.527 10.644 1.00 0.00 C ATOM 2054 CD1 ILE B 48 1.151 -3.495 9.210 1.00 0.00 C ATOM 0 H ILE B 48 1.887 -0.451 7.991 1.00 0.00 H new ATOM 0 HA ILE B 48 0.988 -1.298 10.509 1.00 0.00 H new ATOM 0 HB ILE B 48 3.270 -1.623 8.716 1.00 0.00 H new ATOM 0 HG12 ILE B 48 3.221 -3.877 9.566 1.00 0.00 H new ATOM 0 HG13 ILE B 48 2.325 -3.385 10.989 1.00 0.00 H new ATOM 0 HG21 ILE B 48 4.939 -2.249 10.408 1.00 0.00 H new ATOM 0 HG22 ILE B 48 4.535 -0.518 10.480 1.00 0.00 H new ATOM 0 HG23 ILE B 48 3.864 -1.639 11.688 1.00 0.00 H new ATOM 0 HD11 ILE B 48 0.871 -4.532 9.392 1.00 0.00 H new ATOM 0 HD12 ILE B 48 0.367 -2.836 9.584 1.00 0.00 H new ATOM 0 HD13 ILE B 48 1.277 -3.336 8.139 1.00 0.00 H new ATOM 2066 N GLN B 49 3.134 1.189 10.544 1.00 0.00 N ATOM 2067 CA GLN B 49 3.661 2.223 11.403 1.00 0.00 C ATOM 2068 C GLN B 49 2.602 3.283 11.697 1.00 0.00 C ATOM 2069 O GLN B 49 2.762 4.094 12.609 1.00 0.00 O ATOM 2070 CB GLN B 49 4.904 2.867 10.780 1.00 0.00 C ATOM 2071 CG GLN B 49 4.603 3.774 9.595 1.00 0.00 C ATOM 2072 CD GLN B 49 5.198 5.160 9.756 1.00 0.00 C ATOM 2073 OE1 GLN B 49 5.805 5.698 8.829 1.00 0.00 O ATOM 2074 NE2 GLN B 49 5.029 5.744 10.937 1.00 0.00 N ATOM 0 H GLN B 49 3.454 1.228 9.576 1.00 0.00 H new ATOM 0 HA GLN B 49 3.949 1.759 12.346 1.00 0.00 H new ATOM 0 HB2 GLN B 49 5.423 3.445 11.544 1.00 0.00 H new ATOM 0 HB3 GLN B 49 5.586 2.080 10.458 1.00 0.00 H new ATOM 0 HG2 GLN B 49 4.993 3.318 8.685 1.00 0.00 H new ATOM 0 HG3 GLN B 49 3.523 3.858 9.471 1.00 0.00 H new ATOM 0 HE21 GLN B 49 4.519 5.261 11.677 1.00 0.00 H new ATOM 0 HE22 GLN B 49 5.409 6.676 11.104 1.00 0.00 H new ATOM 2083 N ASN B 50 1.529 3.285 10.908 1.00 0.00 N ATOM 2084 CA ASN B 50 0.461 4.263 11.082 1.00 0.00 C ATOM 2085 C ASN B 50 -0.673 3.723 11.946 1.00 0.00 C ATOM 2086 O ASN B 50 -1.008 4.303 12.975 1.00 0.00 O ATOM 2087 CB ASN B 50 -0.085 4.698 9.722 1.00 0.00 C ATOM 2088 CG ASN B 50 -0.817 6.024 9.791 1.00 0.00 C ATOM 2089 OD1 ASN B 50 -0.437 6.917 10.550 1.00 0.00 O ATOM 2090 ND2 ASN B 50 -1.873 6.160 8.997 1.00 0.00 N ATOM 0 H ASN B 50 1.378 2.623 10.146 1.00 0.00 H new ATOM 0 HA ASN B 50 0.890 5.123 11.596 1.00 0.00 H new ATOM 0 HB2 ASN B 50 0.738 4.777 9.011 1.00 0.00 H new ATOM 0 HB3 ASN B 50 -0.761 3.932 9.343 1.00 0.00 H new ATOM 0 HD21 ASN B 50 -2.405 7.030 9.000 1.00 0.00 H new ATOM 0 HD22 ASN B 50 -2.152 5.394 8.384 1.00 0.00 H new ATOM 2097 N LYS B 51 -1.274 2.627 11.508 1.00 0.00 N ATOM 2098 CA LYS B 51 -2.391 2.023 12.232 1.00 0.00 C ATOM 2099 C LYS B 51 -1.959 1.458 13.582 1.00 0.00 C ATOM 2100 O LYS B 51 -2.548 1.778 14.614 1.00 0.00 O ATOM 2101 CB LYS B 51 -3.035 0.921 11.390 1.00 0.00 C ATOM 2102 CG LYS B 51 -4.150 1.422 10.488 1.00 0.00 C ATOM 2103 CD LYS B 51 -3.600 2.043 9.212 1.00 0.00 C ATOM 2104 CE LYS B 51 -3.986 3.509 9.086 1.00 0.00 C ATOM 2105 NZ LYS B 51 -3.522 4.314 10.249 1.00 0.00 N ATOM 0 H LYS B 51 -1.009 2.135 10.655 1.00 0.00 H new ATOM 0 HA LYS B 51 -3.120 2.812 12.420 1.00 0.00 H new ATOM 0 HB2 LYS B 51 -2.268 0.447 10.777 1.00 0.00 H new ATOM 0 HB3 LYS B 51 -3.432 0.153 12.053 1.00 0.00 H new ATOM 0 HG2 LYS B 51 -4.813 0.595 10.235 1.00 0.00 H new ATOM 0 HG3 LYS B 51 -4.749 2.159 11.023 1.00 0.00 H new ATOM 0 HD2 LYS B 51 -2.514 1.951 9.202 1.00 0.00 H new ATOM 0 HD3 LYS B 51 -3.975 1.493 8.349 1.00 0.00 H new ATOM 0 HE2 LYS B 51 -3.560 3.918 8.170 1.00 0.00 H new ATOM 0 HE3 LYS B 51 -5.069 3.592 8.998 1.00 0.00 H new ATOM 0 HZ1 LYS B 51 -3.732 5.319 10.082 1.00 0.00 H new ATOM 0 HZ2 LYS B 51 -4.013 3.996 11.109 1.00 0.00 H new ATOM 0 HZ3 LYS B 51 -2.497 4.190 10.370 1.00 0.00 H new ATOM 2119 N GLU B 52 -0.937 0.608 13.568 1.00 0.00 N ATOM 2120 CA GLU B 52 -0.436 -0.012 14.793 1.00 0.00 C ATOM 2121 C GLU B 52 -0.282 1.009 15.918 1.00 0.00 C ATOM 2122 O GLU B 52 -0.549 0.710 17.082 1.00 0.00 O ATOM 2123 CB GLU B 52 0.907 -0.694 14.527 1.00 0.00 C ATOM 2124 CG GLU B 52 1.267 -1.751 15.558 1.00 0.00 C ATOM 2125 CD GLU B 52 2.301 -2.735 15.048 1.00 0.00 C ATOM 2126 OE1 GLU B 52 2.883 -3.468 15.876 1.00 0.00 O ATOM 2127 OE2 GLU B 52 2.530 -2.775 13.820 1.00 0.00 O ATOM 0 H GLU B 52 -0.438 0.332 12.722 1.00 0.00 H new ATOM 0 HA GLU B 52 -1.167 -0.756 15.110 1.00 0.00 H new ATOM 0 HB2 GLU B 52 0.882 -1.155 13.540 1.00 0.00 H new ATOM 0 HB3 GLU B 52 1.691 0.063 14.505 1.00 0.00 H new ATOM 0 HG2 GLU B 52 1.647 -1.263 16.456 1.00 0.00 H new ATOM 0 HG3 GLU B 52 0.366 -2.293 15.847 1.00 0.00 H new ATOM 2134 N LYS B 53 0.156 2.210 15.563 1.00 0.00 N ATOM 2135 CA LYS B 53 0.355 3.273 16.543 1.00 0.00 C ATOM 2136 C LYS B 53 -0.408 4.537 16.152 1.00 0.00 C ATOM 2137 O LYS B 53 0.014 5.643 16.480 1.00 0.00 O ATOM 2138 CB LYS B 53 1.844 3.588 16.688 1.00 0.00 C ATOM 2139 CG LYS B 53 2.518 3.951 15.374 1.00 0.00 C ATOM 2140 CD LYS B 53 3.202 5.309 15.448 1.00 0.00 C ATOM 2141 CE LYS B 53 2.428 6.370 14.682 1.00 0.00 C ATOM 2142 NZ LYS B 53 3.320 7.187 13.812 1.00 0.00 N ATOM 0 H LYS B 53 0.381 2.474 14.604 1.00 0.00 H new ATOM 0 HA LYS B 53 -0.033 2.922 17.499 1.00 0.00 H new ATOM 0 HB2 LYS B 53 1.966 4.413 17.390 1.00 0.00 H new ATOM 0 HB3 LYS B 53 2.350 2.724 17.120 1.00 0.00 H new ATOM 0 HG2 LYS B 53 3.252 3.187 15.119 1.00 0.00 H new ATOM 0 HG3 LYS B 53 1.777 3.960 14.575 1.00 0.00 H new ATOM 0 HD2 LYS B 53 3.299 5.611 16.491 1.00 0.00 H new ATOM 0 HD3 LYS B 53 4.211 5.231 15.043 1.00 0.00 H new ATOM 0 HE2 LYS B 53 1.663 5.891 14.070 1.00 0.00 H new ATOM 0 HE3 LYS B 53 1.911 7.022 15.386 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 2.804 7.470 12.955 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 3.626 8.036 14.329 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 4.154 6.625 13.545 1.00 0.00 H new ATOM 2156 N LEU B 54 -1.522 4.365 15.443 1.00 0.00 N ATOM 2157 CA LEU B 54 -2.336 5.497 14.993 1.00 0.00 C ATOM 2158 C LEU B 54 -2.716 6.404 16.164 1.00 0.00 C ATOM 2159 O LEU B 54 -3.647 6.107 16.912 1.00 0.00 O ATOM 2160 CB LEU B 54 -3.604 4.988 14.302 1.00 0.00 C ATOM 2161 CG LEU B 54 -4.611 6.074 13.909 1.00 0.00 C ATOM 2162 CD1 LEU B 54 -4.881 6.040 12.412 1.00 0.00 C ATOM 2163 CD2 LEU B 54 -5.908 5.908 14.689 1.00 0.00 C ATOM 0 H LEU B 54 -1.884 3.452 15.167 1.00 0.00 H new ATOM 0 HA LEU B 54 -1.744 6.079 14.287 1.00 0.00 H new ATOM 0 HB2 LEU B 54 -3.315 4.440 13.405 1.00 0.00 H new ATOM 0 HB3 LEU B 54 -4.099 4.277 14.964 1.00 0.00 H new ATOM 0 HG LEU B 54 -4.181 7.044 14.157 1.00 0.00 H new ATOM 0 HD11 LEU B 54 -5.599 6.819 12.154 1.00 0.00 H new ATOM 0 HD12 LEU B 54 -3.950 6.210 11.870 1.00 0.00 H new ATOM 0 HD13 LEU B 54 -5.288 5.067 12.138 1.00 0.00 H new ATOM 0 HD21 LEU B 54 -6.611 6.688 14.397 1.00 0.00 H new ATOM 0 HD22 LEU B 54 -6.340 4.931 14.473 1.00 0.00 H new ATOM 0 HD23 LEU B 54 -5.703 5.986 15.757 1.00 0.00 H new ATOM 2175 N PRO B 55 -1.998 7.531 16.335 1.00 0.00 N ATOM 2176 CA PRO B 55 -2.255 8.487 17.411 1.00 0.00 C ATOM 2177 C PRO B 55 -3.428 9.410 17.097 1.00 0.00 C ATOM 2178 O PRO B 55 -3.786 9.602 15.935 1.00 0.00 O ATOM 2179 CB PRO B 55 -0.948 9.296 17.506 1.00 0.00 C ATOM 2180 CG PRO B 55 -0.020 8.708 16.488 1.00 0.00 C ATOM 2181 CD PRO B 55 -0.880 7.978 15.499 1.00 0.00 C ATOM 0 HA PRO B 55 -2.525 7.984 18.340 1.00 0.00 H new ATOM 0 HB2 PRO B 55 -1.128 10.352 17.305 1.00 0.00 H new ATOM 0 HB3 PRO B 55 -0.521 9.230 18.507 1.00 0.00 H new ATOM 0 HG2 PRO B 55 0.560 9.488 15.996 1.00 0.00 H new ATOM 0 HG3 PRO B 55 0.692 8.030 16.958 1.00 0.00 H new ATOM 0 HD2 PRO B 55 -1.211 8.628 14.689 1.00 0.00 H new ATOM 0 HD3 PRO B 55 -0.353 7.141 15.041 1.00 0.00 H new ATOM 2189 N ASN B 56 -4.016 9.987 18.140 1.00 0.00 N ATOM 2190 CA ASN B 56 -5.141 10.899 17.973 1.00 0.00 C ATOM 2191 C ASN B 56 -4.665 12.257 17.459 1.00 0.00 C ATOM 2192 O ASN B 56 -5.416 12.985 16.811 1.00 0.00 O ATOM 2193 CB ASN B 56 -5.884 11.074 19.299 1.00 0.00 C ATOM 2194 CG ASN B 56 -7.245 11.717 19.119 1.00 0.00 C ATOM 2195 OD1 ASN B 56 -8.215 11.051 18.757 1.00 0.00 O ATOM 2196 ND2 ASN B 56 -7.322 13.018 19.370 1.00 0.00 N ATOM 0 H ASN B 56 -3.732 9.839 19.109 1.00 0.00 H new ATOM 0 HA ASN B 56 -5.822 10.469 17.238 1.00 0.00 H new ATOM 0 HB2 ASN B 56 -6.005 10.101 19.776 1.00 0.00 H new ATOM 0 HB3 ASN B 56 -5.282 11.686 19.971 1.00 0.00 H new ATOM 0 HD21 ASN B 56 -8.212 13.506 19.265 1.00 0.00 H new ATOM 0 HD22 ASN B 56 -6.492 13.530 19.668 1.00 0.00 H new ATOM 2203 N GLU B 57 -3.411 12.591 17.758 1.00 0.00 N ATOM 2204 CA GLU B 57 -2.833 13.860 17.330 1.00 0.00 C ATOM 2205 C GLU B 57 -2.316 13.777 15.896 1.00 0.00 C ATOM 2206 O GLU B 57 -2.260 14.782 15.190 1.00 0.00 O ATOM 2207 CB GLU B 57 -1.696 14.267 18.271 1.00 0.00 C ATOM 2208 CG GLU B 57 -0.683 13.160 18.514 1.00 0.00 C ATOM 2209 CD GLU B 57 0.726 13.691 18.701 1.00 0.00 C ATOM 2210 OE1 GLU B 57 1.292 14.226 17.725 1.00 0.00 O ATOM 2211 OE2 GLU B 57 1.261 13.571 19.822 1.00 0.00 O ATOM 0 H GLU B 57 -2.777 11.999 18.295 1.00 0.00 H new ATOM 0 HA GLU B 57 -3.618 14.615 17.366 1.00 0.00 H new ATOM 0 HB2 GLU B 57 -1.182 15.133 17.854 1.00 0.00 H new ATOM 0 HB3 GLU B 57 -2.119 14.577 19.226 1.00 0.00 H new ATOM 0 HG2 GLU B 57 -0.974 12.593 19.398 1.00 0.00 H new ATOM 0 HG3 GLU B 57 -0.698 12.467 17.672 1.00 0.00 H new ATOM 2218 N LEU B 58 -1.939 12.574 15.473 1.00 0.00 N ATOM 2219 CA LEU B 58 -1.429 12.365 14.122 1.00 0.00 C ATOM 2220 C LEU B 58 -2.567 12.350 13.106 1.00 0.00 C ATOM 2221 O LEU B 58 -2.358 12.643 11.930 1.00 0.00 O ATOM 2222 CB LEU B 58 -0.650 11.050 14.044 1.00 0.00 C ATOM 2223 CG LEU B 58 0.862 11.197 13.854 1.00 0.00 C ATOM 2224 CD1 LEU B 58 1.522 9.830 13.739 1.00 0.00 C ATOM 2225 CD2 LEU B 58 1.164 12.041 12.626 1.00 0.00 C ATOM 0 H LEU B 58 -1.977 11.730 16.045 1.00 0.00 H new ATOM 0 HA LEU B 58 -0.761 13.192 13.884 1.00 0.00 H new ATOM 0 HB2 LEU B 58 -0.832 10.484 14.958 1.00 0.00 H new ATOM 0 HB3 LEU B 58 -1.048 10.459 13.219 1.00 0.00 H new ATOM 0 HG LEU B 58 1.271 11.703 14.729 1.00 0.00 H new ATOM 0 HD11 LEU B 58 2.596 9.955 13.604 1.00 0.00 H new ATOM 0 HD12 LEU B 58 1.334 9.258 14.647 1.00 0.00 H new ATOM 0 HD13 LEU B 58 1.109 9.297 12.883 1.00 0.00 H new ATOM 0 HD21 LEU B 58 2.243 12.135 12.506 1.00 0.00 H new ATOM 0 HD22 LEU B 58 0.741 11.563 11.743 1.00 0.00 H new ATOM 0 HD23 LEU B 58 0.725 13.031 12.748 1.00 0.00 H new ATOM 2237 N LYS B 59 -3.767 12.000 13.573 1.00 0.00 N ATOM 2238 CA LYS B 59 -4.952 11.933 12.717 1.00 0.00 C ATOM 2239 C LYS B 59 -4.952 13.024 11.643 1.00 0.00 C ATOM 2240 O LYS B 59 -5.052 12.727 10.454 1.00 0.00 O ATOM 2241 CB LYS B 59 -6.221 12.042 13.566 1.00 0.00 C ATOM 2242 CG LYS B 59 -7.312 11.066 13.155 1.00 0.00 C ATOM 2243 CD LYS B 59 -8.687 11.556 13.581 1.00 0.00 C ATOM 2244 CE LYS B 59 -9.140 12.742 12.745 1.00 0.00 C ATOM 2245 NZ LYS B 59 -9.938 12.315 11.563 1.00 0.00 N ATOM 0 H LYS B 59 -3.944 11.757 14.548 1.00 0.00 H new ATOM 0 HA LYS B 59 -4.930 10.969 12.208 1.00 0.00 H new ATOM 0 HB2 LYS B 59 -5.965 11.869 14.611 1.00 0.00 H new ATOM 0 HB3 LYS B 59 -6.609 13.058 13.497 1.00 0.00 H new ATOM 0 HG2 LYS B 59 -7.292 10.930 12.074 1.00 0.00 H new ATOM 0 HG3 LYS B 59 -7.117 10.091 13.602 1.00 0.00 H new ATOM 0 HD2 LYS B 59 -9.409 10.745 13.485 1.00 0.00 H new ATOM 0 HD3 LYS B 59 -8.663 11.839 14.633 1.00 0.00 H new ATOM 0 HE2 LYS B 59 -9.736 13.414 13.362 1.00 0.00 H new ATOM 0 HE3 LYS B 59 -8.268 13.305 12.411 1.00 0.00 H new ATOM 0 HZ1 LYS B 59 -10.228 13.153 11.019 1.00 0.00 H new ATOM 0 HZ2 LYS B 59 -9.361 11.694 10.961 1.00 0.00 H new ATOM 0 HZ3 LYS B 59 -10.783 11.800 11.882 1.00 0.00 H new ATOM 2259 N PRO B 60 -4.844 14.302 12.042 1.00 0.00 N ATOM 2260 CA PRO B 60 -4.839 15.419 11.092 1.00 0.00 C ATOM 2261 C PRO B 60 -3.640 15.384 10.151 1.00 0.00 C ATOM 2262 O PRO B 60 -3.723 15.844 9.013 1.00 0.00 O ATOM 2263 CB PRO B 60 -4.786 16.663 11.987 1.00 0.00 C ATOM 2264 CG PRO B 60 -4.243 16.179 13.287 1.00 0.00 C ATOM 2265 CD PRO B 60 -4.729 14.765 13.437 1.00 0.00 C ATOM 0 HA PRO B 60 -5.710 15.391 10.437 1.00 0.00 H new ATOM 0 HB2 PRO B 60 -4.147 17.433 11.555 1.00 0.00 H new ATOM 0 HB3 PRO B 60 -5.776 17.102 12.112 1.00 0.00 H new ATOM 0 HG2 PRO B 60 -3.154 16.220 13.295 1.00 0.00 H new ATOM 0 HG3 PRO B 60 -4.591 16.801 14.111 1.00 0.00 H new ATOM 0 HD2 PRO B 60 -4.028 14.156 14.007 1.00 0.00 H new ATOM 0 HD3 PRO B 60 -5.686 14.721 13.957 1.00 0.00 H new ATOM 2273 N LYS B 61 -2.528 14.836 10.627 1.00 0.00 N ATOM 2274 CA LYS B 61 -1.323 14.747 9.811 1.00 0.00 C ATOM 2275 C LYS B 61 -1.529 13.784 8.648 1.00 0.00 C ATOM 2276 O LYS B 61 -0.901 13.926 7.600 1.00 0.00 O ATOM 2277 CB LYS B 61 -0.126 14.303 10.649 1.00 0.00 C ATOM 2278 CG LYS B 61 1.212 14.572 9.976 1.00 0.00 C ATOM 2279 CD LYS B 61 1.667 13.384 9.141 1.00 0.00 C ATOM 2280 CE LYS B 61 2.926 12.750 9.710 1.00 0.00 C ATOM 2281 NZ LYS B 61 4.162 13.352 9.136 1.00 0.00 N ATOM 0 H LYS B 61 -2.436 14.449 11.566 1.00 0.00 H new ATOM 0 HA LYS B 61 -1.118 15.741 9.413 1.00 0.00 H new ATOM 0 HB2 LYS B 61 -0.152 14.818 11.609 1.00 0.00 H new ATOM 0 HB3 LYS B 61 -0.212 13.237 10.857 1.00 0.00 H new ATOM 0 HG2 LYS B 61 1.130 15.454 9.341 1.00 0.00 H new ATOM 0 HG3 LYS B 61 1.963 14.794 10.734 1.00 0.00 H new ATOM 0 HD2 LYS B 61 0.871 12.641 9.101 1.00 0.00 H new ATOM 0 HD3 LYS B 61 1.853 13.708 8.117 1.00 0.00 H new ATOM 0 HE2 LYS B 61 2.934 12.869 10.793 1.00 0.00 H new ATOM 0 HE3 LYS B 61 2.916 11.679 9.507 1.00 0.00 H new ATOM 0 HZ1 LYS B 61 4.997 12.891 9.550 1.00 0.00 H new ATOM 0 HZ2 LYS B 61 4.168 13.216 8.105 1.00 0.00 H new ATOM 0 HZ3 LYS B 61 4.185 14.369 9.351 1.00 0.00 H new ATOM 2295 N ILE B 62 -2.422 12.809 8.827 1.00 0.00 N ATOM 2296 CA ILE B 62 -2.706 11.846 7.770 1.00 0.00 C ATOM 2297 C ILE B 62 -3.056 12.588 6.486 1.00 0.00 C ATOM 2298 O ILE B 62 -2.676 12.177 5.389 1.00 0.00 O ATOM 2299 CB ILE B 62 -3.848 10.879 8.174 1.00 0.00 C ATOM 2300 CG1 ILE B 62 -3.286 9.719 8.998 1.00 0.00 C ATOM 2301 CG2 ILE B 62 -4.584 10.347 6.949 1.00 0.00 C ATOM 2302 CD1 ILE B 62 -2.338 10.158 10.092 1.00 0.00 C ATOM 0 H ILE B 62 -2.954 12.669 9.686 1.00 0.00 H new ATOM 0 HA ILE B 62 -1.814 11.241 7.605 1.00 0.00 H new ATOM 0 HB ILE B 62 -4.564 11.436 8.779 1.00 0.00 H new ATOM 0 HG12 ILE B 62 -4.113 9.167 9.445 1.00 0.00 H new ATOM 0 HG13 ILE B 62 -2.766 9.030 8.333 1.00 0.00 H new ATOM 0 HG21 ILE B 62 -5.379 9.672 7.267 1.00 0.00 H new ATOM 0 HG22 ILE B 62 -5.016 11.180 6.394 1.00 0.00 H new ATOM 0 HG23 ILE B 62 -3.884 9.809 6.310 1.00 0.00 H new ATOM 0 HD11 ILE B 62 -1.979 9.284 10.635 1.00 0.00 H new ATOM 0 HD12 ILE B 62 -1.491 10.684 9.651 1.00 0.00 H new ATOM 0 HD13 ILE B 62 -2.860 10.823 10.780 1.00 0.00 H new ATOM 2314 N ASP B 63 -3.744 13.716 6.640 1.00 0.00 N ATOM 2315 CA ASP B 63 -4.096 14.545 5.504 1.00 0.00 C ATOM 2316 C ASP B 63 -2.813 15.103 4.915 1.00 0.00 C ATOM 2317 O ASP B 63 -2.642 15.163 3.699 1.00 0.00 O ATOM 2318 CB ASP B 63 -5.032 15.678 5.932 1.00 0.00 C ATOM 2319 CG ASP B 63 -6.447 15.481 5.423 1.00 0.00 C ATOM 2320 OD1 ASP B 63 -6.715 15.843 4.258 1.00 0.00 O ATOM 2321 OD2 ASP B 63 -7.287 14.966 6.192 1.00 0.00 O ATOM 0 H ASP B 63 -4.066 14.072 7.540 1.00 0.00 H new ATOM 0 HA ASP B 63 -4.623 13.952 4.757 1.00 0.00 H new ATOM 0 HB2 ASP B 63 -5.046 15.743 7.020 1.00 0.00 H new ATOM 0 HB3 ASP B 63 -4.644 16.626 5.561 1.00 0.00 H new ATOM 2326 N GLU B 64 -1.895 15.473 5.809 1.00 0.00 N ATOM 2327 CA GLU B 64 -0.596 15.991 5.413 1.00 0.00 C ATOM 2328 C GLU B 64 0.131 14.952 4.571 1.00 0.00 C ATOM 2329 O GLU B 64 0.628 15.249 3.491 1.00 0.00 O ATOM 2330 CB GLU B 64 0.232 16.349 6.651 1.00 0.00 C ATOM 2331 CG GLU B 64 0.572 17.827 6.752 1.00 0.00 C ATOM 2332 CD GLU B 64 -0.307 18.560 7.746 1.00 0.00 C ATOM 2333 OE1 GLU B 64 -1.546 18.479 7.616 1.00 0.00 O ATOM 2334 OE2 GLU B 64 0.245 19.214 8.655 1.00 0.00 O ATOM 0 H GLU B 64 -2.034 15.421 6.818 1.00 0.00 H new ATOM 0 HA GLU B 64 -0.736 16.895 4.821 1.00 0.00 H new ATOM 0 HB2 GLU B 64 -0.317 16.050 7.544 1.00 0.00 H new ATOM 0 HB3 GLU B 64 1.157 15.772 6.638 1.00 0.00 H new ATOM 0 HG2 GLU B 64 1.616 17.937 7.046 1.00 0.00 H new ATOM 0 HG3 GLU B 64 0.467 18.288 5.770 1.00 0.00 H new ATOM 2341 N ILE B 65 0.160 13.720 5.070 1.00 0.00 N ATOM 2342 CA ILE B 65 0.797 12.614 4.364 1.00 0.00 C ATOM 2343 C ILE B 65 0.282 12.532 2.929 1.00 0.00 C ATOM 2344 O ILE B 65 1.035 12.230 2.004 1.00 0.00 O ATOM 2345 CB ILE B 65 0.520 11.272 5.078 1.00 0.00 C ATOM 2346 CG1 ILE B 65 1.050 11.315 6.514 1.00 0.00 C ATOM 2347 CG2 ILE B 65 1.144 10.114 4.312 1.00 0.00 C ATOM 2348 CD1 ILE B 65 2.558 11.413 6.594 1.00 0.00 C ATOM 0 H ILE B 65 -0.253 13.462 5.966 1.00 0.00 H new ATOM 0 HA ILE B 65 1.871 12.799 4.357 1.00 0.00 H new ATOM 0 HB ILE B 65 -0.558 11.115 5.110 1.00 0.00 H new ATOM 0 HG12 ILE B 65 0.610 12.168 7.031 1.00 0.00 H new ATOM 0 HG13 ILE B 65 0.723 10.419 7.041 1.00 0.00 H new ATOM 0 HG21 ILE B 65 0.936 9.179 4.833 1.00 0.00 H new ATOM 0 HG22 ILE B 65 0.721 10.072 3.308 1.00 0.00 H new ATOM 0 HG23 ILE B 65 2.222 10.261 4.246 1.00 0.00 H new ATOM 0 HD11 ILE B 65 2.866 11.439 7.639 1.00 0.00 H new ATOM 0 HD12 ILE B 65 3.005 10.547 6.106 1.00 0.00 H new ATOM 0 HD13 ILE B 65 2.890 12.323 6.095 1.00 0.00 H new ATOM 2360 N SER B 66 -1.010 12.803 2.758 1.00 0.00 N ATOM 2361 CA SER B 66 -1.637 12.758 1.442 1.00 0.00 C ATOM 2362 C SER B 66 -1.388 14.041 0.652 1.00 0.00 C ATOM 2363 O SER B 66 -0.866 13.998 -0.462 1.00 0.00 O ATOM 2364 CB SER B 66 -3.142 12.520 1.583 1.00 0.00 C ATOM 2365 OG SER B 66 -3.621 13.008 2.825 1.00 0.00 O ATOM 0 H SER B 66 -1.643 13.056 3.517 1.00 0.00 H new ATOM 0 HA SER B 66 -1.186 11.932 0.891 1.00 0.00 H new ATOM 0 HB2 SER B 66 -3.670 13.014 0.767 1.00 0.00 H new ATOM 0 HB3 SER B 66 -3.354 11.454 1.501 1.00 0.00 H new ATOM 0 HG SER B 66 -3.477 13.976 2.874 1.00 0.00 H new ATOM 2371 N LYS B 67 -1.773 15.178 1.223 1.00 0.00 N ATOM 2372 CA LYS B 67 -1.594 16.463 0.553 1.00 0.00 C ATOM 2373 C LYS B 67 -0.115 16.767 0.323 1.00 0.00 C ATOM 2374 O LYS B 67 0.238 17.485 -0.613 1.00 0.00 O ATOM 2375 CB LYS B 67 -2.244 17.588 1.363 1.00 0.00 C ATOM 2376 CG LYS B 67 -1.890 17.556 2.839 1.00 0.00 C ATOM 2377 CD LYS B 67 -1.265 18.865 3.296 1.00 0.00 C ATOM 2378 CE LYS B 67 -1.844 19.330 4.623 1.00 0.00 C ATOM 2379 NZ LYS B 67 -1.268 20.633 5.055 1.00 0.00 N ATOM 0 H LYS B 67 -2.209 15.237 2.143 1.00 0.00 H new ATOM 0 HA LYS B 67 -2.083 16.401 -0.419 1.00 0.00 H new ATOM 0 HB2 LYS B 67 -1.940 18.548 0.946 1.00 0.00 H new ATOM 0 HB3 LYS B 67 -3.327 17.523 1.256 1.00 0.00 H new ATOM 0 HG2 LYS B 67 -2.788 17.358 3.424 1.00 0.00 H new ATOM 0 HG3 LYS B 67 -1.198 16.736 3.029 1.00 0.00 H new ATOM 0 HD2 LYS B 67 -0.187 18.739 3.393 1.00 0.00 H new ATOM 0 HD3 LYS B 67 -1.430 19.631 2.538 1.00 0.00 H new ATOM 0 HE2 LYS B 67 -2.926 19.423 4.534 1.00 0.00 H new ATOM 0 HE3 LYS B 67 -1.651 18.577 5.387 1.00 0.00 H new ATOM 0 HZ1 LYS B 67 -1.689 20.914 5.963 1.00 0.00 H new ATOM 0 HZ2 LYS B 67 -0.238 20.538 5.165 1.00 0.00 H new ATOM 0 HZ3 LYS B 67 -1.474 21.358 4.339 1.00 0.00 H new ATOM 2393 N ARG B 68 0.745 16.215 1.173 1.00 0.00 N ATOM 2394 CA ARG B 68 2.182 16.432 1.045 1.00 0.00 C ATOM 2395 C ARG B 68 2.794 15.433 0.072 1.00 0.00 C ATOM 2396 O ARG B 68 3.755 15.748 -0.627 1.00 0.00 O ATOM 2397 CB ARG B 68 2.875 16.324 2.406 1.00 0.00 C ATOM 2398 CG ARG B 68 2.445 17.397 3.393 1.00 0.00 C ATOM 2399 CD ARG B 68 3.092 17.196 4.756 1.00 0.00 C ATOM 2400 NE ARG B 68 3.561 18.455 5.331 1.00 0.00 N ATOM 2401 CZ ARG B 68 4.693 19.057 4.975 1.00 0.00 C ATOM 2402 NH1 ARG B 68 5.474 18.522 4.046 1.00 0.00 N ATOM 2403 NH2 ARG B 68 5.046 20.198 5.551 1.00 0.00 N ATOM 0 H ARG B 68 0.474 15.617 1.954 1.00 0.00 H new ATOM 0 HA ARG B 68 2.332 17.439 0.656 1.00 0.00 H new ATOM 0 HB2 ARG B 68 2.667 15.343 2.834 1.00 0.00 H new ATOM 0 HB3 ARG B 68 3.954 16.386 2.261 1.00 0.00 H new ATOM 0 HG2 ARG B 68 2.713 18.379 3.003 1.00 0.00 H new ATOM 0 HG3 ARG B 68 1.360 17.381 3.499 1.00 0.00 H new ATOM 0 HD2 ARG B 68 2.374 16.733 5.433 1.00 0.00 H new ATOM 0 HD3 ARG B 68 3.931 16.506 4.661 1.00 0.00 H new ATOM 0 HE ARG B 68 2.987 18.899 6.048 1.00 0.00 H new ATOM 0 HH11 ARG B 68 5.208 17.644 3.600 1.00 0.00 H new ATOM 0 HH12 ARG B 68 6.340 18.989 3.778 1.00 0.00 H new ATOM 0 HH21 ARG B 68 4.450 20.614 6.267 1.00 0.00 H new ATOM 0 HH22 ARG B 68 5.914 20.660 5.278 1.00 0.00 H new ATOM 2417 N PHE B 69 2.229 14.227 0.025 1.00 0.00 N ATOM 2418 CA PHE B 69 2.727 13.192 -0.877 1.00 0.00 C ATOM 2419 C PHE B 69 2.798 13.732 -2.305 1.00 0.00 C ATOM 2420 O PHE B 69 3.688 13.372 -3.076 1.00 0.00 O ATOM 2421 CB PHE B 69 1.838 11.938 -0.793 1.00 0.00 C ATOM 2422 CG PHE B 69 1.279 11.472 -2.113 1.00 0.00 C ATOM 2423 CD1 PHE B 69 -0.078 11.566 -2.377 1.00 0.00 C ATOM 2424 CD2 PHE B 69 2.111 10.940 -3.086 1.00 0.00 C ATOM 2425 CE1 PHE B 69 -0.595 11.139 -3.586 1.00 0.00 C ATOM 2426 CE2 PHE B 69 1.601 10.512 -4.296 1.00 0.00 C ATOM 2427 CZ PHE B 69 0.245 10.611 -4.546 1.00 0.00 C ATOM 0 H PHE B 69 1.433 13.945 0.596 1.00 0.00 H new ATOM 0 HA PHE B 69 3.734 12.906 -0.574 1.00 0.00 H new ATOM 0 HB2 PHE B 69 2.418 11.127 -0.353 1.00 0.00 H new ATOM 0 HB3 PHE B 69 1.009 12.142 -0.115 1.00 0.00 H new ATOM 0 HD1 PHE B 69 -0.740 11.978 -1.629 1.00 0.00 H new ATOM 0 HD2 PHE B 69 3.171 10.859 -2.895 1.00 0.00 H new ATOM 0 HE1 PHE B 69 -1.655 11.218 -3.779 1.00 0.00 H new ATOM 0 HE2 PHE B 69 2.261 10.101 -5.046 1.00 0.00 H new ATOM 0 HZ PHE B 69 -0.157 10.276 -5.491 1.00 0.00 H new ATOM 2437 N PHE B 70 1.861 14.612 -2.637 1.00 0.00 N ATOM 2438 CA PHE B 70 1.816 15.227 -3.956 1.00 0.00 C ATOM 2439 C PHE B 70 2.142 16.713 -3.844 1.00 0.00 C ATOM 2440 O PHE B 70 1.251 17.561 -3.907 1.00 0.00 O ATOM 2441 CB PHE B 70 0.437 15.035 -4.590 1.00 0.00 C ATOM 2442 CG PHE B 70 0.442 15.154 -6.088 1.00 0.00 C ATOM 2443 CD1 PHE B 70 0.924 14.122 -6.876 1.00 0.00 C ATOM 2444 CD2 PHE B 70 -0.036 16.297 -6.706 1.00 0.00 C ATOM 2445 CE1 PHE B 70 0.929 14.227 -8.254 1.00 0.00 C ATOM 2446 CE2 PHE B 70 -0.034 16.409 -8.084 1.00 0.00 C ATOM 2447 CZ PHE B 70 0.450 15.373 -8.859 1.00 0.00 C ATOM 0 H PHE B 70 1.119 14.916 -2.007 1.00 0.00 H new ATOM 0 HA PHE B 70 2.557 14.746 -4.594 1.00 0.00 H new ATOM 0 HB2 PHE B 70 0.052 14.053 -4.313 1.00 0.00 H new ATOM 0 HB3 PHE B 70 -0.250 15.774 -4.177 1.00 0.00 H new ATOM 0 HD1 PHE B 70 1.300 13.224 -6.408 1.00 0.00 H new ATOM 0 HD2 PHE B 70 -0.415 17.110 -6.105 1.00 0.00 H new ATOM 0 HE1 PHE B 70 1.307 13.415 -8.857 1.00 0.00 H new ATOM 0 HE2 PHE B 70 -0.410 17.306 -8.554 1.00 0.00 H new ATOM 0 HZ PHE B 70 0.454 15.459 -9.936 1.00 0.00 H new ATOM 2457 N PRO B 71 3.432 17.047 -3.665 1.00 0.00 N ATOM 2458 CA PRO B 71 3.878 18.436 -3.528 1.00 0.00 C ATOM 2459 C PRO B 71 3.858 19.188 -4.855 1.00 0.00 C ATOM 2460 O PRO B 71 3.822 18.579 -5.924 1.00 0.00 O ATOM 2461 CB PRO B 71 5.309 18.291 -3.014 1.00 0.00 C ATOM 2462 CG PRO B 71 5.769 16.982 -3.554 1.00 0.00 C ATOM 2463 CD PRO B 71 4.556 16.093 -3.572 1.00 0.00 C ATOM 0 HA PRO B 71 3.228 19.013 -2.870 1.00 0.00 H new ATOM 0 HB2 PRO B 71 5.941 19.108 -3.363 1.00 0.00 H new ATOM 0 HB3 PRO B 71 5.343 18.305 -1.925 1.00 0.00 H new ATOM 0 HG2 PRO B 71 6.184 17.097 -4.555 1.00 0.00 H new ATOM 0 HG3 PRO B 71 6.555 16.557 -2.930 1.00 0.00 H new ATOM 0 HD2 PRO B 71 4.573 15.408 -4.420 1.00 0.00 H new ATOM 0 HD3 PRO B 71 4.492 15.483 -2.671 1.00 0.00 H new ATOM 2471 N ALA B 72 3.879 20.515 -4.778 1.00 0.00 N ATOM 2472 CA ALA B 72 3.863 21.351 -5.973 1.00 0.00 C ATOM 2473 C ALA B 72 5.075 22.276 -6.011 1.00 0.00 C ATOM 2474 O ALA B 72 5.459 22.854 -4.993 1.00 0.00 O ATOM 2475 CB ALA B 72 2.577 22.160 -6.033 1.00 0.00 C ATOM 0 H ALA B 72 3.907 21.034 -3.901 1.00 0.00 H new ATOM 0 HA ALA B 72 3.909 20.698 -6.845 1.00 0.00 H new ATOM 0 HB1 ALA B 72 2.578 22.779 -6.930 1.00 0.00 H new ATOM 0 HB2 ALA B 72 1.723 21.484 -6.060 1.00 0.00 H new ATOM 0 HB3 ALA B 72 2.507 22.798 -5.152 1.00 0.00 H new ATOM 2481 N LYS B 73 5.672 22.414 -7.190 1.00 0.00 N ATOM 2482 CA LYS B 73 6.840 23.269 -7.362 1.00 0.00 C ATOM 2483 C LYS B 73 8.001 22.783 -6.497 1.00 0.00 C ATOM 2484 O LYS B 73 8.065 23.183 -5.316 1.00 0.00 O ATOM 2485 CB LYS B 73 6.493 24.719 -7.009 1.00 0.00 C ATOM 2486 CG LYS B 73 6.719 25.692 -8.154 1.00 0.00 C ATOM 2487 CD LYS B 73 5.809 26.905 -8.041 1.00 0.00 C ATOM 2488 CE LYS B 73 4.372 26.558 -8.394 1.00 0.00 C ATOM 2489 NZ LYS B 73 4.154 26.524 -9.866 1.00 0.00 N ATOM 2490 OXT LYS B 73 8.835 22.008 -7.009 1.00 0.00 O ATOM 0 H LYS B 73 5.365 21.944 -8.042 1.00 0.00 H new ATOM 0 HA LYS B 73 7.146 23.221 -8.407 1.00 0.00 H new ATOM 0 HB2 LYS B 73 5.449 24.770 -6.700 1.00 0.00 H new ATOM 0 HB3 LYS B 73 7.093 25.030 -6.154 1.00 0.00 H new ATOM 0 HG2 LYS B 73 7.760 26.016 -8.158 1.00 0.00 H new ATOM 0 HG3 LYS B 73 6.538 25.187 -9.103 1.00 0.00 H new ATOM 0 HD2 LYS B 73 5.850 27.299 -7.025 1.00 0.00 H new ATOM 0 HD3 LYS B 73 6.167 27.693 -8.703 1.00 0.00 H new ATOM 0 HE2 LYS B 73 4.118 25.588 -7.967 1.00 0.00 H new ATOM 0 HE3 LYS B 73 3.701 27.290 -7.945 1.00 0.00 H new ATOM 0 HZ1 LYS B 73 3.162 26.284 -10.065 1.00 0.00 H new ATOM 0 HZ2 LYS B 73 4.372 27.457 -10.271 1.00 0.00 H new ATOM 0 HZ3 LYS B 73 4.776 25.808 -10.293 1.00 0.00 H new TER 2504 LYS B 73