USER MOD reduce.3.24.130724 H: found=0, std=0, add=1436, rem=0, adj=49 USER MOD reduce.3.24.130724 removed 1436 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 72 HIS : no HE2:sc= -10.4! C(o=-13!,f=-8.7!) USER MOD Set 1.2: B 87 LYS NZ :NH3+ 163:sc= -2.31 (180deg=-1.54!) USER MOD Set 2.1: B 64 SER OG : rot -93:sc= -1.33! USER MOD Set 2.2: B 75 TYR OH : rot 34:sc= 1.5 USER MOD Set 3.1: B 27 GLN : amide:sc= -1.19 K(o=-1.4,f=-0.2) USER MOD Set 3.2: B 31 LYS NZ :NH3+ 171:sc= -0.186 (180deg=0) USER MOD Set 4.1: B 24 CYS SG : rot 78:sc= 0.114 USER MOD Set 4.2: B 50 TYR OH : rot 164:sc= -0.966 USER MOD Set 5.1: A 88 SER OG : rot -55:sc= 0.721! USER MOD Set 5.2: B 88 SER OG : rot 173:sc= -0.998! USER MOD Set 6.1: A 64 SER OG : rot -136:sc= -0.369 USER MOD Set 6.2: A 75 TYR OH : rot 13:sc= 0.0753 USER MOD Set 7.1: A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 7.2: A 50 TYR OH : rot 45:sc= -0.0621 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -167:sc= -0.0576 (180deg=-0.364) USER MOD Single : A 2 CYS SG : rot 180:sc= 0.00282 USER MOD Single : A 5 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 ASN : amide:sc= -3.99! K(o=-4!,f=-0.48) USER MOD Single : A 13 MET CE :methyl -140:sc= -2.43! (180deg=-4.12!) USER MOD Single : A 14 SER OG : rot 180:sc= -0.111 USER MOD Single : A 17 MET CE :methyl -151:sc= -8.25! (180deg=-12.5!) USER MOD Single : A 18 GLN : amide:sc= -19.8! C(o=-20!,f=-17!) USER MOD Single : A 19 GLN : amide:sc= -1.99! C(o=-2!,f=-8.7!) USER MOD Single : A 21 SER OG : rot -82:sc= -3.22! USER MOD Single : A 24 CYS SG : rot 100:sc= -1.1 USER MOD Single : A 26 THR OG1 : rot 70:sc= -1.01! USER MOD Single : A 27 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 ASN : amide:sc= -0.214 K(o=-0.21,f=-3.6!) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 HIS : no HE2:sc= -21.8! C(o=-22!,f=-26!) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ -165:sc= 0 (180deg=-0.187) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 ASN : amide:sc= -2.01! C(o=-2!,f=-4.1!) USER MOD Single : A 53 THR OG1 : rot 180:sc= -0.0061 USER MOD Single : A 55 HIS : no HD1:sc= -12.5! C(o=-13!,f=-17!) USER MOD Single : A 56 CYS SG : rot 75:sc= -4.35! USER MOD Single : A 61 ASN : amide:sc= -0.0712 X(o=-0.071,f=-0.4) USER MOD Single : A 65 TYR OH : rot 30:sc= 0 USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HD1:sc= -7.28! C(o=-7.3!,f=-9.6!) USER MOD Single : A 70 THR OG1 : rot 180:sc= -0.889! USER MOD Single : A 71 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0318) USER MOD Single : A 72 HIS : no HD1:sc= -3.01! K(o=-3!,f=-1.4) USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 GLN : amide:sc= -1.97! C(o=-2!,f=0.28!) USER MOD Single : A 87 LYS NZ :NH3+ -146:sc= -0.0921 (180deg=-2.28!) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 2 CYS SG : 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+ 180:sc= 0 (180deg=0) USER MOD Single : B 10 ASN : amide:sc= -3.39! K(o=-3.4!,f=-0.49) USER MOD Single : B 13 MET CE :methyl 156:sc= -1.14 (180deg=-2.41!) USER MOD Single : B 14 SER OG : rot 180:sc= 0 USER MOD Single : B 17 MET CE :methyl 160:sc= -4.02 (180deg=-6.85!) USER MOD Single : B 18 GLN : amide:sc= -12.8! C(o=-13!,f=-12!) USER MOD Single : B 19 GLN : amide:sc= -0.0169 X(o=-0.017,f=-0.46) USER MOD Single : B 21 SER OG : rot 83:sc= -7.82! USER MOD Single : B 26 THR OG1 : rot 58:sc= -1.17! USER MOD Single : B 32 TYR OH : rot 180:sc= 0 USER MOD Single : B 33 ASN : amide:sc= -3.11! K(o=-3.1!,f=-0.45) USER MOD Single : B 36 LYS NZ :NH3+ 148:sc= -0.038 (180deg=-0.777) USER MOD Single : B 41 HIS : no HD1:sc= -20! C(o=-20!,f=-22!) USER MOD Single : B 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 44 LYS NZ :NH3+ -171:sc= -2.84! (180deg=-3.05!) USER MOD Single : B 48 LYS NZ :NH3+ 138:sc= -2.42! (180deg=-4.32!) USER MOD Single : B 49 LYS NZ :NH3+ -130:sc= 0.458 (180deg=0) USER MOD Single : B 51 ASN : amide:sc= -1.6! K(o=-1.6!,f=0) USER MOD Single : B 53 THR OG1 : rot 180:sc= 0 USER MOD Single : B 55 HIS : no HE2:sc= -11.8! C(o=-12!,f=-21!) USER MOD Single : B 56 CYS SG : rot -30:sc= -7.15! USER MOD Single : B 61 ASN : amide:sc= -6.99! K(o=-7!,f=-1.3) USER MOD Single : B 65 TYR OH : rot 180:sc= 0 USER MOD Single : B 67 THR OG1 : rot 180:sc= 0 USER MOD Single : B 68 HIS : no HD1:sc= -5.22! C(o=-5.2!,f=-5.3!) USER MOD Single : B 70 THR OG1 : rot 180:sc= 0 USER MOD Single : B 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 77 TYR OH : rot 180:sc= -2.57! USER MOD Single : B 80 GLN : amide:sc= -0.285 X(o=-0.28,f=-0.00094) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -26.587 4.721 2.197 1.00 0.00 N ATOM 2 CA MET A 1 -26.196 5.776 1.228 1.00 0.00 C ATOM 3 C MET A 1 -25.335 6.847 1.892 1.00 0.00 C ATOM 4 O MET A 1 -24.548 7.523 1.231 1.00 0.00 O ATOM 5 CB MET A 1 -27.466 6.402 0.650 1.00 0.00 C ATOM 6 CG MET A 1 -28.235 5.471 -0.274 1.00 0.00 C ATOM 7 SD MET A 1 -27.330 5.092 -1.786 1.00 0.00 S ATOM 8 CE MET A 1 -27.953 3.453 -2.148 1.00 0.00 C ATOM 0 H1 MET A 1 -26.977 3.905 1.683 1.00 0.00 H new ATOM 0 H2 MET A 1 -25.752 4.421 2.740 1.00 0.00 H new ATOM 0 H3 MET A 1 -27.306 5.097 2.848 1.00 0.00 H new ATOM 0 HA MET A 1 -25.602 5.327 0.432 1.00 0.00 H new ATOM 0 HB2 MET A 1 -28.117 6.707 1.470 1.00 0.00 H new ATOM 0 HB3 MET A 1 -27.199 7.306 0.102 1.00 0.00 H new ATOM 0 HG2 MET A 1 -28.458 4.544 0.254 1.00 0.00 H new ATOM 0 HG3 MET A 1 -29.190 5.928 -0.532 1.00 0.00 H new ATOM 0 HE1 MET A 1 -27.486 3.079 -3.059 1.00 0.00 H new ATOM 0 HE2 MET A 1 -27.719 2.784 -1.320 1.00 0.00 H new ATOM 0 HE3 MET A 1 -29.033 3.497 -2.285 1.00 0.00 H new ATOM 20 N CYS A 2 -25.490 6.996 3.204 1.00 0.00 N ATOM 21 CA CYS A 2 -24.727 7.986 3.956 1.00 0.00 C ATOM 22 C CYS A 2 -23.610 7.320 4.757 1.00 0.00 C ATOM 23 O CYS A 2 -22.657 6.793 4.185 1.00 0.00 O ATOM 24 CB CYS A 2 -25.651 8.771 4.891 1.00 0.00 C ATOM 25 SG CYS A 2 -27.404 8.659 4.463 1.00 0.00 S ATOM 0 H CYS A 2 -26.137 6.444 3.768 1.00 0.00 H new ATOM 0 HA CYS A 2 -24.274 8.677 3.245 1.00 0.00 H new ATOM 0 HB2 CYS A 2 -25.513 8.408 5.909 1.00 0.00 H new ATOM 0 HB3 CYS A 2 -25.352 9.819 4.883 1.00 0.00 H new ATOM 0 HG CYS A 2 -28.103 9.353 5.312 1.00 0.00 H new ATOM 31 N ASP A 3 -23.733 7.350 6.081 1.00 0.00 N ATOM 32 CA ASP A 3 -22.730 6.749 6.955 1.00 0.00 C ATOM 33 C ASP A 3 -21.344 6.841 6.327 1.00 0.00 C ATOM 34 O ASP A 3 -20.606 5.857 6.278 1.00 0.00 O ATOM 35 CB ASP A 3 -23.081 5.287 7.241 1.00 0.00 C ATOM 36 CG ASP A 3 -23.178 4.457 5.975 1.00 0.00 C ATOM 37 OD1 ASP A 3 -22.134 3.950 5.515 1.00 0.00 O ATOM 38 OD2 ASP A 3 -24.300 4.314 5.446 1.00 0.00 O ATOM 0 H ASP A 3 -24.515 7.783 6.571 1.00 0.00 H new ATOM 0 HA ASP A 3 -22.722 7.300 7.895 1.00 0.00 H new ATOM 0 HB2 ASP A 3 -22.325 4.856 7.897 1.00 0.00 H new ATOM 0 HB3 ASP A 3 -24.030 5.242 7.775 1.00 0.00 H new ATOM 43 N ARG A 4 -20.999 8.030 5.845 1.00 0.00 N ATOM 44 CA ARG A 4 -19.704 8.258 5.214 1.00 0.00 C ATOM 45 C ARG A 4 -18.571 7.669 6.049 1.00 0.00 C ATOM 46 O ARG A 4 -17.729 6.931 5.537 1.00 0.00 O ATOM 47 CB ARG A 4 -19.473 9.755 5.003 1.00 0.00 C ATOM 48 CG ARG A 4 -20.571 10.430 4.198 1.00 0.00 C ATOM 49 CD ARG A 4 -20.586 9.939 2.760 1.00 0.00 C ATOM 50 NE ARG A 4 -21.203 10.908 1.859 1.00 0.00 N ATOM 51 CZ ARG A 4 -21.765 10.582 0.699 1.00 0.00 C ATOM 52 NH1 ARG A 4 -21.786 9.316 0.303 1.00 0.00 N ATOM 53 NH2 ARG A 4 -22.304 11.521 -0.065 1.00 0.00 N ATOM 0 H ARG A 4 -21.600 8.853 5.879 1.00 0.00 H new ATOM 0 HA ARG A 4 -19.711 7.756 4.246 1.00 0.00 H new ATOM 0 HB2 ARG A 4 -19.393 10.243 5.975 1.00 0.00 H new ATOM 0 HB3 ARG A 4 -18.520 9.899 4.495 1.00 0.00 H new ATOM 0 HG2 ARG A 4 -21.538 10.233 4.661 1.00 0.00 H new ATOM 0 HG3 ARG A 4 -20.424 11.510 4.214 1.00 0.00 H new ATOM 0 HD2 ARG A 4 -19.565 9.739 2.434 1.00 0.00 H new ATOM 0 HD3 ARG A 4 -21.129 8.995 2.704 1.00 0.00 H new ATOM 0 HE ARG A 4 -21.203 11.890 2.135 1.00 0.00 H new ATOM 0 HH11 ARG A 4 -21.371 8.591 0.889 1.00 0.00 H new ATOM 0 HH12 ARG A 4 -22.217 9.067 -0.587 1.00 0.00 H new ATOM 0 HH21 ARG A 4 -22.288 12.495 0.237 1.00 0.00 H new ATOM 0 HH22 ARG A 4 -22.735 11.270 -0.955 1.00 0.00 H new ATOM 67 N LYS A 5 -18.554 8.000 7.336 1.00 0.00 N ATOM 68 CA LYS A 5 -17.521 7.503 8.236 1.00 0.00 C ATOM 69 C LYS A 5 -16.140 7.957 7.773 1.00 0.00 C ATOM 70 O LYS A 5 -16.020 8.827 6.910 1.00 0.00 O ATOM 71 CB LYS A 5 -17.569 5.975 8.311 1.00 0.00 C ATOM 72 CG LYS A 5 -18.849 5.434 8.928 1.00 0.00 C ATOM 73 CD LYS A 5 -18.898 5.691 10.426 1.00 0.00 C ATOM 74 CE LYS A 5 -17.838 4.889 11.165 1.00 0.00 C ATOM 75 NZ LYS A 5 -18.353 3.567 11.615 1.00 0.00 N ATOM 0 H LYS A 5 -19.243 8.609 7.778 1.00 0.00 H new ATOM 0 HA LYS A 5 -17.709 7.912 9.229 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -17.460 5.567 7.306 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -16.718 5.622 8.893 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -19.710 5.900 8.449 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -18.921 4.363 8.739 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -18.751 6.754 10.619 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -19.885 5.431 10.809 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -16.976 4.740 10.514 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -17.491 5.456 12.029 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -17.599 3.052 12.114 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -19.159 3.709 12.257 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -18.661 3.015 10.789 1.00 0.00 H new ATOM 89 N ALA A 6 -15.103 7.361 8.349 1.00 0.00 N ATOM 90 CA ALA A 6 -13.732 7.704 7.994 1.00 0.00 C ATOM 91 C ALA A 6 -13.467 9.192 8.191 1.00 0.00 C ATOM 92 O ALA A 6 -14.344 10.024 7.967 1.00 0.00 O ATOM 93 CB ALA A 6 -13.446 7.304 6.556 1.00 0.00 C ATOM 0 H ALA A 6 -15.186 6.638 9.064 1.00 0.00 H new ATOM 0 HA ALA A 6 -13.064 7.153 8.656 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -12.419 7.566 6.303 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -13.585 6.229 6.443 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -14.129 7.830 5.889 1.00 0.00 H new ATOM 99 N VAL A 7 -12.249 9.517 8.609 1.00 0.00 N ATOM 100 CA VAL A 7 -11.865 10.904 8.835 1.00 0.00 C ATOM 101 C VAL A 7 -10.909 11.389 7.751 1.00 0.00 C ATOM 102 O VAL A 7 -9.700 11.464 7.965 1.00 0.00 O ATOM 103 CB VAL A 7 -11.195 11.086 10.210 1.00 0.00 C ATOM 104 CG1 VAL A 7 -10.985 12.563 10.511 1.00 0.00 C ATOM 105 CG2 VAL A 7 -12.025 10.424 11.300 1.00 0.00 C ATOM 0 H VAL A 7 -11.511 8.839 8.798 1.00 0.00 H new ATOM 0 HA VAL A 7 -12.780 11.495 8.805 1.00 0.00 H new ATOM 0 HB VAL A 7 -10.218 10.602 10.185 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -10.511 12.672 11.486 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -10.346 13.003 9.746 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -11.948 13.074 10.517 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -11.536 10.563 12.264 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -13.017 10.876 11.327 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -12.118 9.358 11.090 1.00 0.00 H new ATOM 115 N ILE A 8 -11.457 11.715 6.585 1.00 0.00 N ATOM 116 CA ILE A 8 -10.646 12.192 5.472 1.00 0.00 C ATOM 117 C ILE A 8 -9.656 13.256 5.945 1.00 0.00 C ATOM 118 O ILE A 8 -9.890 13.944 6.938 1.00 0.00 O ATOM 119 CB ILE A 8 -11.538 12.745 4.322 1.00 0.00 C ATOM 120 CG1 ILE A 8 -11.759 11.663 3.264 1.00 0.00 C ATOM 121 CG2 ILE A 8 -10.937 13.989 3.675 1.00 0.00 C ATOM 122 CD1 ILE A 8 -13.131 11.024 3.326 1.00 0.00 C ATOM 0 H ILE A 8 -12.456 11.658 6.387 1.00 0.00 H new ATOM 0 HA ILE A 8 -10.083 11.345 5.081 1.00 0.00 H new ATOM 0 HB ILE A 8 -12.494 13.032 4.760 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -11.615 12.099 2.275 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -11.001 10.889 3.385 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -11.594 14.339 2.879 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -10.827 14.772 4.425 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -9.959 13.746 3.258 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -13.215 10.267 2.547 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -13.272 10.558 4.301 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -13.895 11.787 3.175 1.00 0.00 H new ATOM 134 N LYS A 9 -8.556 13.384 5.215 1.00 0.00 N ATOM 135 CA LYS A 9 -7.525 14.364 5.538 1.00 0.00 C ATOM 136 C LYS A 9 -7.014 15.030 4.268 1.00 0.00 C ATOM 137 O LYS A 9 -6.421 16.107 4.310 1.00 0.00 O ATOM 138 CB LYS A 9 -6.366 13.697 6.283 1.00 0.00 C ATOM 139 CG LYS A 9 -6.810 12.823 7.443 1.00 0.00 C ATOM 140 CD LYS A 9 -6.547 13.496 8.779 1.00 0.00 C ATOM 141 CE LYS A 9 -7.683 13.253 9.760 1.00 0.00 C ATOM 142 NZ LYS A 9 -7.761 14.319 10.796 1.00 0.00 N ATOM 0 H LYS A 9 -8.353 12.819 4.391 1.00 0.00 H new ATOM 0 HA LYS A 9 -7.963 15.125 6.184 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -5.795 13.090 5.580 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -5.694 14.469 6.657 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -7.873 12.603 7.348 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -6.283 11.870 7.404 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -5.615 13.119 9.200 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -6.418 14.568 8.628 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -8.627 13.205 9.217 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -7.544 12.286 10.244 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -8.548 14.116 11.445 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -6.870 14.349 11.331 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -7.919 15.239 10.337 1.00 0.00 H new ATOM 156 N ASN A 10 -7.253 14.374 3.137 1.00 0.00 N ATOM 157 CA ASN A 10 -6.823 14.891 1.844 1.00 0.00 C ATOM 158 C ASN A 10 -7.469 14.102 0.711 1.00 0.00 C ATOM 159 O ASN A 10 -7.002 13.021 0.352 1.00 0.00 O ATOM 160 CB ASN A 10 -5.300 14.819 1.726 1.00 0.00 C ATOM 161 CG ASN A 10 -4.672 16.176 1.473 1.00 0.00 C ATOM 162 OD1 ASN A 10 -3.458 16.288 1.305 1.00 0.00 O ATOM 163 ND2 ASN A 10 -5.497 17.217 1.446 1.00 0.00 N ATOM 0 H ASN A 10 -7.744 13.481 3.091 1.00 0.00 H new ATOM 0 HA ASN A 10 -7.137 15.932 1.768 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -4.887 14.397 2.642 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -5.033 14.142 0.915 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -5.130 18.154 1.281 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -6.497 17.079 1.590 1.00 0.00 H new ATOM 170 N ALA A 11 -8.549 14.642 0.158 1.00 0.00 N ATOM 171 CA ALA A 11 -9.259 13.975 -0.926 1.00 0.00 C ATOM 172 C ALA A 11 -9.127 14.736 -2.240 1.00 0.00 C ATOM 173 O ALA A 11 -10.072 15.385 -2.688 1.00 0.00 O ATOM 174 CB ALA A 11 -10.725 13.797 -0.566 1.00 0.00 C ATOM 0 H ALA A 11 -8.950 15.536 0.441 1.00 0.00 H new ATOM 0 HA ALA A 11 -8.803 12.995 -1.064 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -11.243 13.298 -1.385 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -10.807 13.193 0.337 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -11.178 14.773 -0.392 1.00 0.00 H new ATOM 180 N ASP A 12 -7.959 14.636 -2.864 1.00 0.00 N ATOM 181 CA ASP A 12 -7.720 15.301 -4.138 1.00 0.00 C ATOM 182 C ASP A 12 -8.433 14.545 -5.251 1.00 0.00 C ATOM 183 O ASP A 12 -7.911 14.392 -6.355 1.00 0.00 O ATOM 184 CB ASP A 12 -6.220 15.380 -4.430 1.00 0.00 C ATOM 185 CG ASP A 12 -5.545 16.524 -3.698 1.00 0.00 C ATOM 186 OD1 ASP A 12 -5.749 17.689 -4.099 1.00 0.00 O ATOM 187 OD2 ASP A 12 -4.813 16.254 -2.722 1.00 0.00 O ATOM 0 H ASP A 12 -7.165 14.102 -2.509 1.00 0.00 H new ATOM 0 HA ASP A 12 -8.112 16.317 -4.085 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -5.747 14.440 -4.143 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -6.068 15.499 -5.503 1.00 0.00 H new ATOM 192 N MET A 13 -9.630 14.061 -4.936 1.00 0.00 N ATOM 193 CA MET A 13 -10.429 13.299 -5.884 1.00 0.00 C ATOM 194 C MET A 13 -11.894 13.750 -5.841 1.00 0.00 C ATOM 195 O MET A 13 -12.283 14.543 -4.985 1.00 0.00 O ATOM 196 CB MET A 13 -10.285 11.801 -5.567 1.00 0.00 C ATOM 197 CG MET A 13 -11.566 10.993 -5.683 1.00 0.00 C ATOM 198 SD MET A 13 -12.013 10.183 -4.137 1.00 0.00 S ATOM 199 CE MET A 13 -11.546 8.492 -4.497 1.00 0.00 C ATOM 0 H MET A 13 -10.069 14.185 -4.024 1.00 0.00 H new ATOM 0 HA MET A 13 -10.071 13.478 -6.898 1.00 0.00 H new ATOM 0 HB2 MET A 13 -9.541 11.373 -6.239 1.00 0.00 H new ATOM 0 HB3 MET A 13 -9.897 11.695 -4.554 1.00 0.00 H new ATOM 0 HG2 MET A 13 -12.379 11.649 -5.994 1.00 0.00 H new ATOM 0 HG3 MET A 13 -11.448 10.241 -6.463 1.00 0.00 H new ATOM 0 HE1 MET A 13 -12.295 7.813 -4.089 1.00 0.00 H new ATOM 0 HE2 MET A 13 -11.481 8.354 -5.576 1.00 0.00 H new ATOM 0 HE3 MET A 13 -10.577 8.278 -4.045 1.00 0.00 H new ATOM 209 N SER A 14 -12.695 13.243 -6.775 1.00 0.00 N ATOM 210 CA SER A 14 -14.111 13.598 -6.850 1.00 0.00 C ATOM 211 C SER A 14 -14.816 13.349 -5.519 1.00 0.00 C ATOM 212 O SER A 14 -14.632 12.306 -4.897 1.00 0.00 O ATOM 213 CB SER A 14 -14.798 12.797 -7.957 1.00 0.00 C ATOM 214 OG SER A 14 -16.206 12.822 -7.808 1.00 0.00 O ATOM 0 H SER A 14 -12.388 12.585 -7.491 1.00 0.00 H new ATOM 0 HA SER A 14 -14.177 14.662 -7.078 1.00 0.00 H new ATOM 0 HB2 SER A 14 -14.525 13.207 -8.929 1.00 0.00 H new ATOM 0 HB3 SER A 14 -14.446 11.766 -7.936 1.00 0.00 H new ATOM 0 HG SER A 14 -16.621 12.304 -8.529 1.00 0.00 H new ATOM 220 N GLU A 15 -15.625 14.319 -5.095 1.00 0.00 N ATOM 221 CA GLU A 15 -16.364 14.217 -3.838 1.00 0.00 C ATOM 222 C GLU A 15 -17.138 12.905 -3.754 1.00 0.00 C ATOM 223 O GLU A 15 -16.711 11.961 -3.090 1.00 0.00 O ATOM 224 CB GLU A 15 -17.326 15.397 -3.695 1.00 0.00 C ATOM 225 CG GLU A 15 -17.784 15.970 -5.027 1.00 0.00 C ATOM 226 CD GLU A 15 -19.280 16.207 -5.080 1.00 0.00 C ATOM 227 OE1 GLU A 15 -19.957 15.954 -4.061 1.00 0.00 O ATOM 228 OE2 GLU A 15 -19.775 16.643 -6.141 1.00 0.00 O ATOM 0 H GLU A 15 -15.785 15.187 -5.606 1.00 0.00 H new ATOM 0 HA GLU A 15 -15.641 14.238 -3.023 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -18.199 15.077 -3.126 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -16.840 16.184 -3.118 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -17.265 16.911 -5.211 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -17.500 15.288 -5.828 1.00 0.00 H new ATOM 235 N GLU A 16 -18.282 12.847 -4.427 1.00 0.00 N ATOM 236 CA GLU A 16 -19.104 11.645 -4.418 1.00 0.00 C ATOM 237 C GLU A 16 -18.232 10.405 -4.582 1.00 0.00 C ATOM 238 O GLU A 16 -18.583 9.317 -4.121 1.00 0.00 O ATOM 239 CB GLU A 16 -20.151 11.708 -5.533 1.00 0.00 C ATOM 240 CG GLU A 16 -19.622 11.283 -6.894 1.00 0.00 C ATOM 241 CD GLU A 16 -19.853 12.332 -7.964 1.00 0.00 C ATOM 242 OE1 GLU A 16 -18.993 13.227 -8.113 1.00 0.00 O ATOM 243 OE2 GLU A 16 -20.892 12.260 -8.653 1.00 0.00 O ATOM 0 H GLU A 16 -18.659 13.615 -4.983 1.00 0.00 H new ATOM 0 HA GLU A 16 -19.619 11.584 -3.459 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -20.993 11.070 -5.265 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -20.533 12.726 -5.603 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -18.554 11.078 -6.817 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -20.105 10.352 -7.193 1.00 0.00 H new ATOM 250 N MET A 17 -17.090 10.580 -5.241 1.00 0.00 N ATOM 251 CA MET A 17 -16.160 9.484 -5.471 1.00 0.00 C ATOM 252 C MET A 17 -15.330 9.194 -4.216 1.00 0.00 C ATOM 253 O MET A 17 -15.010 8.039 -3.932 1.00 0.00 O ATOM 254 CB MET A 17 -15.266 9.813 -6.675 1.00 0.00 C ATOM 255 CG MET A 17 -13.833 9.323 -6.559 1.00 0.00 C ATOM 256 SD MET A 17 -13.420 8.094 -7.806 1.00 0.00 S ATOM 257 CE MET A 17 -14.451 6.734 -7.275 1.00 0.00 C ATOM 0 H MET A 17 -16.788 11.475 -5.626 1.00 0.00 H new ATOM 0 HA MET A 17 -16.724 8.579 -5.695 1.00 0.00 H new ATOM 0 HB2 MET A 17 -15.712 9.379 -7.570 1.00 0.00 H new ATOM 0 HB3 MET A 17 -15.255 10.894 -6.817 1.00 0.00 H new ATOM 0 HG2 MET A 17 -13.154 10.171 -6.651 1.00 0.00 H new ATOM 0 HG3 MET A 17 -13.678 8.896 -5.568 1.00 0.00 H new ATOM 0 HE1 MET A 17 -13.985 5.791 -7.561 1.00 0.00 H new ATOM 0 HE2 MET A 17 -14.567 6.767 -6.192 1.00 0.00 H new ATOM 0 HE3 MET A 17 -15.430 6.813 -7.748 1.00 0.00 H new ATOM 267 N GLN A 18 -14.993 10.239 -3.460 1.00 0.00 N ATOM 268 CA GLN A 18 -14.214 10.065 -2.236 1.00 0.00 C ATOM 269 C GLN A 18 -15.084 9.482 -1.132 1.00 0.00 C ATOM 270 O GLN A 18 -14.606 8.728 -0.284 1.00 0.00 O ATOM 271 CB GLN A 18 -13.601 11.388 -1.769 1.00 0.00 C ATOM 272 CG GLN A 18 -14.292 12.621 -2.320 1.00 0.00 C ATOM 273 CD GLN A 18 -13.307 13.644 -2.852 1.00 0.00 C ATOM 274 OE1 GLN A 18 -13.659 14.802 -3.077 1.00 0.00 O ATOM 275 NE2 GLN A 18 -12.065 13.219 -3.053 1.00 0.00 N ATOM 0 H GLN A 18 -15.244 11.205 -3.671 1.00 0.00 H new ATOM 0 HA GLN A 18 -13.402 9.373 -2.458 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -13.630 11.425 -0.680 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -12.551 11.412 -2.061 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -14.973 12.327 -3.118 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -14.897 13.076 -1.536 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -11.819 12.250 -2.852 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -11.357 13.862 -3.408 1.00 0.00 H new ATOM 284 N GLN A 19 -16.371 9.820 -1.159 1.00 0.00 N ATOM 285 CA GLN A 19 -17.309 9.310 -0.173 1.00 0.00 C ATOM 286 C GLN A 19 -17.567 7.841 -0.456 1.00 0.00 C ATOM 287 O GLN A 19 -17.621 7.013 0.457 1.00 0.00 O ATOM 288 CB GLN A 19 -18.618 10.102 -0.215 1.00 0.00 C ATOM 289 CG GLN A 19 -18.572 11.395 0.585 1.00 0.00 C ATOM 290 CD GLN A 19 -19.024 12.596 -0.222 1.00 0.00 C ATOM 291 OE1 GLN A 19 -20.147 12.637 -0.722 1.00 0.00 O ATOM 292 NE2 GLN A 19 -18.146 13.584 -0.354 1.00 0.00 N ATOM 0 H GLN A 19 -16.784 10.444 -1.853 1.00 0.00 H new ATOM 0 HA GLN A 19 -16.884 9.421 0.825 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -18.859 10.334 -1.252 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -19.424 9.476 0.167 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -19.205 11.295 1.467 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -17.555 11.562 0.940 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -17.225 13.509 0.078 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -18.393 14.418 -0.887 1.00 0.00 H new ATOM 301 N ASP A 20 -17.697 7.524 -1.740 1.00 0.00 N ATOM 302 CA ASP A 20 -17.916 6.154 -2.163 1.00 0.00 C ATOM 303 C ASP A 20 -16.679 5.323 -1.856 1.00 0.00 C ATOM 304 O ASP A 20 -16.766 4.124 -1.589 1.00 0.00 O ATOM 305 CB ASP A 20 -18.233 6.097 -3.659 1.00 0.00 C ATOM 306 CG ASP A 20 -19.721 6.153 -3.938 1.00 0.00 C ATOM 307 OD1 ASP A 20 -20.510 5.961 -2.990 1.00 0.00 O ATOM 308 OD2 ASP A 20 -20.099 6.390 -5.105 1.00 0.00 O ATOM 0 H ASP A 20 -17.654 8.200 -2.502 1.00 0.00 H new ATOM 0 HA ASP A 20 -18.768 5.748 -1.618 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -17.740 6.928 -4.164 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -17.822 5.179 -4.080 1.00 0.00 H new ATOM 313 N SER A 21 -15.524 5.983 -1.879 1.00 0.00 N ATOM 314 CA SER A 21 -14.259 5.325 -1.586 1.00 0.00 C ATOM 315 C SER A 21 -14.222 4.891 -0.127 1.00 0.00 C ATOM 316 O SER A 21 -13.840 3.765 0.188 1.00 0.00 O ATOM 317 CB SER A 21 -13.088 6.262 -1.885 1.00 0.00 C ATOM 318 OG SER A 21 -12.193 6.325 -0.787 1.00 0.00 O ATOM 0 H SER A 21 -15.441 6.976 -2.098 1.00 0.00 H new ATOM 0 HA SER A 21 -14.170 4.443 -2.221 1.00 0.00 H new ATOM 0 HB2 SER A 21 -12.557 5.915 -2.772 1.00 0.00 H new ATOM 0 HB3 SER A 21 -13.465 7.260 -2.109 1.00 0.00 H new ATOM 0 HG SER A 21 -12.534 6.960 -0.123 1.00 0.00 H new ATOM 324 N VAL A 22 -14.633 5.795 0.760 1.00 0.00 N ATOM 325 CA VAL A 22 -14.656 5.501 2.186 1.00 0.00 C ATOM 326 C VAL A 22 -15.528 4.285 2.465 1.00 0.00 C ATOM 327 O VAL A 22 -15.115 3.366 3.169 1.00 0.00 O ATOM 328 CB VAL A 22 -15.182 6.690 3.009 1.00 0.00 C ATOM 329 CG1 VAL A 22 -15.310 6.303 4.475 1.00 0.00 C ATOM 330 CG2 VAL A 22 -14.273 7.898 2.848 1.00 0.00 C ATOM 0 H VAL A 22 -14.953 6.732 0.515 1.00 0.00 H new ATOM 0 HA VAL A 22 -13.627 5.300 2.485 1.00 0.00 H new ATOM 0 HB VAL A 22 -16.170 6.959 2.636 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -15.683 7.154 5.045 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -16.005 5.469 4.572 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -14.334 6.009 4.860 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -14.663 8.728 3.438 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -13.270 7.647 3.193 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -14.234 8.186 1.798 1.00 0.00 H new ATOM 340 N GLU A 23 -16.732 4.281 1.901 1.00 0.00 N ATOM 341 CA GLU A 23 -17.652 3.166 2.086 1.00 0.00 C ATOM 342 C GLU A 23 -17.010 1.873 1.603 1.00 0.00 C ATOM 343 O GLU A 23 -17.195 0.813 2.200 1.00 0.00 O ATOM 344 CB GLU A 23 -18.960 3.416 1.330 1.00 0.00 C ATOM 345 CG GLU A 23 -19.730 4.627 1.829 1.00 0.00 C ATOM 346 CD GLU A 23 -20.650 4.297 2.988 1.00 0.00 C ATOM 347 OE1 GLU A 23 -21.633 3.556 2.774 1.00 0.00 O ATOM 348 OE2 GLU A 23 -20.387 4.778 4.110 1.00 0.00 O ATOM 0 H GLU A 23 -17.091 5.034 1.315 1.00 0.00 H new ATOM 0 HA GLU A 23 -17.877 3.077 3.149 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -18.738 3.548 0.271 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -19.593 2.533 1.415 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -19.025 5.399 2.138 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -20.318 5.042 1.010 1.00 0.00 H new ATOM 355 N CYS A 24 -16.241 1.972 0.522 1.00 0.00 N ATOM 356 CA CYS A 24 -15.554 0.813 -0.033 1.00 0.00 C ATOM 357 C CYS A 24 -14.478 0.334 0.930 1.00 0.00 C ATOM 358 O CYS A 24 -14.213 -0.863 1.042 1.00 0.00 O ATOM 359 CB CYS A 24 -14.934 1.158 -1.389 1.00 0.00 C ATOM 360 SG CYS A 24 -14.163 -0.245 -2.230 1.00 0.00 S ATOM 0 H CYS A 24 -16.079 2.842 0.015 1.00 0.00 H new ATOM 0 HA CYS A 24 -16.280 0.013 -0.178 1.00 0.00 H new ATOM 0 HB2 CYS A 24 -15.708 1.574 -2.034 1.00 0.00 H new ATOM 0 HB3 CYS A 24 -14.186 1.937 -1.246 1.00 0.00 H new ATOM 0 HG CYS A 24 -14.973 -0.707 -3.136 1.00 0.00 H new ATOM 366 N ALA A 25 -13.884 1.279 1.654 1.00 0.00 N ATOM 367 CA ALA A 25 -12.866 0.953 2.636 1.00 0.00 C ATOM 368 C ALA A 25 -13.547 0.324 3.831 1.00 0.00 C ATOM 369 O ALA A 25 -13.073 -0.657 4.405 1.00 0.00 O ATOM 370 CB ALA A 25 -12.101 2.204 3.047 1.00 0.00 C ATOM 0 H ALA A 25 -14.093 2.274 1.576 1.00 0.00 H new ATOM 0 HA ALA A 25 -12.146 0.254 2.211 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -11.342 1.941 3.784 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -11.621 2.641 2.171 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -12.792 2.927 3.481 1.00 0.00 H new ATOM 376 N THR A 26 -14.694 0.895 4.167 1.00 0.00 N ATOM 377 CA THR A 26 -15.510 0.415 5.262 1.00 0.00 C ATOM 378 C THR A 26 -16.014 -0.985 4.942 1.00 0.00 C ATOM 379 O THR A 26 -16.084 -1.851 5.815 1.00 0.00 O ATOM 380 CB THR A 26 -16.684 1.363 5.479 1.00 0.00 C ATOM 381 OG1 THR A 26 -16.227 2.674 5.764 1.00 0.00 O ATOM 382 CG2 THR A 26 -17.592 0.939 6.604 1.00 0.00 C ATOM 0 H THR A 26 -15.082 1.706 3.685 1.00 0.00 H new ATOM 0 HA THR A 26 -14.915 0.378 6.175 1.00 0.00 H new ATOM 0 HB THR A 26 -17.250 1.338 4.548 1.00 0.00 H new ATOM 0 HG1 THR A 26 -15.826 3.063 4.959 1.00 0.00 H new ATOM 0 HG21 THR A 26 -18.406 1.657 6.705 1.00 0.00 H new ATOM 0 HG22 THR A 26 -18.002 -0.047 6.388 1.00 0.00 H new ATOM 0 HG23 THR A 26 -17.025 0.901 7.534 1.00 0.00 H new ATOM 390 N GLN A 27 -16.344 -1.202 3.671 1.00 0.00 N ATOM 391 CA GLN A 27 -16.819 -2.498 3.215 1.00 0.00 C ATOM 392 C GLN A 27 -15.741 -3.544 3.448 1.00 0.00 C ATOM 393 O GLN A 27 -16.014 -4.648 3.919 1.00 0.00 O ATOM 394 CB GLN A 27 -17.186 -2.440 1.732 1.00 0.00 C ATOM 395 CG GLN A 27 -18.540 -1.804 1.466 1.00 0.00 C ATOM 396 CD GLN A 27 -19.672 -2.813 1.476 1.00 0.00 C ATOM 397 OE1 GLN A 27 -19.828 -3.596 0.539 1.00 0.00 O ATOM 398 NE2 GLN A 27 -20.469 -2.800 2.538 1.00 0.00 N ATOM 0 H GLN A 27 -16.290 -0.493 2.940 1.00 0.00 H new ATOM 0 HA GLN A 27 -17.712 -2.769 3.779 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -16.419 -1.879 1.198 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -17.183 -3.451 1.325 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -18.733 -1.040 2.220 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -18.517 -1.300 0.500 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -20.303 -2.134 3.292 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -21.247 -3.457 2.600 1.00 0.00 H new ATOM 407 N ALA A 28 -14.506 -3.171 3.129 1.00 0.00 N ATOM 408 CA ALA A 28 -13.369 -4.057 3.317 1.00 0.00 C ATOM 409 C ALA A 28 -12.982 -4.103 4.791 1.00 0.00 C ATOM 410 O ALA A 28 -12.232 -4.976 5.224 1.00 0.00 O ATOM 411 CB ALA A 28 -12.195 -3.598 2.468 1.00 0.00 C ATOM 0 H ALA A 28 -14.269 -2.259 2.739 1.00 0.00 H new ATOM 0 HA ALA A 28 -13.647 -5.062 2.999 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -11.351 -4.271 2.619 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -12.481 -3.606 1.416 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -11.909 -2.587 2.758 1.00 0.00 H new ATOM 417 N LEU A 29 -13.507 -3.150 5.555 1.00 0.00 N ATOM 418 CA LEU A 29 -13.233 -3.072 6.982 1.00 0.00 C ATOM 419 C LEU A 29 -14.142 -4.018 7.760 1.00 0.00 C ATOM 420 O LEU A 29 -13.694 -4.732 8.657 1.00 0.00 O ATOM 421 CB LEU A 29 -13.426 -1.646 7.480 1.00 0.00 C ATOM 422 CG LEU A 29 -12.302 -0.687 7.102 1.00 0.00 C ATOM 423 CD1 LEU A 29 -12.869 0.650 6.675 1.00 0.00 C ATOM 424 CD2 LEU A 29 -11.337 -0.515 8.263 1.00 0.00 C ATOM 0 H LEU A 29 -14.127 -2.419 5.206 1.00 0.00 H new ATOM 0 HA LEU A 29 -12.197 -3.371 7.145 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -14.365 -1.260 7.083 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -13.522 -1.663 8.566 1.00 0.00 H new ATOM 0 HG LEU A 29 -11.753 -1.111 6.261 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -12.054 1.323 6.409 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -13.521 0.510 5.812 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -13.442 1.081 7.496 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -10.541 0.172 7.976 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -11.871 -0.113 9.124 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -10.905 -1.481 8.523 1.00 0.00 H new ATOM 436 N GLU A 30 -15.425 -4.011 7.410 1.00 0.00 N ATOM 437 CA GLU A 30 -16.405 -4.862 8.074 1.00 0.00 C ATOM 438 C GLU A 30 -16.248 -6.318 7.652 1.00 0.00 C ATOM 439 O GLU A 30 -16.464 -7.232 8.447 1.00 0.00 O ATOM 440 CB GLU A 30 -17.824 -4.382 7.760 1.00 0.00 C ATOM 441 CG GLU A 30 -18.518 -3.725 8.941 1.00 0.00 C ATOM 442 CD GLU A 30 -19.790 -4.445 9.343 1.00 0.00 C ATOM 443 OE1 GLU A 30 -19.783 -5.694 9.371 1.00 0.00 O ATOM 444 OE2 GLU A 30 -20.794 -3.760 9.632 1.00 0.00 O ATOM 0 H GLU A 30 -15.810 -3.424 6.669 1.00 0.00 H new ATOM 0 HA GLU A 30 -16.231 -4.796 9.148 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -17.784 -3.674 6.932 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -18.420 -5.231 7.425 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -17.835 -3.699 9.790 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -18.754 -2.691 8.690 1.00 0.00 H new ATOM 451 N LYS A 31 -15.872 -6.527 6.394 1.00 0.00 N ATOM 452 CA LYS A 31 -15.688 -7.875 5.868 1.00 0.00 C ATOM 453 C LYS A 31 -14.345 -8.446 6.310 1.00 0.00 C ATOM 454 O LYS A 31 -14.194 -9.659 6.455 1.00 0.00 O ATOM 455 CB LYS A 31 -15.780 -7.866 4.342 1.00 0.00 C ATOM 456 CG LYS A 31 -17.188 -8.099 3.818 1.00 0.00 C ATOM 457 CD LYS A 31 -17.441 -7.317 2.539 1.00 0.00 C ATOM 458 CE LYS A 31 -18.778 -7.684 1.917 1.00 0.00 C ATOM 459 NZ LYS A 31 -18.619 -8.243 0.546 1.00 0.00 N ATOM 0 H LYS A 31 -15.689 -5.782 5.722 1.00 0.00 H new ATOM 0 HA LYS A 31 -16.481 -8.509 6.265 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -15.416 -6.908 3.970 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -15.120 -8.635 3.942 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -17.337 -9.163 3.631 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -17.913 -7.804 4.576 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -17.420 -6.249 2.754 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -16.640 -7.515 1.826 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -19.285 -8.413 2.550 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -19.414 -6.800 1.877 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -19.554 -8.480 0.157 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -18.159 -7.538 -0.065 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -18.033 -9.101 0.587 1.00 0.00 H new ATOM 473 N TYR A 32 -13.376 -7.563 6.529 1.00 0.00 N ATOM 474 CA TYR A 32 -12.048 -7.981 6.964 1.00 0.00 C ATOM 475 C TYR A 32 -11.354 -6.868 7.743 1.00 0.00 C ATOM 476 O TYR A 32 -11.583 -5.685 7.490 1.00 0.00 O ATOM 477 CB TYR A 32 -11.188 -8.392 5.765 1.00 0.00 C ATOM 478 CG TYR A 32 -11.963 -8.536 4.472 1.00 0.00 C ATOM 479 CD1 TYR A 32 -12.628 -7.452 3.912 1.00 0.00 C ATOM 480 CD2 TYR A 32 -12.021 -9.755 3.807 1.00 0.00 C ATOM 481 CE1 TYR A 32 -13.329 -7.577 2.728 1.00 0.00 C ATOM 482 CE2 TYR A 32 -12.722 -9.887 2.622 1.00 0.00 C ATOM 483 CZ TYR A 32 -13.373 -8.797 2.087 1.00 0.00 C ATOM 484 OH TYR A 32 -14.070 -8.927 0.908 1.00 0.00 O ATOM 0 H TYR A 32 -13.485 -6.556 6.413 1.00 0.00 H new ATOM 0 HA TYR A 32 -12.170 -8.842 7.621 1.00 0.00 H new ATOM 0 HB2 TYR A 32 -10.401 -7.651 5.624 1.00 0.00 H new ATOM 0 HB3 TYR A 32 -10.698 -9.339 5.990 1.00 0.00 H new ATOM 0 HD1 TYR A 32 -12.596 -6.495 4.411 1.00 0.00 H new ATOM 0 HD2 TYR A 32 -11.511 -10.612 4.222 1.00 0.00 H new ATOM 0 HE1 TYR A 32 -13.840 -6.724 2.307 1.00 0.00 H new ATOM 0 HE2 TYR A 32 -12.759 -10.841 2.118 1.00 0.00 H new ATOM 0 HH TYR A 32 -14.000 -9.850 0.587 1.00 0.00 H new ATOM 494 N ASN A 33 -10.505 -7.255 8.693 1.00 0.00 N ATOM 495 CA ASN A 33 -9.781 -6.287 9.510 1.00 0.00 C ATOM 496 C ASN A 33 -8.277 -6.392 9.280 1.00 0.00 C ATOM 497 O ASN A 33 -7.482 -6.178 10.195 1.00 0.00 O ATOM 498 CB ASN A 33 -10.095 -6.505 10.991 1.00 0.00 C ATOM 499 CG ASN A 33 -9.977 -7.960 11.400 1.00 0.00 C ATOM 500 OD1 ASN A 33 -8.929 -8.582 11.230 1.00 0.00 O ATOM 501 ND2 ASN A 33 -11.058 -8.510 11.941 1.00 0.00 N ATOM 0 H ASN A 33 -10.303 -8.230 8.915 1.00 0.00 H new ATOM 0 HA ASN A 33 -10.106 -5.289 9.216 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -9.415 -5.904 11.596 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -11.105 -6.152 11.201 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -11.041 -9.487 12.235 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -11.906 -7.956 12.063 1.00 0.00 H new ATOM 508 N ILE A 34 -7.892 -6.723 8.051 1.00 0.00 N ATOM 509 CA ILE A 34 -6.483 -6.854 7.699 1.00 0.00 C ATOM 510 C ILE A 34 -6.063 -5.767 6.717 1.00 0.00 C ATOM 511 O ILE A 34 -6.441 -5.801 5.549 1.00 0.00 O ATOM 512 CB ILE A 34 -6.187 -8.230 7.072 1.00 0.00 C ATOM 513 CG1 ILE A 34 -7.016 -9.314 7.755 1.00 0.00 C ATOM 514 CG2 ILE A 34 -4.702 -8.549 7.167 1.00 0.00 C ATOM 515 CD1 ILE A 34 -6.746 -9.424 9.235 1.00 0.00 C ATOM 0 H ILE A 34 -8.537 -6.905 7.282 1.00 0.00 H new ATOM 0 HA ILE A 34 -5.914 -6.751 8.623 1.00 0.00 H new ATOM 0 HB ILE A 34 -6.463 -8.199 6.018 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -8.074 -9.105 7.600 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -6.808 -10.274 7.282 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -4.510 -9.524 6.720 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -4.132 -7.787 6.636 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -4.399 -8.564 8.214 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -7.367 -10.212 9.661 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -5.695 -9.663 9.396 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -6.981 -8.476 9.719 1.00 0.00 H new ATOM 527 N GLU A 35 -5.281 -4.804 7.197 1.00 0.00 N ATOM 528 CA GLU A 35 -4.813 -3.709 6.352 1.00 0.00 C ATOM 529 C GLU A 35 -4.672 -4.162 4.903 1.00 0.00 C ATOM 530 O GLU A 35 -5.493 -3.816 4.053 1.00 0.00 O ATOM 531 CB GLU A 35 -3.474 -3.176 6.864 1.00 0.00 C ATOM 532 CG GLU A 35 -3.524 -2.682 8.301 1.00 0.00 C ATOM 533 CD GLU A 35 -3.087 -3.739 9.297 1.00 0.00 C ATOM 534 OE1 GLU A 35 -2.987 -4.920 8.904 1.00 0.00 O ATOM 535 OE2 GLU A 35 -2.847 -3.385 10.471 1.00 0.00 O ATOM 0 H GLU A 35 -4.959 -4.759 8.164 1.00 0.00 H new ATOM 0 HA GLU A 35 -5.553 -2.910 6.394 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -2.725 -3.964 6.786 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -3.147 -2.360 6.219 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -2.884 -1.806 8.402 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -4.540 -2.364 8.537 1.00 0.00 H new ATOM 542 N LYS A 36 -3.629 -4.938 4.628 1.00 0.00 N ATOM 543 CA LYS A 36 -3.388 -5.440 3.281 1.00 0.00 C ATOM 544 C LYS A 36 -4.686 -5.932 2.649 1.00 0.00 C ATOM 545 O LYS A 36 -5.109 -5.432 1.605 1.00 0.00 O ATOM 546 CB LYS A 36 -2.361 -6.574 3.314 1.00 0.00 C ATOM 547 CG LYS A 36 -1.527 -6.599 4.586 1.00 0.00 C ATOM 548 CD LYS A 36 -0.352 -7.556 4.465 1.00 0.00 C ATOM 549 CE LYS A 36 -0.424 -8.658 5.510 1.00 0.00 C ATOM 550 NZ LYS A 36 0.812 -8.720 6.339 1.00 0.00 N ATOM 0 H LYS A 36 -2.939 -5.232 5.319 1.00 0.00 H new ATOM 0 HA LYS A 36 -2.995 -4.622 2.677 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -2.880 -7.527 3.210 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -1.697 -6.477 2.455 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -1.159 -5.596 4.801 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -2.154 -6.896 5.427 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -0.342 -7.998 3.469 1.00 0.00 H new ATOM 0 HD3 LYS A 36 0.581 -7.005 4.579 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -1.286 -8.490 6.156 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -0.578 -9.617 5.016 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 0.723 -9.484 7.039 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 1.632 -8.906 5.727 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 0.946 -7.814 6.831 1.00 0.00 H new ATOM 564 N ASP A 37 -5.317 -6.911 3.290 1.00 0.00 N ATOM 565 CA ASP A 37 -6.570 -7.467 2.794 1.00 0.00 C ATOM 566 C ASP A 37 -7.519 -6.352 2.369 1.00 0.00 C ATOM 567 O ASP A 37 -7.877 -6.238 1.197 1.00 0.00 O ATOM 568 CB ASP A 37 -7.228 -8.332 3.874 1.00 0.00 C ATOM 569 CG ASP A 37 -7.642 -9.694 3.352 1.00 0.00 C ATOM 570 OD1 ASP A 37 -7.348 -9.994 2.176 1.00 0.00 O ATOM 571 OD2 ASP A 37 -8.261 -10.462 4.120 1.00 0.00 O ATOM 0 H ASP A 37 -4.980 -7.335 4.154 1.00 0.00 H new ATOM 0 HA ASP A 37 -6.352 -8.088 1.925 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -6.535 -8.460 4.705 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -8.104 -7.815 4.266 1.00 0.00 H new ATOM 576 N ILE A 38 -7.919 -5.531 3.334 1.00 0.00 N ATOM 577 CA ILE A 38 -8.822 -4.419 3.071 1.00 0.00 C ATOM 578 C ILE A 38 -8.380 -3.631 1.844 1.00 0.00 C ATOM 579 O ILE A 38 -9.166 -3.397 0.926 1.00 0.00 O ATOM 580 CB ILE A 38 -8.891 -3.465 4.280 1.00 0.00 C ATOM 581 CG1 ILE A 38 -9.072 -4.255 5.576 1.00 0.00 C ATOM 582 CG2 ILE A 38 -10.020 -2.461 4.105 1.00 0.00 C ATOM 583 CD1 ILE A 38 -8.502 -3.558 6.793 1.00 0.00 C ATOM 0 H ILE A 38 -7.630 -5.616 4.309 1.00 0.00 H new ATOM 0 HA ILE A 38 -9.809 -4.844 2.889 1.00 0.00 H new ATOM 0 HB ILE A 38 -7.951 -2.917 4.339 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -10.135 -4.437 5.736 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -8.595 -5.229 5.468 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -10.053 -1.796 4.968 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -9.849 -1.875 3.202 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -10.968 -2.991 4.019 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -8.666 -4.175 7.676 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -7.432 -3.400 6.654 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -8.997 -2.596 6.926 1.00 0.00 H new ATOM 595 N ALA A 39 -7.114 -3.223 1.836 1.00 0.00 N ATOM 596 CA ALA A 39 -6.563 -2.459 0.724 1.00 0.00 C ATOM 597 C ALA A 39 -6.780 -3.184 -0.602 1.00 0.00 C ATOM 598 O ALA A 39 -7.036 -2.556 -1.629 1.00 0.00 O ATOM 599 CB ALA A 39 -5.082 -2.194 0.949 1.00 0.00 C ATOM 0 H ALA A 39 -6.451 -3.410 2.588 1.00 0.00 H new ATOM 0 HA ALA A 39 -7.087 -1.505 0.675 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -4.683 -1.623 0.111 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -4.950 -1.627 1.870 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -4.550 -3.142 1.027 1.00 0.00 H new ATOM 605 N ALA A 40 -6.679 -4.509 -0.571 1.00 0.00 N ATOM 606 CA ALA A 40 -6.867 -5.317 -1.769 1.00 0.00 C ATOM 607 C ALA A 40 -8.306 -5.237 -2.265 1.00 0.00 C ATOM 608 O ALA A 40 -8.576 -4.686 -3.332 1.00 0.00 O ATOM 609 CB ALA A 40 -6.482 -6.765 -1.493 1.00 0.00 C ATOM 0 H ALA A 40 -6.468 -5.045 0.271 1.00 0.00 H new ATOM 0 HA ALA A 40 -6.219 -4.921 -2.551 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -6.627 -7.358 -2.396 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -5.435 -6.812 -1.192 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -7.108 -7.162 -0.694 1.00 0.00 H new ATOM 615 N HIS A 41 -9.226 -5.789 -1.482 1.00 0.00 N ATOM 616 CA HIS A 41 -10.641 -5.781 -1.838 1.00 0.00 C ATOM 617 C HIS A 41 -11.072 -4.397 -2.312 1.00 0.00 C ATOM 618 O HIS A 41 -11.846 -4.268 -3.260 1.00 0.00 O ATOM 619 CB HIS A 41 -11.491 -6.211 -0.641 1.00 0.00 C ATOM 620 CG HIS A 41 -10.722 -6.963 0.399 1.00 0.00 C ATOM 621 ND1 HIS A 41 -10.888 -6.759 1.752 1.00 0.00 N ATOM 622 CD2 HIS A 41 -9.776 -7.924 0.278 1.00 0.00 C ATOM 623 CE1 HIS A 41 -10.076 -7.561 2.419 1.00 0.00 C ATOM 624 NE2 HIS A 41 -9.391 -8.279 1.547 1.00 0.00 N ATOM 0 H HIS A 41 -9.018 -6.248 -0.595 1.00 0.00 H new ATOM 0 HA HIS A 41 -10.791 -6.489 -2.653 1.00 0.00 H new ATOM 0 HB2 HIS A 41 -11.935 -5.326 -0.184 1.00 0.00 H new ATOM 0 HB3 HIS A 41 -12.313 -6.834 -0.994 1.00 0.00 H new ATOM 0 HD1 HIS A 41 -11.536 -6.093 2.173 1.00 0.00 H new ATOM 0 HD2 HIS A 41 -9.395 -8.335 -0.645 1.00 0.00 H new ATOM 0 HE1 HIS A 41 -9.988 -7.619 3.494 1.00 0.00 H new ATOM 633 N ILE A 42 -10.567 -3.366 -1.644 1.00 0.00 N ATOM 634 CA ILE A 42 -10.900 -1.992 -1.996 1.00 0.00 C ATOM 635 C ILE A 42 -10.423 -1.659 -3.405 1.00 0.00 C ATOM 636 O ILE A 42 -11.229 -1.432 -4.307 1.00 0.00 O ATOM 637 CB ILE A 42 -10.278 -0.993 -1.003 1.00 0.00 C ATOM 638 CG1 ILE A 42 -10.802 -1.256 0.411 1.00 0.00 C ATOM 639 CG2 ILE A 42 -10.580 0.435 -1.430 1.00 0.00 C ATOM 640 CD1 ILE A 42 -10.225 -0.324 1.454 1.00 0.00 C ATOM 0 H ILE A 42 -9.926 -3.456 -0.856 1.00 0.00 H new ATOM 0 HA ILE A 42 -11.986 -1.905 -1.953 1.00 0.00 H new ATOM 0 HB ILE A 42 -9.196 -1.129 -1.001 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -11.888 -1.160 0.411 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -10.573 -2.285 0.689 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -10.134 1.130 -0.718 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -10.164 0.614 -2.421 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -11.659 0.586 -1.457 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -10.641 -0.569 2.431 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -9.141 -0.436 1.483 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -10.476 0.706 1.201 1.00 0.00 H new ATOM 652 N LYS A 43 -9.107 -1.635 -3.588 1.00 0.00 N ATOM 653 CA LYS A 43 -8.527 -1.335 -4.891 1.00 0.00 C ATOM 654 C LYS A 43 -9.229 -2.132 -5.984 1.00 0.00 C ATOM 655 O LYS A 43 -9.605 -1.585 -7.020 1.00 0.00 O ATOM 656 CB LYS A 43 -7.029 -1.647 -4.890 1.00 0.00 C ATOM 657 CG LYS A 43 -6.331 -1.288 -6.191 1.00 0.00 C ATOM 658 CD LYS A 43 -6.662 -2.284 -7.291 1.00 0.00 C ATOM 659 CE LYS A 43 -5.739 -3.491 -7.244 1.00 0.00 C ATOM 660 NZ LYS A 43 -5.565 -4.110 -8.588 1.00 0.00 N ATOM 0 H LYS A 43 -8.424 -1.819 -2.853 1.00 0.00 H new ATOM 0 HA LYS A 43 -8.664 -0.273 -5.093 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -6.554 -1.106 -4.072 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -6.888 -2.710 -4.693 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -6.630 -0.287 -6.502 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -5.253 -1.263 -6.033 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -7.697 -2.611 -7.188 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -6.577 -1.797 -8.262 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -4.767 -3.189 -6.855 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -6.144 -4.231 -6.553 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -4.929 -4.929 -8.513 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -6.489 -4.421 -8.949 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -5.155 -3.412 -9.241 1.00 0.00 H new ATOM 674 N LYS A 44 -9.412 -3.427 -5.743 1.00 0.00 N ATOM 675 CA LYS A 44 -10.080 -4.293 -6.706 1.00 0.00 C ATOM 676 C LYS A 44 -11.428 -3.707 -7.103 1.00 0.00 C ATOM 677 O LYS A 44 -11.648 -3.350 -8.261 1.00 0.00 O ATOM 678 CB LYS A 44 -10.269 -5.696 -6.123 1.00 0.00 C ATOM 679 CG LYS A 44 -9.666 -6.798 -6.980 1.00 0.00 C ATOM 680 CD LYS A 44 -9.419 -8.063 -6.171 1.00 0.00 C ATOM 681 CE LYS A 44 -8.403 -8.970 -6.847 1.00 0.00 C ATOM 682 NZ LYS A 44 -8.671 -9.122 -8.303 1.00 0.00 N ATOM 0 H LYS A 44 -9.107 -3.898 -4.891 1.00 0.00 H new ATOM 0 HA LYS A 44 -9.453 -4.364 -7.595 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -9.819 -5.732 -5.131 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -11.335 -5.887 -5.997 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -10.335 -7.021 -7.811 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -8.727 -6.452 -7.411 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -9.064 -7.796 -5.176 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -10.358 -8.601 -6.040 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -7.402 -8.563 -6.703 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -8.420 -9.951 -6.371 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -8.129 -9.929 -8.673 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -9.686 -9.289 -8.454 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -8.385 -8.255 -8.801 1.00 0.00 H new ATOM 696 N GLU A 45 -12.325 -3.599 -6.130 1.00 0.00 N ATOM 697 CA GLU A 45 -13.650 -3.045 -6.372 1.00 0.00 C ATOM 698 C GLU A 45 -13.549 -1.771 -7.203 1.00 0.00 C ATOM 699 O GLU A 45 -14.124 -1.678 -8.286 1.00 0.00 O ATOM 700 CB GLU A 45 -14.355 -2.749 -5.046 1.00 0.00 C ATOM 701 CG GLU A 45 -15.836 -2.441 -5.199 1.00 0.00 C ATOM 702 CD GLU A 45 -16.603 -3.570 -5.858 1.00 0.00 C ATOM 703 OE1 GLU A 45 -15.986 -4.337 -6.627 1.00 0.00 O ATOM 704 OE2 GLU A 45 -17.821 -3.688 -5.605 1.00 0.00 O ATOM 0 H GLU A 45 -12.158 -3.888 -5.166 1.00 0.00 H new ATOM 0 HA GLU A 45 -14.234 -3.781 -6.925 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -14.237 -3.606 -4.383 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -13.864 -1.903 -4.564 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -16.265 -2.241 -4.217 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -15.955 -1.533 -5.790 1.00 0.00 H new ATOM 711 N PHE A 46 -12.807 -0.794 -6.690 1.00 0.00 N ATOM 712 CA PHE A 46 -12.624 0.471 -7.389 1.00 0.00 C ATOM 713 C PHE A 46 -12.135 0.231 -8.813 1.00 0.00 C ATOM 714 O PHE A 46 -12.566 0.902 -9.751 1.00 0.00 O ATOM 715 CB PHE A 46 -11.631 1.356 -6.635 1.00 0.00 C ATOM 716 CG PHE A 46 -12.289 2.430 -5.815 1.00 0.00 C ATOM 717 CD1 PHE A 46 -13.003 2.105 -4.673 1.00 0.00 C ATOM 718 CD2 PHE A 46 -12.195 3.761 -6.188 1.00 0.00 C ATOM 719 CE1 PHE A 46 -13.611 3.090 -3.917 1.00 0.00 C ATOM 720 CE2 PHE A 46 -12.801 4.749 -5.436 1.00 0.00 C ATOM 721 CZ PHE A 46 -13.510 4.413 -4.299 1.00 0.00 C ATOM 0 H PHE A 46 -12.324 -0.855 -5.794 1.00 0.00 H new ATOM 0 HA PHE A 46 -13.587 0.980 -7.433 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -11.023 0.731 -5.981 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -10.953 1.820 -7.351 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -13.085 1.072 -4.370 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -11.642 4.029 -7.076 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -14.165 2.825 -3.028 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -12.720 5.783 -5.737 1.00 0.00 H new ATOM 0 HZ PHE A 46 -13.984 5.184 -3.710 1.00 0.00 H new ATOM 731 N ASP A 47 -11.237 -0.738 -8.967 1.00 0.00 N ATOM 732 CA ASP A 47 -10.696 -1.074 -10.277 1.00 0.00 C ATOM 733 C ASP A 47 -11.808 -1.556 -11.202 1.00 0.00 C ATOM 734 O ASP A 47 -11.702 -1.459 -12.425 1.00 0.00 O ATOM 735 CB ASP A 47 -9.619 -2.153 -10.144 1.00 0.00 C ATOM 736 CG ASP A 47 -9.155 -2.677 -11.489 1.00 0.00 C ATOM 737 OD1 ASP A 47 -9.925 -3.418 -12.136 1.00 0.00 O ATOM 738 OD2 ASP A 47 -8.021 -2.348 -11.896 1.00 0.00 O ATOM 0 H ASP A 47 -10.870 -1.303 -8.201 1.00 0.00 H new ATOM 0 HA ASP A 47 -10.246 -0.179 -10.707 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -8.766 -1.745 -9.602 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -10.009 -2.980 -9.550 1.00 0.00 H new ATOM 743 N LYS A 48 -12.876 -2.074 -10.606 1.00 0.00 N ATOM 744 CA LYS A 48 -14.012 -2.569 -11.368 1.00 0.00 C ATOM 745 C LYS A 48 -15.275 -1.784 -11.029 1.00 0.00 C ATOM 746 O LYS A 48 -16.366 -2.105 -11.502 1.00 0.00 O ATOM 747 CB LYS A 48 -14.227 -4.058 -11.089 1.00 0.00 C ATOM 748 CG LYS A 48 -13.590 -4.970 -12.125 1.00 0.00 C ATOM 749 CD LYS A 48 -14.553 -5.291 -13.257 1.00 0.00 C ATOM 750 CE LYS A 48 -15.065 -4.027 -13.928 1.00 0.00 C ATOM 751 NZ LYS A 48 -14.856 -4.058 -15.402 1.00 0.00 N ATOM 0 H LYS A 48 -12.977 -2.161 -9.595 1.00 0.00 H new ATOM 0 HA LYS A 48 -13.798 -2.434 -12.428 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -13.819 -4.297 -10.107 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -15.297 -4.260 -11.048 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -12.697 -4.493 -12.530 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -13.268 -5.895 -11.647 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -14.053 -5.919 -13.995 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -15.395 -5.864 -12.869 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -16.127 -3.907 -13.714 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -14.555 -3.160 -13.507 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -15.218 -3.179 -15.823 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -13.840 -4.147 -15.607 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -15.363 -4.870 -15.808 1.00 0.00 H new ATOM 765 N LYS A 49 -15.117 -0.753 -10.204 1.00 0.00 N ATOM 766 CA LYS A 49 -16.239 0.081 -9.796 1.00 0.00 C ATOM 767 C LYS A 49 -16.171 1.450 -10.463 1.00 0.00 C ATOM 768 O LYS A 49 -17.144 2.204 -10.454 1.00 0.00 O ATOM 769 CB LYS A 49 -16.251 0.247 -8.275 1.00 0.00 C ATOM 770 CG LYS A 49 -17.513 -0.278 -7.612 1.00 0.00 C ATOM 771 CD LYS A 49 -18.749 0.464 -8.096 1.00 0.00 C ATOM 772 CE LYS A 49 -19.413 1.236 -6.966 1.00 0.00 C ATOM 773 NZ LYS A 49 -19.707 2.644 -7.353 1.00 0.00 N ATOM 0 H LYS A 49 -14.220 -0.476 -9.805 1.00 0.00 H new ATOM 0 HA LYS A 49 -17.158 -0.413 -10.111 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -15.389 -0.271 -7.855 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -16.137 1.304 -8.033 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -17.620 -1.342 -7.824 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -17.426 -0.175 -6.530 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -18.472 1.152 -8.895 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -19.459 -0.247 -8.519 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -20.339 0.737 -6.681 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -18.764 1.228 -6.090 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -20.159 3.136 -6.556 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -18.821 3.128 -7.601 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -20.347 2.652 -8.173 1.00 0.00 H new ATOM 787 N TYR A 50 -15.015 1.768 -11.035 1.00 0.00 N ATOM 788 CA TYR A 50 -14.823 3.051 -11.699 1.00 0.00 C ATOM 789 C TYR A 50 -13.904 2.915 -12.909 1.00 0.00 C ATOM 790 O TYR A 50 -14.322 3.156 -14.041 1.00 0.00 O ATOM 791 CB TYR A 50 -14.245 4.070 -10.714 1.00 0.00 C ATOM 792 CG TYR A 50 -14.870 3.996 -9.339 1.00 0.00 C ATOM 793 CD1 TYR A 50 -14.357 3.144 -8.367 1.00 0.00 C ATOM 794 CD2 TYR A 50 -15.975 4.773 -9.013 1.00 0.00 C ATOM 795 CE1 TYR A 50 -14.927 3.070 -7.111 1.00 0.00 C ATOM 796 CE2 TYR A 50 -16.549 4.705 -7.758 1.00 0.00 C ATOM 797 CZ TYR A 50 -16.023 3.852 -6.811 1.00 0.00 C ATOM 798 OH TYR A 50 -16.594 3.781 -5.562 1.00 0.00 O ATOM 0 H TYR A 50 -14.199 1.156 -11.052 1.00 0.00 H new ATOM 0 HA TYR A 50 -15.795 3.399 -12.049 1.00 0.00 H new ATOM 0 HB2 TYR A 50 -13.170 3.910 -10.626 1.00 0.00 H new ATOM 0 HB3 TYR A 50 -14.386 5.073 -11.116 1.00 0.00 H new ATOM 0 HD1 TYR A 50 -13.499 2.530 -8.598 1.00 0.00 H new ATOM 0 HD2 TYR A 50 -16.392 5.441 -9.752 1.00 0.00 H new ATOM 0 HE1 TYR A 50 -14.516 2.403 -6.367 1.00 0.00 H new ATOM 0 HE2 TYR A 50 -17.406 5.317 -7.520 1.00 0.00 H new ATOM 0 HH TYR A 50 -15.891 3.789 -4.880 1.00 0.00 H new ATOM 808 N ASN A 51 -12.654 2.528 -12.657 1.00 0.00 N ATOM 809 CA ASN A 51 -11.657 2.356 -13.711 1.00 0.00 C ATOM 810 C ASN A 51 -10.251 2.474 -13.129 1.00 0.00 C ATOM 811 O ASN A 51 -9.874 3.527 -12.613 1.00 0.00 O ATOM 812 CB ASN A 51 -11.844 3.397 -14.819 1.00 0.00 C ATOM 813 CG ASN A 51 -11.275 4.751 -14.442 1.00 0.00 C ATOM 814 OD1 ASN A 51 -11.367 5.178 -13.291 1.00 0.00 O ATOM 815 ND2 ASN A 51 -10.686 5.435 -15.416 1.00 0.00 N ATOM 0 H ASN A 51 -12.306 2.326 -11.720 1.00 0.00 H new ATOM 0 HA ASN A 51 -11.789 1.363 -14.142 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -11.361 3.044 -15.730 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -12.906 3.501 -15.040 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -10.287 6.354 -15.225 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -10.633 5.041 -16.356 1.00 0.00 H new ATOM 822 N PRO A 52 -9.451 1.396 -13.202 1.00 0.00 N ATOM 823 CA PRO A 52 -8.083 1.394 -12.675 1.00 0.00 C ATOM 824 C PRO A 52 -7.228 2.512 -13.279 1.00 0.00 C ATOM 825 O PRO A 52 -7.684 3.222 -14.175 1.00 0.00 O ATOM 826 CB PRO A 52 -7.535 0.019 -13.077 1.00 0.00 C ATOM 827 CG PRO A 52 -8.468 -0.488 -14.125 1.00 0.00 C ATOM 828 CD PRO A 52 -9.808 0.100 -13.798 1.00 0.00 C ATOM 0 HA PRO A 52 -8.064 1.569 -11.599 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -6.518 0.098 -13.461 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -7.501 -0.656 -12.222 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -8.140 -0.185 -15.120 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -8.507 -1.577 -14.120 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -10.427 0.219 -14.687 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -10.367 -0.526 -13.103 1.00 0.00 H new ATOM 836 N THR A 53 -5.985 2.679 -12.795 1.00 0.00 N ATOM 837 CA THR A 53 -5.423 1.848 -11.730 1.00 0.00 C ATOM 838 C THR A 53 -5.418 2.604 -10.407 1.00 0.00 C ATOM 839 O THR A 53 -4.856 3.694 -10.308 1.00 0.00 O ATOM 840 CB THR A 53 -4.002 1.415 -12.093 1.00 0.00 C ATOM 841 OG1 THR A 53 -4.017 0.502 -13.175 1.00 0.00 O ATOM 842 CG2 THR A 53 -3.266 0.759 -10.946 1.00 0.00 C ATOM 0 H THR A 53 -5.345 3.397 -13.136 1.00 0.00 H new ATOM 0 HA THR A 53 -6.046 0.961 -11.620 1.00 0.00 H new ATOM 0 HB THR A 53 -3.479 2.333 -12.360 1.00 0.00 H new ATOM 0 HG1 THR A 53 -3.099 0.238 -13.393 1.00 0.00 H new ATOM 0 HG21 THR A 53 -2.265 0.476 -11.271 1.00 0.00 H new ATOM 0 HG22 THR A 53 -3.193 1.458 -10.113 1.00 0.00 H new ATOM 0 HG23 THR A 53 -3.809 -0.131 -10.627 1.00 0.00 H new ATOM 850 N TRP A 54 -6.059 2.028 -9.396 1.00 0.00 N ATOM 851 CA TRP A 54 -6.139 2.663 -8.085 1.00 0.00 C ATOM 852 C TRP A 54 -5.075 2.141 -7.127 1.00 0.00 C ATOM 853 O TRP A 54 -4.959 0.937 -6.898 1.00 0.00 O ATOM 854 CB TRP A 54 -7.526 2.444 -7.479 1.00 0.00 C ATOM 855 CG TRP A 54 -8.635 2.920 -8.361 1.00 0.00 C ATOM 856 CD1 TRP A 54 -9.136 2.287 -9.459 1.00 0.00 C ATOM 857 CD2 TRP A 54 -9.377 4.135 -8.223 1.00 0.00 C ATOM 858 NE1 TRP A 54 -10.145 3.035 -10.014 1.00 0.00 N ATOM 859 CE2 TRP A 54 -10.313 4.174 -9.273 1.00 0.00 C ATOM 860 CE3 TRP A 54 -9.340 5.195 -7.313 1.00 0.00 C ATOM 861 CZ2 TRP A 54 -11.204 5.230 -9.437 1.00 0.00 C ATOM 862 CZ3 TRP A 54 -10.225 6.243 -7.478 1.00 0.00 C ATOM 863 CH2 TRP A 54 -11.147 6.253 -8.532 1.00 0.00 C ATOM 0 H TRP A 54 -6.530 1.125 -9.458 1.00 0.00 H new ATOM 0 HA TRP A 54 -5.961 3.728 -8.231 1.00 0.00 H new ATOM 0 HB2 TRP A 54 -7.663 1.382 -7.275 1.00 0.00 H new ATOM 0 HB3 TRP A 54 -7.583 2.962 -6.522 1.00 0.00 H new ATOM 0 HD1 TRP A 54 -8.790 1.336 -9.837 1.00 0.00 H new ATOM 0 HE1 TRP A 54 -10.682 2.783 -10.844 1.00 0.00 H new ATOM 0 HE3 TRP A 54 -8.633 5.195 -6.496 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 -11.915 5.241 -10.250 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 -10.205 7.069 -6.782 1.00 0.00 H new ATOM 0 HH2 TRP A 54 -11.827 7.086 -8.632 1.00 0.00 H new ATOM 874 N HIS A 55 -4.322 3.070 -6.548 1.00 0.00 N ATOM 875 CA HIS A 55 -3.284 2.734 -5.584 1.00 0.00 C ATOM 876 C HIS A 55 -3.758 3.130 -4.192 1.00 0.00 C ATOM 877 O HIS A 55 -3.669 4.296 -3.808 1.00 0.00 O ATOM 878 CB HIS A 55 -1.977 3.461 -5.917 1.00 0.00 C ATOM 879 CG HIS A 55 -1.715 3.608 -7.386 1.00 0.00 C ATOM 880 ND1 HIS A 55 -2.676 3.403 -8.354 1.00 0.00 N ATOM 881 CD2 HIS A 55 -0.585 3.949 -8.050 1.00 0.00 C ATOM 882 CE1 HIS A 55 -2.149 3.611 -9.547 1.00 0.00 C ATOM 883 NE2 HIS A 55 -0.881 3.944 -9.390 1.00 0.00 N ATOM 0 H HIS A 55 -4.414 4.069 -6.733 1.00 0.00 H new ATOM 0 HA HIS A 55 -3.094 1.661 -5.622 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -1.999 4.451 -5.462 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -1.147 2.920 -5.463 1.00 0.00 H new ATOM 0 HD2 HIS A 55 0.372 4.182 -7.607 1.00 0.00 H new ATOM 0 HE1 HIS A 55 -2.667 3.524 -10.491 1.00 0.00 H new ATOM 0 HE2 HIS A 55 -0.228 4.162 -10.142 1.00 0.00 H new ATOM 892 N CYS A 56 -4.296 2.170 -3.450 1.00 0.00 N ATOM 893 CA CYS A 56 -4.816 2.453 -2.119 1.00 0.00 C ATOM 894 C CYS A 56 -3.982 1.813 -1.018 1.00 0.00 C ATOM 895 O CYS A 56 -3.428 0.728 -1.188 1.00 0.00 O ATOM 896 CB CYS A 56 -6.263 1.973 -2.012 1.00 0.00 C ATOM 897 SG CYS A 56 -6.445 0.175 -1.982 1.00 0.00 S ATOM 0 H CYS A 56 -4.383 1.197 -3.744 1.00 0.00 H new ATOM 0 HA CYS A 56 -4.767 3.533 -1.979 1.00 0.00 H new ATOM 0 HB2 CYS A 56 -6.706 2.387 -1.106 1.00 0.00 H new ATOM 0 HB3 CYS A 56 -6.829 2.371 -2.854 1.00 0.00 H new ATOM 0 HG CYS A 56 -6.088 -0.278 -0.817 1.00 0.00 H new ATOM 903 N ILE A 57 -3.919 2.499 0.119 1.00 0.00 N ATOM 904 CA ILE A 57 -3.181 2.016 1.282 1.00 0.00 C ATOM 905 C ILE A 57 -4.030 2.153 2.542 1.00 0.00 C ATOM 906 O ILE A 57 -4.287 3.262 3.008 1.00 0.00 O ATOM 907 CB ILE A 57 -1.860 2.787 1.488 1.00 0.00 C ATOM 908 CG1 ILE A 57 -1.023 2.793 0.201 1.00 0.00 C ATOM 909 CG2 ILE A 57 -1.070 2.185 2.642 1.00 0.00 C ATOM 910 CD1 ILE A 57 -0.912 1.443 -0.471 1.00 0.00 C ATOM 0 H ILE A 57 -4.375 3.400 0.260 1.00 0.00 H new ATOM 0 HA ILE A 57 -2.946 0.968 1.097 1.00 0.00 H new ATOM 0 HB ILE A 57 -2.101 3.821 1.736 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -1.462 3.501 -0.502 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -0.021 3.154 0.434 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -0.141 2.739 2.775 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -1.661 2.242 3.556 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -0.842 1.142 2.422 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -0.305 1.534 -1.372 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -0.444 0.734 0.212 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -1.907 1.087 -0.738 1.00 0.00 H new ATOM 922 N VAL A 58 -4.473 1.023 3.083 1.00 0.00 N ATOM 923 CA VAL A 58 -5.306 1.028 4.280 1.00 0.00 C ATOM 924 C VAL A 58 -4.555 0.496 5.494 1.00 0.00 C ATOM 925 O VAL A 58 -4.035 -0.620 5.475 1.00 0.00 O ATOM 926 CB VAL A 58 -6.577 0.189 4.071 1.00 0.00 C ATOM 927 CG1 VAL A 58 -6.219 -1.188 3.541 1.00 0.00 C ATOM 928 CG2 VAL A 58 -7.368 0.088 5.366 1.00 0.00 C ATOM 0 H VAL A 58 -4.270 0.095 2.713 1.00 0.00 H new ATOM 0 HA VAL A 58 -5.580 2.067 4.465 1.00 0.00 H new ATOM 0 HB VAL A 58 -7.206 0.684 3.331 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -7.129 -1.771 3.398 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -5.699 -1.087 2.588 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -5.572 -1.696 4.256 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -8.264 -0.509 5.199 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -6.754 -0.386 6.132 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -7.654 1.087 5.697 1.00 0.00 H new ATOM 938 N GLY A 59 -4.512 1.300 6.553 1.00 0.00 N ATOM 939 CA GLY A 59 -3.832 0.897 7.768 1.00 0.00 C ATOM 940 C GLY A 59 -4.506 1.449 9.007 1.00 0.00 C ATOM 941 O GLY A 59 -5.730 1.409 9.122 1.00 0.00 O ATOM 0 H GLY A 59 -4.938 2.226 6.589 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -3.806 -0.191 7.824 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -2.798 1.240 7.735 1.00 0.00 H new ATOM 945 N ARG A 60 -3.711 1.961 9.938 1.00 0.00 N ATOM 946 CA ARG A 60 -4.248 2.515 11.168 1.00 0.00 C ATOM 947 C ARG A 60 -3.241 3.439 11.846 1.00 0.00 C ATOM 948 O ARG A 60 -3.610 4.276 12.669 1.00 0.00 O ATOM 949 CB ARG A 60 -4.632 1.381 12.111 1.00 0.00 C ATOM 950 CG ARG A 60 -3.693 0.189 12.042 1.00 0.00 C ATOM 951 CD ARG A 60 -4.409 -1.104 12.394 1.00 0.00 C ATOM 952 NE ARG A 60 -3.481 -2.151 12.809 1.00 0.00 N ATOM 953 CZ ARG A 60 -3.793 -3.108 13.678 1.00 0.00 C ATOM 954 NH1 ARG A 60 -5.003 -3.145 14.220 1.00 0.00 N ATOM 955 NH2 ARG A 60 -2.899 -4.030 14.003 1.00 0.00 N ATOM 0 H ARG A 60 -2.695 2.003 9.862 1.00 0.00 H new ATOM 0 HA ARG A 60 -5.131 3.105 10.923 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -4.650 1.760 13.133 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -5.644 1.050 11.875 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -3.273 0.112 11.039 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -2.858 0.342 12.726 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -5.124 -0.915 13.195 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -4.980 -1.448 11.532 1.00 0.00 H new ATOM 0 HE ARG A 60 -2.542 -2.149 12.411 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -5.695 -2.439 13.970 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -5.241 -3.880 14.886 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -1.968 -4.007 13.586 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -3.141 -4.763 14.670 1.00 0.00 H new ATOM 969 N ASN A 61 -1.967 3.283 11.497 1.00 0.00 N ATOM 970 CA ASN A 61 -0.915 4.106 12.081 1.00 0.00 C ATOM 971 C ASN A 61 0.293 4.205 11.153 1.00 0.00 C ATOM 972 O ASN A 61 1.434 4.253 11.613 1.00 0.00 O ATOM 973 CB ASN A 61 -0.486 3.532 13.432 1.00 0.00 C ATOM 974 CG ASN A 61 -1.178 4.215 14.598 1.00 0.00 C ATOM 975 OD1 ASN A 61 -1.272 5.441 14.648 1.00 0.00 O ATOM 976 ND2 ASN A 61 -1.665 3.419 15.544 1.00 0.00 N ATOM 0 H ASN A 61 -1.640 2.598 10.816 1.00 0.00 H new ATOM 0 HA ASN A 61 -1.316 5.109 12.224 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -0.707 2.465 13.457 1.00 0.00 H new ATOM 0 HB3 ASN A 61 0.593 3.637 13.542 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -2.140 3.820 16.353 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -1.564 2.407 15.461 1.00 0.00 H new ATOM 983 N PHE A 62 0.040 4.239 9.848 1.00 0.00 N ATOM 984 CA PHE A 62 1.114 4.338 8.871 1.00 0.00 C ATOM 985 C PHE A 62 1.237 5.764 8.348 1.00 0.00 C ATOM 986 O PHE A 62 0.507 6.658 8.776 1.00 0.00 O ATOM 987 CB PHE A 62 0.866 3.376 7.710 1.00 0.00 C ATOM 988 CG PHE A 62 -0.127 3.892 6.709 1.00 0.00 C ATOM 989 CD1 PHE A 62 0.277 4.741 5.692 1.00 0.00 C ATOM 990 CD2 PHE A 62 -1.462 3.534 6.789 1.00 0.00 C ATOM 991 CE1 PHE A 62 -0.631 5.222 4.770 1.00 0.00 C ATOM 992 CE2 PHE A 62 -2.376 4.012 5.869 1.00 0.00 C ATOM 993 CZ PHE A 62 -1.962 4.856 4.859 1.00 0.00 C ATOM 0 H PHE A 62 -0.897 4.200 9.446 1.00 0.00 H new ATOM 0 HA PHE A 62 2.048 4.067 9.363 1.00 0.00 H new ATOM 0 HB2 PHE A 62 1.811 3.178 7.204 1.00 0.00 H new ATOM 0 HB3 PHE A 62 0.511 2.425 8.106 1.00 0.00 H new ATOM 0 HD1 PHE A 62 1.315 5.030 5.619 1.00 0.00 H new ATOM 0 HD2 PHE A 62 -1.792 2.875 7.578 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -0.303 5.883 3.981 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -3.415 3.725 5.941 1.00 0.00 H new ATOM 0 HZ PHE A 62 -2.675 5.230 4.140 1.00 0.00 H new ATOM 1003 N GLY A 63 2.165 5.967 7.421 1.00 0.00 N ATOM 1004 CA GLY A 63 2.372 7.284 6.850 1.00 0.00 C ATOM 1005 C GLY A 63 2.554 7.224 5.350 1.00 0.00 C ATOM 1006 O GLY A 63 3.587 6.767 4.863 1.00 0.00 O ATOM 0 H GLY A 63 2.780 5.241 7.054 1.00 0.00 H new ATOM 0 HA2 GLY A 63 1.520 7.921 7.087 1.00 0.00 H new ATOM 0 HA3 GLY A 63 3.250 7.743 7.304 1.00 0.00 H new ATOM 1010 N SER A 64 1.546 7.672 4.613 1.00 0.00 N ATOM 1011 CA SER A 64 1.608 7.647 3.159 1.00 0.00 C ATOM 1012 C SER A 64 2.150 8.953 2.596 1.00 0.00 C ATOM 1013 O SER A 64 1.689 10.040 2.948 1.00 0.00 O ATOM 1014 CB SER A 64 0.229 7.356 2.565 1.00 0.00 C ATOM 1015 OG SER A 64 -0.736 8.279 3.038 1.00 0.00 O ATOM 0 H SER A 64 0.681 8.055 4.996 1.00 0.00 H new ATOM 0 HA SER A 64 2.294 6.848 2.878 1.00 0.00 H new ATOM 0 HB2 SER A 64 0.281 7.405 1.477 1.00 0.00 H new ATOM 0 HB3 SER A 64 -0.075 6.342 2.825 1.00 0.00 H new ATOM 0 HG SER A 64 -1.555 7.800 3.283 1.00 0.00 H new ATOM 1021 N TYR A 65 3.127 8.830 1.707 1.00 0.00 N ATOM 1022 CA TYR A 65 3.743 9.984 1.068 1.00 0.00 C ATOM 1023 C TYR A 65 3.930 9.720 -0.423 1.00 0.00 C ATOM 1024 O TYR A 65 5.050 9.510 -0.893 1.00 0.00 O ATOM 1025 CB TYR A 65 5.089 10.303 1.722 1.00 0.00 C ATOM 1026 CG TYR A 65 5.668 11.635 1.297 1.00 0.00 C ATOM 1027 CD1 TYR A 65 5.094 12.829 1.715 1.00 0.00 C ATOM 1028 CD2 TYR A 65 6.788 11.696 0.479 1.00 0.00 C ATOM 1029 CE1 TYR A 65 5.620 14.047 1.329 1.00 0.00 C ATOM 1030 CE2 TYR A 65 7.321 12.911 0.088 1.00 0.00 C ATOM 1031 CZ TYR A 65 6.732 14.083 0.515 1.00 0.00 C ATOM 1032 OH TYR A 65 7.260 15.294 0.129 1.00 0.00 O ATOM 0 H TYR A 65 3.512 7.933 1.410 1.00 0.00 H new ATOM 0 HA TYR A 65 3.085 10.844 1.194 1.00 0.00 H new ATOM 0 HB2 TYR A 65 4.968 10.298 2.805 1.00 0.00 H new ATOM 0 HB3 TYR A 65 5.799 9.513 1.477 1.00 0.00 H new ATOM 0 HD1 TYR A 65 4.222 12.805 2.352 1.00 0.00 H new ATOM 0 HD2 TYR A 65 7.251 10.780 0.142 1.00 0.00 H new ATOM 0 HE1 TYR A 65 5.162 14.966 1.663 1.00 0.00 H new ATOM 0 HE2 TYR A 65 8.193 12.942 -0.548 1.00 0.00 H new ATOM 0 HH TYR A 65 7.089 15.962 0.825 1.00 0.00 H new ATOM 1042 N VAL A 66 2.822 9.721 -1.156 1.00 0.00 N ATOM 1043 CA VAL A 66 2.854 9.473 -2.591 1.00 0.00 C ATOM 1044 C VAL A 66 2.244 10.634 -3.367 1.00 0.00 C ATOM 1045 O VAL A 66 1.198 11.163 -2.992 1.00 0.00 O ATOM 1046 CB VAL A 66 2.097 8.182 -2.953 1.00 0.00 C ATOM 1047 CG1 VAL A 66 2.557 7.031 -2.074 1.00 0.00 C ATOM 1048 CG2 VAL A 66 0.596 8.391 -2.826 1.00 0.00 C ATOM 0 H VAL A 66 1.890 9.891 -0.779 1.00 0.00 H new ATOM 0 HA VAL A 66 3.903 9.365 -2.867 1.00 0.00 H new ATOM 0 HB VAL A 66 2.320 7.930 -3.990 1.00 0.00 H new ATOM 0 HG11 VAL A 66 2.011 6.127 -2.344 1.00 0.00 H new ATOM 0 HG12 VAL A 66 3.625 6.867 -2.218 1.00 0.00 H new ATOM 0 HG13 VAL A 66 2.365 7.272 -1.029 1.00 0.00 H new ATOM 0 HG21 VAL A 66 0.077 7.468 -3.086 1.00 0.00 H new ATOM 0 HG22 VAL A 66 0.353 8.668 -1.800 1.00 0.00 H new ATOM 0 HG23 VAL A 66 0.281 9.187 -3.501 1.00 0.00 H new ATOM 1058 N THR A 67 2.903 11.020 -4.452 1.00 0.00 N ATOM 1059 CA THR A 67 2.424 12.116 -5.286 1.00 0.00 C ATOM 1060 C THR A 67 1.129 11.734 -6.000 1.00 0.00 C ATOM 1061 O THR A 67 1.107 10.816 -6.819 1.00 0.00 O ATOM 1062 CB THR A 67 3.485 12.506 -6.312 1.00 0.00 C ATOM 1063 OG1 THR A 67 3.179 13.757 -6.903 1.00 0.00 O ATOM 1064 CG2 THR A 67 3.629 11.495 -7.426 1.00 0.00 C ATOM 0 H THR A 67 3.770 10.591 -4.775 1.00 0.00 H new ATOM 0 HA THR A 67 2.223 12.969 -4.637 1.00 0.00 H new ATOM 0 HB THR A 67 4.422 12.554 -5.758 1.00 0.00 H new ATOM 0 HG1 THR A 67 3.872 13.989 -7.556 1.00 0.00 H new ATOM 0 HG21 THR A 67 4.398 11.829 -8.123 1.00 0.00 H new ATOM 0 HG22 THR A 67 3.913 10.530 -7.007 1.00 0.00 H new ATOM 0 HG23 THR A 67 2.680 11.396 -7.953 1.00 0.00 H new ATOM 1072 N HIS A 68 0.053 12.449 -5.687 1.00 0.00 N ATOM 1073 CA HIS A 68 -1.243 12.187 -6.301 1.00 0.00 C ATOM 1074 C HIS A 68 -1.387 12.959 -7.609 1.00 0.00 C ATOM 1075 O HIS A 68 -0.642 13.903 -7.868 1.00 0.00 O ATOM 1076 CB HIS A 68 -2.374 12.569 -5.342 1.00 0.00 C ATOM 1077 CG HIS A 68 -2.392 14.022 -4.985 1.00 0.00 C ATOM 1078 ND1 HIS A 68 -1.341 14.656 -4.354 1.00 0.00 N ATOM 1079 CD2 HIS A 68 -3.342 14.969 -5.173 1.00 0.00 C ATOM 1080 CE1 HIS A 68 -1.644 15.929 -4.169 1.00 0.00 C ATOM 1081 NE2 HIS A 68 -2.852 16.144 -4.657 1.00 0.00 N ATOM 0 H HIS A 68 0.053 13.214 -5.012 1.00 0.00 H new ATOM 0 HA HIS A 68 -1.307 11.121 -6.518 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -3.329 12.303 -5.795 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -2.280 11.980 -4.429 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -4.305 14.827 -5.641 1.00 0.00 H new ATOM 0 HE1 HIS A 68 -1.012 16.667 -3.699 1.00 0.00 H new ATOM 0 HE2 HIS A 68 -3.342 17.038 -4.652 1.00 0.00 H new ATOM 1090 N GLU A 69 -2.346 12.550 -8.435 1.00 0.00 N ATOM 1091 CA GLU A 69 -2.579 13.207 -9.718 1.00 0.00 C ATOM 1092 C GLU A 69 -3.992 12.938 -10.226 1.00 0.00 C ATOM 1093 O GLU A 69 -4.911 12.695 -9.443 1.00 0.00 O ATOM 1094 CB GLU A 69 -1.557 12.726 -10.748 1.00 0.00 C ATOM 1095 CG GLU A 69 -1.267 11.236 -10.666 1.00 0.00 C ATOM 1096 CD GLU A 69 -0.182 10.801 -11.631 1.00 0.00 C ATOM 1097 OE1 GLU A 69 -0.033 11.448 -12.688 1.00 0.00 O ATOM 1098 OE2 GLU A 69 0.520 9.814 -11.328 1.00 0.00 O ATOM 0 H GLU A 69 -2.973 11.769 -8.240 1.00 0.00 H new ATOM 0 HA GLU A 69 -2.467 14.281 -9.572 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -1.922 12.962 -11.748 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -0.627 13.277 -10.610 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -0.967 10.983 -9.649 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -2.180 10.679 -10.876 1.00 0.00 H new ATOM 1105 N THR A 70 -4.160 12.984 -11.544 1.00 0.00 N ATOM 1106 CA THR A 70 -5.459 12.746 -12.161 1.00 0.00 C ATOM 1107 C THR A 70 -6.564 13.480 -11.405 1.00 0.00 C ATOM 1108 O THR A 70 -6.849 14.645 -11.679 1.00 0.00 O ATOM 1109 CB THR A 70 -5.759 11.247 -12.205 1.00 0.00 C ATOM 1110 OG1 THR A 70 -7.150 11.009 -12.078 1.00 0.00 O ATOM 1111 CG2 THR A 70 -5.058 10.463 -11.116 1.00 0.00 C ATOM 0 H THR A 70 -3.410 13.184 -12.206 1.00 0.00 H new ATOM 0 HA THR A 70 -5.426 13.131 -13.180 1.00 0.00 H new ATOM 0 HB THR A 70 -5.387 10.907 -13.172 1.00 0.00 H new ATOM 0 HG1 THR A 70 -7.321 10.045 -12.110 1.00 0.00 H new ATOM 0 HG21 THR A 70 -5.314 9.407 -11.205 1.00 0.00 H new ATOM 0 HG22 THR A 70 -3.980 10.584 -11.217 1.00 0.00 H new ATOM 0 HG23 THR A 70 -5.375 10.832 -10.141 1.00 0.00 H new ATOM 1119 N LYS A 71 -7.181 12.789 -10.453 1.00 0.00 N ATOM 1120 CA LYS A 71 -8.254 13.375 -9.657 1.00 0.00 C ATOM 1121 C LYS A 71 -8.936 12.310 -8.807 1.00 0.00 C ATOM 1122 O LYS A 71 -10.074 12.484 -8.371 1.00 0.00 O ATOM 1123 CB LYS A 71 -9.284 14.052 -10.563 1.00 0.00 C ATOM 1124 CG LYS A 71 -9.234 15.571 -10.512 1.00 0.00 C ATOM 1125 CD LYS A 71 -9.392 16.084 -9.089 1.00 0.00 C ATOM 1126 CE LYS A 71 -10.691 15.604 -8.464 1.00 0.00 C ATOM 1127 NZ LYS A 71 -11.883 16.171 -9.154 1.00 0.00 N ATOM 0 H LYS A 71 -6.957 11.823 -10.214 1.00 0.00 H new ATOM 0 HA LYS A 71 -7.816 14.124 -8.997 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -9.122 13.726 -11.590 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -10.282 13.720 -10.276 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -8.286 15.919 -10.923 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -10.024 15.984 -11.139 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -8.550 15.747 -8.484 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -9.368 17.174 -9.089 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -10.732 14.516 -8.504 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -10.713 15.886 -7.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -12.744 15.902 -8.637 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -11.807 17.208 -9.184 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -11.932 15.800 -10.124 1.00 0.00 H new ATOM 1141 N HIS A 72 -8.234 11.207 -8.579 1.00 0.00 N ATOM 1142 CA HIS A 72 -8.774 10.113 -7.784 1.00 0.00 C ATOM 1143 C HIS A 72 -7.841 9.759 -6.631 1.00 0.00 C ATOM 1144 O HIS A 72 -7.335 8.640 -6.548 1.00 0.00 O ATOM 1145 CB HIS A 72 -9.008 8.885 -8.664 1.00 0.00 C ATOM 1146 CG HIS A 72 -10.003 9.119 -9.758 1.00 0.00 C ATOM 1147 ND1 HIS A 72 -11.126 9.903 -9.597 1.00 0.00 N ATOM 1148 CD2 HIS A 72 -10.039 8.669 -11.034 1.00 0.00 C ATOM 1149 CE1 HIS A 72 -11.810 9.925 -10.728 1.00 0.00 C ATOM 1150 NE2 HIS A 72 -11.171 9.185 -11.614 1.00 0.00 N ATOM 0 H HIS A 72 -7.291 11.047 -8.933 1.00 0.00 H new ATOM 0 HA HIS A 72 -9.726 10.439 -7.365 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -8.060 8.577 -9.105 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -9.352 8.060 -8.040 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -9.313 8.025 -11.507 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -12.734 10.458 -10.898 1.00 0.00 H new ATOM 0 HE2 HIS A 72 -11.470 9.022 -12.576 1.00 0.00 H new ATOM 1159 N PHE A 73 -7.626 10.719 -5.737 1.00 0.00 N ATOM 1160 CA PHE A 73 -6.765 10.510 -4.581 1.00 0.00 C ATOM 1161 C PHE A 73 -7.476 10.969 -3.314 1.00 0.00 C ATOM 1162 O PHE A 73 -7.496 12.159 -2.999 1.00 0.00 O ATOM 1163 CB PHE A 73 -5.443 11.266 -4.756 1.00 0.00 C ATOM 1164 CG PHE A 73 -4.719 11.526 -3.463 1.00 0.00 C ATOM 1165 CD1 PHE A 73 -4.342 10.476 -2.643 1.00 0.00 C ATOM 1166 CD2 PHE A 73 -4.422 12.821 -3.071 1.00 0.00 C ATOM 1167 CE1 PHE A 73 -3.679 10.712 -1.454 1.00 0.00 C ATOM 1168 CE2 PHE A 73 -3.760 13.062 -1.882 1.00 0.00 C ATOM 1169 CZ PHE A 73 -3.388 12.007 -1.072 1.00 0.00 C ATOM 0 H PHE A 73 -8.038 11.651 -5.792 1.00 0.00 H new ATOM 0 HA PHE A 73 -6.543 9.446 -4.494 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -4.792 10.694 -5.418 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -5.641 12.218 -5.249 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -4.569 9.461 -2.936 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -4.710 13.650 -3.700 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -3.389 9.884 -0.824 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -3.533 14.076 -1.586 1.00 0.00 H new ATOM 0 HZ PHE A 73 -2.871 12.194 -0.142 1.00 0.00 H new ATOM 1179 N ILE A 74 -8.070 10.023 -2.599 1.00 0.00 N ATOM 1180 CA ILE A 74 -8.796 10.341 -1.379 1.00 0.00 C ATOM 1181 C ILE A 74 -8.141 9.717 -0.151 1.00 0.00 C ATOM 1182 O ILE A 74 -7.972 8.500 -0.074 1.00 0.00 O ATOM 1183 CB ILE A 74 -10.257 9.861 -1.461 1.00 0.00 C ATOM 1184 CG1 ILE A 74 -11.100 10.590 -0.392 1.00 0.00 C ATOM 1185 CG2 ILE A 74 -10.314 8.341 -1.321 1.00 0.00 C ATOM 1186 CD1 ILE A 74 -12.193 9.760 0.263 1.00 0.00 C ATOM 0 H ILE A 74 -8.063 9.033 -2.842 1.00 0.00 H new ATOM 0 HA ILE A 74 -8.773 11.426 -1.279 1.00 0.00 H new ATOM 0 HB ILE A 74 -10.682 10.107 -2.434 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -10.430 10.955 0.387 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -11.560 11.465 -0.852 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -11.350 8.009 -1.380 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -9.739 7.880 -2.124 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -9.893 8.048 -0.359 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -12.722 10.369 0.996 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -12.894 9.417 -0.498 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -11.747 8.899 0.760 1.00 0.00 H new ATOM 1198 N TYR A 75 -7.790 10.560 0.814 1.00 0.00 N ATOM 1199 CA TYR A 75 -7.172 10.093 2.048 1.00 0.00 C ATOM 1200 C TYR A 75 -8.100 10.343 3.232 1.00 0.00 C ATOM 1201 O TYR A 75 -8.715 11.405 3.337 1.00 0.00 O ATOM 1202 CB TYR A 75 -5.830 10.789 2.278 1.00 0.00 C ATOM 1203 CG TYR A 75 -4.962 10.090 3.300 1.00 0.00 C ATOM 1204 CD1 TYR A 75 -4.752 8.718 3.236 1.00 0.00 C ATOM 1205 CD2 TYR A 75 -4.356 10.799 4.328 1.00 0.00 C ATOM 1206 CE1 TYR A 75 -3.963 8.072 4.169 1.00 0.00 C ATOM 1207 CE2 TYR A 75 -3.565 10.161 5.266 1.00 0.00 C ATOM 1208 CZ TYR A 75 -3.372 8.798 5.181 1.00 0.00 C ATOM 1209 OH TYR A 75 -2.586 8.158 6.113 1.00 0.00 O ATOM 0 H TYR A 75 -7.923 11.570 0.765 1.00 0.00 H new ATOM 0 HA TYR A 75 -6.995 9.021 1.957 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -5.291 10.846 1.332 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -6.011 11.813 2.604 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -5.213 8.147 2.444 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -4.505 11.867 4.396 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -3.810 7.005 4.106 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -3.101 10.727 6.060 1.00 0.00 H new ATOM 0 HH TYR A 75 -2.384 7.251 5.803 1.00 0.00 H new ATOM 1219 N PHE A 76 -8.203 9.360 4.118 1.00 0.00 N ATOM 1220 CA PHE A 76 -9.063 9.475 5.290 1.00 0.00 C ATOM 1221 C PHE A 76 -8.671 8.465 6.362 1.00 0.00 C ATOM 1222 O PHE A 76 -7.821 7.603 6.140 1.00 0.00 O ATOM 1223 CB PHE A 76 -10.525 9.264 4.895 1.00 0.00 C ATOM 1224 CG PHE A 76 -10.725 8.176 3.878 1.00 0.00 C ATOM 1225 CD1 PHE A 76 -10.175 8.284 2.609 1.00 0.00 C ATOM 1226 CD2 PHE A 76 -11.462 7.045 4.189 1.00 0.00 C ATOM 1227 CE1 PHE A 76 -10.359 7.285 1.672 1.00 0.00 C ATOM 1228 CE2 PHE A 76 -11.648 6.042 3.256 1.00 0.00 C ATOM 1229 CZ PHE A 76 -11.097 6.163 1.996 1.00 0.00 C ATOM 0 H PHE A 76 -7.702 8.474 4.048 1.00 0.00 H new ATOM 0 HA PHE A 76 -8.939 10.478 5.699 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -11.103 9.025 5.788 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -10.923 10.198 4.498 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -9.597 9.159 2.350 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -11.897 6.946 5.173 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -9.926 7.381 0.687 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -12.224 5.165 3.512 1.00 0.00 H new ATOM 0 HZ PHE A 76 -11.243 5.382 1.265 1.00 0.00 H new ATOM 1239 N TYR A 77 -9.303 8.580 7.527 1.00 0.00 N ATOM 1240 CA TYR A 77 -9.029 7.676 8.638 1.00 0.00 C ATOM 1241 C TYR A 77 -10.327 7.161 9.254 1.00 0.00 C ATOM 1242 O TYR A 77 -10.896 7.791 10.146 1.00 0.00 O ATOM 1243 CB TYR A 77 -8.189 8.381 9.705 1.00 0.00 C ATOM 1244 CG TYR A 77 -7.927 7.533 10.931 1.00 0.00 C ATOM 1245 CD1 TYR A 77 -6.910 6.586 10.936 1.00 0.00 C ATOM 1246 CD2 TYR A 77 -8.695 7.678 12.079 1.00 0.00 C ATOM 1247 CE1 TYR A 77 -6.666 5.808 12.053 1.00 0.00 C ATOM 1248 CE2 TYR A 77 -8.456 6.904 13.200 1.00 0.00 C ATOM 1249 CZ TYR A 77 -7.441 5.971 13.180 1.00 0.00 C ATOM 1250 OH TYR A 77 -7.200 5.199 14.294 1.00 0.00 O ATOM 0 H TYR A 77 -10.008 9.290 7.725 1.00 0.00 H new ATOM 0 HA TYR A 77 -8.469 6.825 8.250 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -7.235 8.676 9.268 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -8.697 9.296 10.009 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -6.301 6.456 10.054 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -9.492 8.407 12.097 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -5.872 5.076 12.042 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -9.061 7.030 14.086 1.00 0.00 H new ATOM 0 HH TYR A 77 -7.834 5.439 15.002 1.00 0.00 H new ATOM 1260 N LEU A 78 -10.790 6.012 8.771 1.00 0.00 N ATOM 1261 CA LEU A 78 -12.020 5.412 9.273 1.00 0.00 C ATOM 1262 C LEU A 78 -12.086 5.501 10.795 1.00 0.00 C ATOM 1263 O LEU A 78 -11.099 5.842 11.448 1.00 0.00 O ATOM 1264 CB LEU A 78 -12.118 3.952 8.831 1.00 0.00 C ATOM 1265 CG LEU A 78 -12.879 3.722 7.526 1.00 0.00 C ATOM 1266 CD1 LEU A 78 -14.332 4.148 7.671 1.00 0.00 C ATOM 1267 CD2 LEU A 78 -12.212 4.474 6.383 1.00 0.00 C ATOM 0 H LEU A 78 -10.331 5.478 8.033 1.00 0.00 H new ATOM 0 HA LEU A 78 -12.861 5.966 8.857 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -11.110 3.553 8.721 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -12.603 3.380 9.622 1.00 0.00 H new ATOM 0 HG LEU A 78 -12.857 2.656 7.297 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -14.857 3.976 6.731 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -14.805 3.566 8.462 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -14.377 5.207 7.924 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -12.766 4.300 5.461 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -12.204 5.541 6.605 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -11.188 4.120 6.263 1.00 0.00 H new ATOM 1279 N GLY A 79 -13.253 5.192 11.353 1.00 0.00 N ATOM 1280 CA GLY A 79 -13.425 5.242 12.794 1.00 0.00 C ATOM 1281 C GLY A 79 -12.142 4.931 13.541 1.00 0.00 C ATOM 1282 O GLY A 79 -11.795 5.613 14.506 1.00 0.00 O ATOM 0 H GLY A 79 -14.083 4.908 10.833 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -13.778 6.233 13.081 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -14.196 4.531 13.090 1.00 0.00 H new ATOM 1286 N GLN A 80 -11.435 3.900 13.090 1.00 0.00 N ATOM 1287 CA GLN A 80 -10.180 3.498 13.716 1.00 0.00 C ATOM 1288 C GLN A 80 -9.228 2.906 12.681 1.00 0.00 C ATOM 1289 O GLN A 80 -8.440 2.011 12.984 1.00 0.00 O ATOM 1290 CB GLN A 80 -10.440 2.480 14.829 1.00 0.00 C ATOM 1291 CG GLN A 80 -9.300 2.364 15.826 1.00 0.00 C ATOM 1292 CD GLN A 80 -8.647 0.995 15.809 1.00 0.00 C ATOM 1293 OE1 GLN A 80 -8.329 0.460 14.747 1.00 0.00 O ATOM 1294 NE2 GLN A 80 -8.445 0.420 16.989 1.00 0.00 N ATOM 0 H GLN A 80 -11.710 3.327 12.292 1.00 0.00 H new ATOM 0 HA GLN A 80 -9.717 4.384 14.149 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -11.349 2.760 15.361 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -10.621 1.503 14.381 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -8.550 3.123 15.604 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -9.676 2.571 16.828 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -8.724 0.900 17.845 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -8.010 -0.501 17.040 1.00 0.00 H new ATOM 1303 N VAL A 81 -9.312 3.417 11.457 1.00 0.00 N ATOM 1304 CA VAL A 81 -8.467 2.949 10.365 1.00 0.00 C ATOM 1305 C VAL A 81 -8.152 4.090 9.401 1.00 0.00 C ATOM 1306 O VAL A 81 -8.715 5.179 9.514 1.00 0.00 O ATOM 1307 CB VAL A 81 -9.145 1.795 9.596 1.00 0.00 C ATOM 1308 CG1 VAL A 81 -8.358 1.432 8.346 1.00 0.00 C ATOM 1309 CG2 VAL A 81 -9.310 0.581 10.497 1.00 0.00 C ATOM 0 H VAL A 81 -9.961 4.160 11.196 1.00 0.00 H new ATOM 0 HA VAL A 81 -7.538 2.582 10.800 1.00 0.00 H new ATOM 0 HB VAL A 81 -10.133 2.132 9.283 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -8.859 0.616 7.825 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -8.298 2.300 7.689 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -7.352 1.119 8.627 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -9.790 -0.223 9.939 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -8.331 0.249 10.843 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -9.928 0.846 11.355 1.00 0.00 H new ATOM 1319 N ALA A 82 -7.252 3.839 8.456 1.00 0.00 N ATOM 1320 CA ALA A 82 -6.870 4.850 7.480 1.00 0.00 C ATOM 1321 C ALA A 82 -6.859 4.265 6.073 1.00 0.00 C ATOM 1322 O ALA A 82 -6.512 3.101 5.877 1.00 0.00 O ATOM 1323 CB ALA A 82 -5.508 5.433 7.826 1.00 0.00 C ATOM 0 H ALA A 82 -6.774 2.944 8.346 1.00 0.00 H new ATOM 0 HA ALA A 82 -7.608 5.651 7.510 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -5.237 6.187 7.087 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -5.549 5.891 8.814 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -4.761 4.639 7.825 1.00 0.00 H new ATOM 1329 N ILE A 83 -7.244 5.078 5.097 1.00 0.00 N ATOM 1330 CA ILE A 83 -7.283 4.638 3.709 1.00 0.00 C ATOM 1331 C ILE A 83 -6.662 5.680 2.786 1.00 0.00 C ATOM 1332 O ILE A 83 -7.072 6.841 2.779 1.00 0.00 O ATOM 1333 CB ILE A 83 -8.725 4.348 3.244 1.00 0.00 C ATOM 1334 CG1 ILE A 83 -9.657 4.175 4.446 1.00 0.00 C ATOM 1335 CG2 ILE A 83 -8.757 3.107 2.366 1.00 0.00 C ATOM 1336 CD1 ILE A 83 -9.387 2.917 5.243 1.00 0.00 C ATOM 0 H ILE A 83 -7.534 6.045 5.241 1.00 0.00 H new ATOM 0 HA ILE A 83 -6.704 3.716 3.656 1.00 0.00 H new ATOM 0 HB ILE A 83 -9.075 5.199 2.659 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -9.556 5.040 5.102 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -10.689 4.159 4.096 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -9.781 2.914 2.045 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -8.126 3.264 1.491 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -8.387 2.252 2.931 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -10.084 2.859 6.079 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -9.517 2.045 4.602 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -8.366 2.939 5.623 1.00 0.00 H new ATOM 1348 N LEU A 84 -5.673 5.255 2.009 1.00 0.00 N ATOM 1349 CA LEU A 84 -4.990 6.145 1.079 1.00 0.00 C ATOM 1350 C LEU A 84 -5.287 5.743 -0.364 1.00 0.00 C ATOM 1351 O LEU A 84 -4.554 4.957 -0.960 1.00 0.00 O ATOM 1352 CB LEU A 84 -3.480 6.113 1.338 1.00 0.00 C ATOM 1353 CG LEU A 84 -2.602 6.467 0.137 1.00 0.00 C ATOM 1354 CD1 LEU A 84 -2.365 7.965 0.078 1.00 0.00 C ATOM 1355 CD2 LEU A 84 -1.279 5.716 0.208 1.00 0.00 C ATOM 0 H LEU A 84 -5.325 4.296 2.005 1.00 0.00 H new ATOM 0 HA LEU A 84 -5.355 7.160 1.235 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -3.253 6.804 2.149 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -3.209 5.116 1.684 1.00 0.00 H new ATOM 0 HG LEU A 84 -3.120 6.166 -0.774 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -1.738 8.201 -0.782 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -3.320 8.481 -0.017 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -1.866 8.291 0.991 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -0.665 5.978 -0.654 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -0.755 5.989 1.124 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -1.469 4.643 0.205 1.00 0.00 H new ATOM 1367 N LEU A 85 -6.370 6.284 -0.915 1.00 0.00 N ATOM 1368 CA LEU A 85 -6.767 5.973 -2.283 1.00 0.00 C ATOM 1369 C LEU A 85 -6.203 6.987 -3.272 1.00 0.00 C ATOM 1370 O LEU A 85 -6.431 8.190 -3.141 1.00 0.00 O ATOM 1371 CB LEU A 85 -8.292 5.944 -2.396 1.00 0.00 C ATOM 1372 CG LEU A 85 -8.888 4.591 -2.785 1.00 0.00 C ATOM 1373 CD1 LEU A 85 -8.795 3.617 -1.622 1.00 0.00 C ATOM 1374 CD2 LEU A 85 -10.334 4.757 -3.231 1.00 0.00 C ATOM 0 H LEU A 85 -6.987 6.939 -0.435 1.00 0.00 H new ATOM 0 HA LEU A 85 -6.362 4.992 -2.529 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -8.717 6.250 -1.440 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -8.600 6.685 -3.134 1.00 0.00 H new ATOM 0 HG LEU A 85 -8.315 4.186 -3.619 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -9.224 2.659 -1.915 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -7.750 3.478 -1.346 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -9.345 4.015 -0.769 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -10.744 3.785 -3.505 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -10.920 5.182 -2.416 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -10.375 5.424 -4.092 1.00 0.00 H new ATOM 1386 N PHE A 86 -5.471 6.493 -4.266 1.00 0.00 N ATOM 1387 CA PHE A 86 -4.885 7.364 -5.281 1.00 0.00 C ATOM 1388 C PHE A 86 -4.432 6.572 -6.509 1.00 0.00 C ATOM 1389 O PHE A 86 -3.706 5.585 -6.391 1.00 0.00 O ATOM 1390 CB PHE A 86 -3.709 8.155 -4.690 1.00 0.00 C ATOM 1391 CG PHE A 86 -2.375 7.470 -4.823 1.00 0.00 C ATOM 1392 CD1 PHE A 86 -2.064 6.368 -4.044 1.00 0.00 C ATOM 1393 CD2 PHE A 86 -1.433 7.934 -5.728 1.00 0.00 C ATOM 1394 CE1 PHE A 86 -0.839 5.739 -4.164 1.00 0.00 C ATOM 1395 CE2 PHE A 86 -0.206 7.309 -5.853 1.00 0.00 C ATOM 1396 CZ PHE A 86 0.090 6.211 -5.070 1.00 0.00 C ATOM 0 H PHE A 86 -5.270 5.501 -4.391 1.00 0.00 H new ATOM 0 HA PHE A 86 -5.656 8.063 -5.605 1.00 0.00 H new ATOM 0 HB2 PHE A 86 -3.656 9.127 -5.181 1.00 0.00 H new ATOM 0 HB3 PHE A 86 -3.905 8.341 -3.634 1.00 0.00 H new ATOM 0 HD1 PHE A 86 -2.788 5.995 -3.334 1.00 0.00 H new ATOM 0 HD2 PHE A 86 -1.660 8.793 -6.342 1.00 0.00 H new ATOM 0 HE1 PHE A 86 -0.609 4.880 -3.551 1.00 0.00 H new ATOM 0 HE2 PHE A 86 0.520 7.679 -6.562 1.00 0.00 H new ATOM 0 HZ PHE A 86 1.048 5.721 -5.166 1.00 0.00 H new ATOM 1406 N LYS A 87 -4.860 7.023 -7.688 1.00 0.00 N ATOM 1407 CA LYS A 87 -4.494 6.372 -8.942 1.00 0.00 C ATOM 1408 C LYS A 87 -3.419 7.173 -9.665 1.00 0.00 C ATOM 1409 O LYS A 87 -3.220 8.356 -9.388 1.00 0.00 O ATOM 1410 CB LYS A 87 -5.713 6.223 -9.853 1.00 0.00 C ATOM 1411 CG LYS A 87 -7.044 6.248 -9.119 1.00 0.00 C ATOM 1412 CD LYS A 87 -8.214 6.203 -10.091 1.00 0.00 C ATOM 1413 CE LYS A 87 -8.113 5.013 -11.036 1.00 0.00 C ATOM 1414 NZ LYS A 87 -7.520 5.391 -12.348 1.00 0.00 N ATOM 0 H LYS A 87 -5.462 7.839 -7.799 1.00 0.00 H new ATOM 0 HA LYS A 87 -4.106 5.382 -8.703 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -5.702 7.026 -10.591 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -5.631 5.285 -10.402 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -7.102 5.399 -8.438 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -7.109 7.150 -8.510 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -9.149 6.147 -9.533 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -8.243 7.126 -10.670 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -7.506 4.234 -10.575 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -9.105 4.591 -11.195 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -7.955 4.822 -13.102 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -7.695 6.400 -12.530 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -6.495 5.215 -12.329 1.00 0.00 H new ATOM 1428 N SER A 88 -2.734 6.526 -10.600 1.00 0.00 N ATOM 1429 CA SER A 88 -1.687 7.185 -11.368 1.00 0.00 C ATOM 1430 C SER A 88 -2.018 7.155 -12.851 1.00 0.00 C ATOM 1431 O SER A 88 -1.147 7.322 -13.704 1.00 0.00 O ATOM 1432 CB SER A 88 -0.341 6.514 -11.120 1.00 0.00 C ATOM 1433 OG SER A 88 0.431 7.248 -10.184 1.00 0.00 O ATOM 0 H SER A 88 -2.885 5.547 -10.844 1.00 0.00 H new ATOM 0 HA SER A 88 -1.626 8.224 -11.043 1.00 0.00 H new ATOM 0 HB2 SER A 88 -0.499 5.501 -10.751 1.00 0.00 H new ATOM 0 HB3 SER A 88 0.205 6.429 -12.060 1.00 0.00 H new ATOM 0 HG SER A 88 0.526 8.173 -10.492 1.00 0.00 H new ATOM 1439 N GLY A 89 -3.290 6.942 -13.140 1.00 0.00 N ATOM 1440 CA GLY A 89 -3.748 6.888 -14.516 1.00 0.00 C ATOM 1441 C GLY A 89 -5.175 6.388 -14.635 1.00 0.00 C ATOM 1442 O GLY A 89 -6.077 7.218 -14.872 1.00 0.00 O ATOM 1443 OXT GLY A 89 -5.389 5.166 -14.494 1.00 0.00 O ATOM 0 H GLY A 89 -4.021 6.804 -12.442 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -3.677 7.882 -14.958 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -3.089 6.236 -15.089 1.00 0.00 H new TER 1447 GLY A 89 ATOM 1448 N MET B 1 26.605 -0.051 11.455 1.00 0.00 N ATOM 1449 CA MET B 1 25.327 0.171 12.181 1.00 0.00 C ATOM 1450 C MET B 1 24.223 -0.733 11.643 1.00 0.00 C ATOM 1451 O MET B 1 23.199 -0.255 11.154 1.00 0.00 O ATOM 1452 CB MET B 1 24.929 1.640 12.032 1.00 0.00 C ATOM 1453 CG MET B 1 25.646 2.563 13.005 1.00 0.00 C ATOM 1454 SD MET B 1 24.704 4.054 13.374 1.00 0.00 S ATOM 1455 CE MET B 1 25.941 5.029 14.226 1.00 0.00 C ATOM 0 H1 MET B 1 27.338 0.577 11.842 1.00 0.00 H new ATOM 0 H2 MET B 1 26.902 -1.041 11.570 1.00 0.00 H new ATOM 0 H3 MET B 1 26.471 0.155 10.445 1.00 0.00 H new ATOM 0 HA MET B 1 25.467 -0.074 13.234 1.00 0.00 H new ATOM 0 HB2 MET B 1 25.140 1.964 11.013 1.00 0.00 H new ATOM 0 HB3 MET B 1 23.853 1.734 12.180 1.00 0.00 H new ATOM 0 HG2 MET B 1 25.843 2.024 13.932 1.00 0.00 H new ATOM 0 HG3 MET B 1 26.613 2.843 12.587 1.00 0.00 H new ATOM 0 HE1 MET B 1 25.511 5.986 14.520 1.00 0.00 H new ATOM 0 HE2 MET B 1 26.278 4.494 15.114 1.00 0.00 H new ATOM 0 HE3 MET B 1 26.789 5.201 13.563 1.00 0.00 H new ATOM 1467 N CYS B 2 24.438 -2.041 11.740 1.00 0.00 N ATOM 1468 CA CYS B 2 23.460 -3.013 11.266 1.00 0.00 C ATOM 1469 C CYS B 2 22.691 -2.473 10.065 1.00 0.00 C ATOM 1470 O CYS B 2 21.537 -2.064 10.190 1.00 0.00 O ATOM 1471 CB CYS B 2 22.483 -3.377 12.386 1.00 0.00 C ATOM 1472 SG CYS B 2 23.073 -2.967 14.046 1.00 0.00 S ATOM 0 H CYS B 2 25.280 -2.452 12.142 1.00 0.00 H new ATOM 0 HA CYS B 2 24.000 -3.908 10.958 1.00 0.00 H new ATOM 0 HB2 CYS B 2 21.538 -2.862 12.211 1.00 0.00 H new ATOM 0 HB3 CYS B 2 22.276 -4.446 12.340 1.00 0.00 H new ATOM 0 HG CYS B 2 22.176 -3.311 14.922 1.00 0.00 H new ATOM 1478 N ASP B 3 23.334 -2.478 8.903 1.00 0.00 N ATOM 1479 CA ASP B 3 22.702 -1.991 7.683 1.00 0.00 C ATOM 1480 C ASP B 3 21.431 -2.778 7.386 1.00 0.00 C ATOM 1481 O ASP B 3 21.382 -3.992 7.586 1.00 0.00 O ATOM 1482 CB ASP B 3 23.669 -2.096 6.502 1.00 0.00 C ATOM 1483 CG ASP B 3 25.023 -1.485 6.803 1.00 0.00 C ATOM 1484 OD1 ASP B 3 25.768 -2.068 7.618 1.00 0.00 O ATOM 1485 OD2 ASP B 3 25.338 -0.425 6.224 1.00 0.00 O ATOM 0 H ASP B 3 24.290 -2.813 8.780 1.00 0.00 H new ATOM 0 HA ASP B 3 22.438 -0.944 7.831 1.00 0.00 H new ATOM 0 HB2 ASP B 3 23.799 -3.145 6.235 1.00 0.00 H new ATOM 0 HB3 ASP B 3 23.234 -1.598 5.635 1.00 0.00 H new ATOM 1490 N ARG B 4 20.404 -2.083 6.911 1.00 0.00 N ATOM 1491 CA ARG B 4 19.136 -2.725 6.589 1.00 0.00 C ATOM 1492 C ARG B 4 18.524 -3.364 7.833 1.00 0.00 C ATOM 1493 O ARG B 4 18.745 -4.544 8.108 1.00 0.00 O ATOM 1494 CB ARG B 4 19.341 -3.784 5.505 1.00 0.00 C ATOM 1495 CG ARG B 4 18.047 -4.274 4.878 1.00 0.00 C ATOM 1496 CD ARG B 4 18.176 -4.406 3.369 1.00 0.00 C ATOM 1497 NE ARG B 4 18.051 -5.794 2.929 1.00 0.00 N ATOM 1498 CZ ARG B 4 18.235 -6.189 1.673 1.00 0.00 C ATOM 1499 NH1 ARG B 4 18.542 -5.303 0.735 1.00 0.00 N ATOM 1500 NH2 ARG B 4 18.110 -7.469 1.354 1.00 0.00 N ATOM 0 H ARG B 4 20.425 -1.078 6.741 1.00 0.00 H new ATOM 0 HA ARG B 4 18.451 -1.963 6.217 1.00 0.00 H new ATOM 0 HB2 ARG B 4 19.980 -3.373 4.724 1.00 0.00 H new ATOM 0 HB3 ARG B 4 19.871 -4.634 5.935 1.00 0.00 H new ATOM 0 HG2 ARG B 4 17.776 -5.239 5.307 1.00 0.00 H new ATOM 0 HG3 ARG B 4 17.240 -3.581 5.116 1.00 0.00 H new ATOM 0 HD2 ARG B 4 17.409 -3.802 2.885 1.00 0.00 H new ATOM 0 HD3 ARG B 4 19.141 -4.010 3.051 1.00 0.00 H new ATOM 0 HE ARG B 4 17.809 -6.499 3.625 1.00 0.00 H new ATOM 0 HH11 ARG B 4 18.637 -4.317 0.977 1.00 0.00 H new ATOM 0 HH12 ARG B 4 18.683 -5.608 -0.228 1.00 0.00 H new ATOM 0 HH21 ARG B 4 17.872 -8.153 2.073 1.00 0.00 H new ATOM 0 HH22 ARG B 4 18.251 -7.770 0.390 1.00 0.00 H new ATOM 1514 N LYS B 5 17.758 -2.578 8.583 1.00 0.00 N ATOM 1515 CA LYS B 5 17.122 -3.070 9.798 1.00 0.00 C ATOM 1516 C LYS B 5 15.605 -3.138 9.637 1.00 0.00 C ATOM 1517 O LYS B 5 14.858 -2.802 10.555 1.00 0.00 O ATOM 1518 CB LYS B 5 17.481 -2.175 10.986 1.00 0.00 C ATOM 1519 CG LYS B 5 17.544 -2.920 12.309 1.00 0.00 C ATOM 1520 CD LYS B 5 16.224 -2.842 13.058 1.00 0.00 C ATOM 1521 CE LYS B 5 15.862 -1.407 13.404 1.00 0.00 C ATOM 1522 NZ LYS B 5 16.097 -1.107 14.844 1.00 0.00 N ATOM 0 H LYS B 5 17.563 -1.600 8.370 1.00 0.00 H new ATOM 0 HA LYS B 5 17.492 -4.078 9.985 1.00 0.00 H new ATOM 0 HB2 LYS B 5 18.446 -1.704 10.797 1.00 0.00 H new ATOM 0 HB3 LYS B 5 16.745 -1.375 11.063 1.00 0.00 H new ATOM 0 HG2 LYS B 5 17.799 -3.964 12.128 1.00 0.00 H new ATOM 0 HG3 LYS B 5 18.339 -2.500 12.926 1.00 0.00 H new ATOM 0 HD2 LYS B 5 15.433 -3.281 12.450 1.00 0.00 H new ATOM 0 HD3 LYS B 5 16.288 -3.432 13.972 1.00 0.00 H new ATOM 0 HE2 LYS B 5 16.451 -0.726 12.790 1.00 0.00 H new ATOM 0 HE3 LYS B 5 14.814 -1.228 13.162 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 15.838 -0.119 15.040 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 15.516 -1.740 15.430 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 17.102 -1.253 15.069 1.00 0.00 H new ATOM 1536 N ALA B 6 15.158 -3.578 8.465 1.00 0.00 N ATOM 1537 CA ALA B 6 13.731 -3.692 8.187 1.00 0.00 C ATOM 1538 C ALA B 6 13.323 -5.143 7.970 1.00 0.00 C ATOM 1539 O ALA B 6 14.111 -6.062 8.195 1.00 0.00 O ATOM 1540 CB ALA B 6 13.361 -2.857 6.972 1.00 0.00 C ATOM 0 H ALA B 6 15.762 -3.861 7.694 1.00 0.00 H new ATOM 0 HA ALA B 6 13.191 -3.316 9.056 1.00 0.00 H new ATOM 0 HB1 ALA B 6 12.293 -2.952 6.777 1.00 0.00 H new ATOM 0 HB2 ALA B 6 13.604 -1.811 7.162 1.00 0.00 H new ATOM 0 HB3 ALA B 6 13.921 -3.208 6.105 1.00 0.00 H new ATOM 1546 N VAL B 7 12.086 -5.338 7.527 1.00 0.00 N ATOM 1547 CA VAL B 7 11.564 -6.674 7.272 1.00 0.00 C ATOM 1548 C VAL B 7 10.760 -6.703 5.978 1.00 0.00 C ATOM 1549 O VAL B 7 9.545 -6.900 5.994 1.00 0.00 O ATOM 1550 CB VAL B 7 10.671 -7.160 8.429 1.00 0.00 C ATOM 1551 CG1 VAL B 7 10.267 -8.611 8.219 1.00 0.00 C ATOM 1552 CG2 VAL B 7 11.383 -6.983 9.763 1.00 0.00 C ATOM 0 H VAL B 7 11.425 -4.585 7.337 1.00 0.00 H new ATOM 0 HA VAL B 7 12.422 -7.341 7.184 1.00 0.00 H new ATOM 0 HB VAL B 7 9.765 -6.555 8.444 1.00 0.00 H new ATOM 0 HG11 VAL B 7 9.637 -8.937 9.046 1.00 0.00 H new ATOM 0 HG12 VAL B 7 9.715 -8.703 7.284 1.00 0.00 H new ATOM 0 HG13 VAL B 7 11.160 -9.235 8.176 1.00 0.00 H new ATOM 0 HG21 VAL B 7 10.737 -7.332 10.569 1.00 0.00 H new ATOM 0 HG22 VAL B 7 12.307 -7.562 9.762 1.00 0.00 H new ATOM 0 HG23 VAL B 7 11.615 -5.929 9.914 1.00 0.00 H new ATOM 1562 N ILE B 8 11.445 -6.503 4.857 1.00 0.00 N ATOM 1563 CA ILE B 8 10.792 -6.503 3.555 1.00 0.00 C ATOM 1564 C ILE B 8 9.684 -7.556 3.507 1.00 0.00 C ATOM 1565 O ILE B 8 9.692 -8.522 4.267 1.00 0.00 O ATOM 1566 CB ILE B 8 11.820 -6.737 2.411 1.00 0.00 C ATOM 1567 CG1 ILE B 8 12.290 -5.394 1.847 1.00 0.00 C ATOM 1568 CG2 ILE B 8 11.246 -7.601 1.289 1.00 0.00 C ATOM 1569 CD1 ILE B 8 13.472 -4.803 2.586 1.00 0.00 C ATOM 0 H ILE B 8 12.451 -6.339 4.825 1.00 0.00 H new ATOM 0 HA ILE B 8 10.342 -5.521 3.406 1.00 0.00 H new ATOM 0 HB ILE B 8 12.667 -7.274 2.838 1.00 0.00 H new ATOM 0 HG12 ILE B 8 12.557 -5.524 0.798 1.00 0.00 H new ATOM 0 HG13 ILE B 8 11.462 -4.686 1.880 1.00 0.00 H new ATOM 0 HG21 ILE B 8 11.999 -7.737 0.513 1.00 0.00 H new ATOM 0 HG22 ILE B 8 10.958 -8.573 1.689 1.00 0.00 H new ATOM 0 HG23 ILE B 8 10.371 -7.110 0.863 1.00 0.00 H new ATOM 0 HD11 ILE B 8 13.748 -3.852 2.130 1.00 0.00 H new ATOM 0 HD12 ILE B 8 13.204 -4.640 3.630 1.00 0.00 H new ATOM 0 HD13 ILE B 8 14.316 -5.491 2.531 1.00 0.00 H new ATOM 1581 N LYS B 9 8.741 -7.353 2.598 1.00 0.00 N ATOM 1582 CA LYS B 9 7.623 -8.273 2.428 1.00 0.00 C ATOM 1583 C LYS B 9 7.083 -8.187 1.008 1.00 0.00 C ATOM 1584 O LYS B 9 6.283 -9.019 0.579 1.00 0.00 O ATOM 1585 CB LYS B 9 6.517 -7.959 3.437 1.00 0.00 C ATOM 1586 CG LYS B 9 7.040 -7.601 4.818 1.00 0.00 C ATOM 1587 CD LYS B 9 6.658 -8.651 5.850 1.00 0.00 C ATOM 1588 CE LYS B 9 7.467 -8.497 7.128 1.00 0.00 C ATOM 1589 NZ LYS B 9 6.720 -7.746 8.174 1.00 0.00 N ATOM 0 H LYS B 9 8.727 -6.555 1.963 1.00 0.00 H new ATOM 0 HA LYS B 9 7.977 -9.288 2.607 1.00 0.00 H new ATOM 0 HB2 LYS B 9 5.916 -7.132 3.059 1.00 0.00 H new ATOM 0 HB3 LYS B 9 5.856 -8.822 3.520 1.00 0.00 H new ATOM 0 HG2 LYS B 9 8.125 -7.502 4.783 1.00 0.00 H new ATOM 0 HG3 LYS B 9 6.641 -6.632 5.119 1.00 0.00 H new ATOM 0 HD2 LYS B 9 5.595 -8.568 6.079 1.00 0.00 H new ATOM 0 HD3 LYS B 9 6.818 -9.646 5.435 1.00 0.00 H new ATOM 0 HE2 LYS B 9 7.733 -9.483 7.510 1.00 0.00 H new ATOM 0 HE3 LYS B 9 8.400 -7.979 6.906 1.00 0.00 H new ATOM 0 HZ1 LYS B 9 7.307 -7.664 9.028 1.00 0.00 H new ATOM 0 HZ2 LYS B 9 6.488 -6.796 7.820 1.00 0.00 H new ATOM 0 HZ3 LYS B 9 5.842 -8.253 8.405 1.00 0.00 H new ATOM 1603 N ASN B 10 7.535 -7.170 0.281 1.00 0.00 N ATOM 1604 CA ASN B 10 7.113 -6.959 -1.097 1.00 0.00 C ATOM 1605 C ASN B 10 8.015 -5.939 -1.779 1.00 0.00 C ATOM 1606 O ASN B 10 7.862 -4.733 -1.584 1.00 0.00 O ATOM 1607 CB ASN B 10 5.660 -6.485 -1.145 1.00 0.00 C ATOM 1608 CG ASN B 10 4.884 -7.118 -2.283 1.00 0.00 C ATOM 1609 OD1 ASN B 10 3.694 -6.862 -2.457 1.00 0.00 O ATOM 1610 ND2 ASN B 10 5.560 -7.953 -3.065 1.00 0.00 N ATOM 0 H ASN B 10 8.197 -6.476 0.627 1.00 0.00 H new ATOM 0 HA ASN B 10 7.191 -7.908 -1.628 1.00 0.00 H new ATOM 0 HB2 ASN B 10 5.172 -6.722 -0.200 1.00 0.00 H new ATOM 0 HB3 ASN B 10 5.638 -5.401 -1.252 1.00 0.00 H new ATOM 0 HD21 ASN B 10 5.092 -8.411 -3.847 1.00 0.00 H new ATOM 0 HD22 ASN B 10 6.547 -8.136 -2.883 1.00 0.00 H new ATOM 1617 N ALA B 11 8.962 -6.428 -2.573 1.00 0.00 N ATOM 1618 CA ALA B 11 9.891 -5.551 -3.272 1.00 0.00 C ATOM 1619 C ALA B 11 9.951 -5.870 -4.762 1.00 0.00 C ATOM 1620 O ALA B 11 10.008 -7.034 -5.160 1.00 0.00 O ATOM 1621 CB ALA B 11 11.277 -5.653 -2.655 1.00 0.00 C ATOM 0 H ALA B 11 9.105 -7.423 -2.747 1.00 0.00 H new ATOM 0 HA ALA B 11 9.527 -4.529 -3.166 1.00 0.00 H new ATOM 0 HB1 ALA B 11 11.962 -4.992 -3.187 1.00 0.00 H new ATOM 0 HB2 ALA B 11 11.231 -5.359 -1.606 1.00 0.00 H new ATOM 0 HB3 ALA B 11 11.633 -6.680 -2.729 1.00 0.00 H new ATOM 1627 N ASP B 12 9.951 -4.821 -5.576 1.00 0.00 N ATOM 1628 CA ASP B 12 10.018 -4.965 -7.022 1.00 0.00 C ATOM 1629 C ASP B 12 11.066 -4.016 -7.586 1.00 0.00 C ATOM 1630 O ASP B 12 10.964 -3.555 -8.723 1.00 0.00 O ATOM 1631 CB ASP B 12 8.654 -4.685 -7.657 1.00 0.00 C ATOM 1632 CG ASP B 12 8.684 -4.797 -9.168 1.00 0.00 C ATOM 1633 OD1 ASP B 12 9.259 -5.782 -9.679 1.00 0.00 O ATOM 1634 OD2 ASP B 12 8.131 -3.902 -9.842 1.00 0.00 O ATOM 0 H ASP B 12 9.905 -3.854 -5.254 1.00 0.00 H new ATOM 0 HA ASP B 12 10.300 -5.991 -7.258 1.00 0.00 H new ATOM 0 HB2 ASP B 12 7.920 -5.386 -7.258 1.00 0.00 H new ATOM 0 HB3 ASP B 12 8.325 -3.685 -7.376 1.00 0.00 H new ATOM 1639 N MET B 13 12.069 -3.723 -6.766 1.00 0.00 N ATOM 1640 CA MET B 13 13.145 -2.820 -7.153 1.00 0.00 C ATOM 1641 C MET B 13 14.504 -3.501 -7.010 1.00 0.00 C ATOM 1642 O MET B 13 14.678 -4.392 -6.179 1.00 0.00 O ATOM 1643 CB MET B 13 13.097 -1.561 -6.287 1.00 0.00 C ATOM 1644 CG MET B 13 14.311 -0.664 -6.441 1.00 0.00 C ATOM 1645 SD MET B 13 13.984 1.039 -5.945 1.00 0.00 S ATOM 1646 CE MET B 13 13.112 0.781 -4.403 1.00 0.00 C ATOM 0 H MET B 13 12.159 -4.101 -5.823 1.00 0.00 H new ATOM 0 HA MET B 13 13.009 -2.546 -8.199 1.00 0.00 H new ATOM 0 HB2 MET B 13 12.202 -0.992 -6.539 1.00 0.00 H new ATOM 0 HB3 MET B 13 13.004 -1.854 -5.241 1.00 0.00 H new ATOM 0 HG2 MET B 13 15.130 -1.062 -5.842 1.00 0.00 H new ATOM 0 HG3 MET B 13 14.639 -0.679 -7.480 1.00 0.00 H new ATOM 0 HE1 MET B 13 13.213 1.667 -3.776 1.00 0.00 H new ATOM 0 HE2 MET B 13 12.057 0.599 -4.608 1.00 0.00 H new ATOM 0 HE3 MET B 13 13.535 -0.080 -3.886 1.00 0.00 H new ATOM 1656 N SER B 14 15.465 -3.076 -7.825 1.00 0.00 N ATOM 1657 CA SER B 14 16.808 -3.644 -7.786 1.00 0.00 C ATOM 1658 C SER B 14 17.217 -3.980 -6.354 1.00 0.00 C ATOM 1659 O SER B 14 16.910 -3.238 -5.422 1.00 0.00 O ATOM 1660 CB SER B 14 17.814 -2.671 -8.403 1.00 0.00 C ATOM 1661 OG SER B 14 17.939 -2.882 -9.799 1.00 0.00 O ATOM 0 H SER B 14 15.338 -2.340 -8.520 1.00 0.00 H new ATOM 0 HA SER B 14 16.802 -4.566 -8.367 1.00 0.00 H new ATOM 0 HB2 SER B 14 17.495 -1.646 -8.214 1.00 0.00 H new ATOM 0 HB3 SER B 14 18.786 -2.796 -7.925 1.00 0.00 H new ATOM 0 HG SER B 14 18.586 -2.246 -10.169 1.00 0.00 H new ATOM 1667 N GLU B 15 17.912 -5.103 -6.188 1.00 0.00 N ATOM 1668 CA GLU B 15 18.361 -5.542 -4.869 1.00 0.00 C ATOM 1669 C GLU B 15 19.005 -4.394 -4.095 1.00 0.00 C ATOM 1670 O GLU B 15 18.483 -3.946 -3.074 1.00 0.00 O ATOM 1671 CB GLU B 15 19.357 -6.695 -5.004 1.00 0.00 C ATOM 1672 CG GLU B 15 18.699 -8.048 -5.221 1.00 0.00 C ATOM 1673 CD GLU B 15 19.625 -9.045 -5.893 1.00 0.00 C ATOM 1674 OE1 GLU B 15 20.458 -9.650 -5.186 1.00 0.00 O ATOM 1675 OE2 GLU B 15 19.517 -9.219 -7.124 1.00 0.00 O ATOM 0 H GLU B 15 18.177 -5.726 -6.951 1.00 0.00 H new ATOM 0 HA GLU B 15 17.486 -5.883 -4.316 1.00 0.00 H new ATOM 0 HB2 GLU B 15 20.027 -6.489 -5.838 1.00 0.00 H new ATOM 0 HB3 GLU B 15 19.972 -6.740 -4.105 1.00 0.00 H new ATOM 0 HG2 GLU B 15 18.375 -8.449 -4.261 1.00 0.00 H new ATOM 0 HG3 GLU B 15 17.805 -7.920 -5.831 1.00 0.00 H new ATOM 1682 N GLU B 16 20.146 -3.925 -4.584 1.00 0.00 N ATOM 1683 CA GLU B 16 20.860 -2.832 -3.936 1.00 0.00 C ATOM 1684 C GLU B 16 19.927 -1.657 -3.675 1.00 0.00 C ATOM 1685 O GLU B 16 20.103 -0.915 -2.709 1.00 0.00 O ATOM 1686 CB GLU B 16 22.039 -2.383 -4.802 1.00 0.00 C ATOM 1687 CG GLU B 16 22.604 -3.487 -5.681 1.00 0.00 C ATOM 1688 CD GLU B 16 22.662 -3.097 -7.146 1.00 0.00 C ATOM 1689 OE1 GLU B 16 22.097 -2.042 -7.502 1.00 0.00 O ATOM 1690 OE2 GLU B 16 23.271 -3.848 -7.937 1.00 0.00 O ATOM 0 H GLU B 16 20.596 -4.284 -5.426 1.00 0.00 H new ATOM 0 HA GLU B 16 21.239 -3.191 -2.979 1.00 0.00 H new ATOM 0 HB2 GLU B 16 21.720 -1.554 -5.434 1.00 0.00 H new ATOM 0 HB3 GLU B 16 22.830 -2.004 -4.155 1.00 0.00 H new ATOM 0 HG2 GLU B 16 23.606 -3.742 -5.337 1.00 0.00 H new ATOM 0 HG3 GLU B 16 21.992 -4.382 -5.571 1.00 0.00 H new ATOM 1697 N MET B 17 18.931 -1.496 -4.538 1.00 0.00 N ATOM 1698 CA MET B 17 17.968 -0.413 -4.396 1.00 0.00 C ATOM 1699 C MET B 17 17.060 -0.651 -3.191 1.00 0.00 C ATOM 1700 O MET B 17 16.750 0.278 -2.447 1.00 0.00 O ATOM 1701 CB MET B 17 17.128 -0.279 -5.667 1.00 0.00 C ATOM 1702 CG MET B 17 17.688 0.724 -6.664 1.00 0.00 C ATOM 1703 SD MET B 17 16.582 2.123 -6.938 1.00 0.00 S ATOM 1704 CE MET B 17 16.575 2.876 -5.312 1.00 0.00 C ATOM 0 H MET B 17 18.770 -2.102 -5.343 1.00 0.00 H new ATOM 0 HA MET B 17 18.519 0.514 -4.237 1.00 0.00 H new ATOM 0 HB2 MET B 17 17.054 -1.254 -6.148 1.00 0.00 H new ATOM 0 HB3 MET B 17 16.116 0.019 -5.394 1.00 0.00 H new ATOM 0 HG2 MET B 17 18.649 1.091 -6.304 1.00 0.00 H new ATOM 0 HG3 MET B 17 17.874 0.222 -7.613 1.00 0.00 H new ATOM 0 HE1 MET B 17 16.246 3.912 -5.392 1.00 0.00 H new ATOM 0 HE2 MET B 17 15.894 2.329 -4.660 1.00 0.00 H new ATOM 0 HE3 MET B 17 17.581 2.846 -4.893 1.00 0.00 H new ATOM 1714 N GLN B 18 16.641 -1.901 -3.000 1.00 0.00 N ATOM 1715 CA GLN B 18 15.774 -2.248 -1.878 1.00 0.00 C ATOM 1716 C GLN B 18 16.518 -2.078 -0.556 1.00 0.00 C ATOM 1717 O GLN B 18 15.913 -1.788 0.476 1.00 0.00 O ATOM 1718 CB GLN B 18 15.259 -3.684 -2.006 1.00 0.00 C ATOM 1719 CG GLN B 18 15.917 -4.476 -3.121 1.00 0.00 C ATOM 1720 CD GLN B 18 14.933 -5.350 -3.872 1.00 0.00 C ATOM 1721 OE1 GLN B 18 15.293 -6.406 -4.394 1.00 0.00 O ATOM 1722 NE2 GLN B 18 13.681 -4.913 -3.930 1.00 0.00 N ATOM 0 H GLN B 18 16.887 -2.685 -3.604 1.00 0.00 H new ATOM 0 HA GLN B 18 14.919 -1.572 -1.894 1.00 0.00 H new ATOM 0 HB2 GLN B 18 15.420 -4.203 -1.061 1.00 0.00 H new ATOM 0 HB3 GLN B 18 14.183 -3.660 -2.177 1.00 0.00 H new ATOM 0 HG2 GLN B 18 16.393 -3.787 -3.819 1.00 0.00 H new ATOM 0 HG3 GLN B 18 16.706 -5.100 -2.702 1.00 0.00 H new ATOM 0 HE21 GLN B 18 13.427 -4.032 -3.483 1.00 0.00 H new ATOM 0 HE22 GLN B 18 12.973 -5.458 -4.422 1.00 0.00 H new ATOM 1731 N GLN B 19 17.836 -2.247 -0.600 1.00 0.00 N ATOM 1732 CA GLN B 19 18.661 -2.099 0.589 1.00 0.00 C ATOM 1733 C GLN B 19 18.860 -0.624 0.892 1.00 0.00 C ATOM 1734 O GLN B 19 18.769 -0.192 2.042 1.00 0.00 O ATOM 1735 CB GLN B 19 20.015 -2.790 0.391 1.00 0.00 C ATOM 1736 CG GLN B 19 21.047 -1.931 -0.322 1.00 0.00 C ATOM 1737 CD GLN B 19 22.471 -2.369 -0.038 1.00 0.00 C ATOM 1738 OE1 GLN B 19 23.168 -2.865 -0.923 1.00 0.00 O ATOM 1739 NE2 GLN B 19 22.910 -2.192 1.203 1.00 0.00 N ATOM 0 H GLN B 19 18.353 -2.486 -1.446 1.00 0.00 H new ATOM 0 HA GLN B 19 18.156 -2.571 1.432 1.00 0.00 H new ATOM 0 HB2 GLN B 19 20.409 -3.081 1.365 1.00 0.00 H new ATOM 0 HB3 GLN B 19 19.864 -3.707 -0.179 1.00 0.00 H new ATOM 0 HG2 GLN B 19 20.867 -1.970 -1.396 1.00 0.00 H new ATOM 0 HG3 GLN B 19 20.923 -0.892 -0.016 1.00 0.00 H new ATOM 0 HE21 GLN B 19 22.299 -1.777 1.906 1.00 0.00 H new ATOM 0 HE22 GLN B 19 23.859 -2.471 1.453 1.00 0.00 H new ATOM 1748 N ASP B 20 19.110 0.148 -0.158 1.00 0.00 N ATOM 1749 CA ASP B 20 19.301 1.580 -0.018 1.00 0.00 C ATOM 1750 C ASP B 20 17.980 2.243 0.345 1.00 0.00 C ATOM 1751 O ASP B 20 17.952 3.311 0.956 1.00 0.00 O ATOM 1752 CB ASP B 20 19.853 2.177 -1.314 1.00 0.00 C ATOM 1753 CG ASP B 20 21.305 2.591 -1.187 1.00 0.00 C ATOM 1754 OD1 ASP B 20 21.894 2.369 -0.108 1.00 0.00 O ATOM 1755 OD2 ASP B 20 21.855 3.136 -2.166 1.00 0.00 O ATOM 0 H ASP B 20 19.185 -0.197 -1.115 1.00 0.00 H new ATOM 0 HA ASP B 20 20.023 1.762 0.778 1.00 0.00 H new ATOM 0 HB2 ASP B 20 19.755 1.447 -2.118 1.00 0.00 H new ATOM 0 HB3 ASP B 20 19.254 3.043 -1.596 1.00 0.00 H new ATOM 1760 N SER B 21 16.886 1.586 -0.029 1.00 0.00 N ATOM 1761 CA SER B 21 15.553 2.092 0.264 1.00 0.00 C ATOM 1762 C SER B 21 15.263 1.976 1.751 1.00 0.00 C ATOM 1763 O SER B 21 14.874 2.950 2.397 1.00 0.00 O ATOM 1764 CB SER B 21 14.504 1.319 -0.535 1.00 0.00 C ATOM 1765 OG SER B 21 13.617 0.629 0.328 1.00 0.00 O ATOM 0 H SER B 21 16.899 0.701 -0.536 1.00 0.00 H new ATOM 0 HA SER B 21 15.509 3.142 -0.024 1.00 0.00 H new ATOM 0 HB2 SER B 21 13.942 2.008 -1.166 1.00 0.00 H new ATOM 0 HB3 SER B 21 14.997 0.609 -1.199 1.00 0.00 H new ATOM 0 HG SER B 21 12.916 1.242 0.635 1.00 0.00 H new ATOM 1771 N VAL B 22 15.470 0.781 2.296 1.00 0.00 N ATOM 1772 CA VAL B 22 15.243 0.547 3.714 1.00 0.00 C ATOM 1773 C VAL B 22 16.084 1.504 4.547 1.00 0.00 C ATOM 1774 O VAL B 22 15.610 2.071 5.531 1.00 0.00 O ATOM 1775 CB VAL B 22 15.583 -0.898 4.113 1.00 0.00 C ATOM 1776 CG1 VAL B 22 15.307 -1.120 5.591 1.00 0.00 C ATOM 1777 CG2 VAL B 22 14.806 -1.887 3.260 1.00 0.00 C ATOM 0 H VAL B 22 15.793 -0.036 1.778 1.00 0.00 H new ATOM 0 HA VAL B 22 14.184 0.719 3.905 1.00 0.00 H new ATOM 0 HB VAL B 22 16.646 -1.064 3.937 1.00 0.00 H new ATOM 0 HG11 VAL B 22 15.553 -2.148 5.857 1.00 0.00 H new ATOM 0 HG12 VAL B 22 15.917 -0.437 6.182 1.00 0.00 H new ATOM 0 HG13 VAL B 22 14.253 -0.935 5.796 1.00 0.00 H new ATOM 0 HG21 VAL B 22 15.061 -2.904 3.558 1.00 0.00 H new ATOM 0 HG22 VAL B 22 13.737 -1.726 3.398 1.00 0.00 H new ATOM 0 HG23 VAL B 22 15.062 -1.742 2.210 1.00 0.00 H new ATOM 1787 N GLU B 23 17.335 1.690 4.134 1.00 0.00 N ATOM 1788 CA GLU B 23 18.239 2.593 4.833 1.00 0.00 C ATOM 1789 C GLU B 23 17.687 4.012 4.803 1.00 0.00 C ATOM 1790 O GLU B 23 17.772 4.746 5.786 1.00 0.00 O ATOM 1791 CB GLU B 23 19.630 2.554 4.198 1.00 0.00 C ATOM 1792 CG GLU B 23 20.351 1.230 4.392 1.00 0.00 C ATOM 1793 CD GLU B 23 21.849 1.399 4.549 1.00 0.00 C ATOM 1794 OE1 GLU B 23 22.276 2.031 5.539 1.00 0.00 O ATOM 1795 OE2 GLU B 23 22.597 0.901 3.682 1.00 0.00 O ATOM 0 H GLU B 23 17.743 1.228 3.321 1.00 0.00 H new ATOM 0 HA GLU B 23 18.323 2.268 5.870 1.00 0.00 H new ATOM 0 HB2 GLU B 23 19.539 2.755 3.131 1.00 0.00 H new ATOM 0 HB3 GLU B 23 20.237 3.354 4.623 1.00 0.00 H new ATOM 0 HG2 GLU B 23 19.951 0.729 5.274 1.00 0.00 H new ATOM 0 HG3 GLU B 23 20.150 0.583 3.539 1.00 0.00 H new ATOM 1802 N CYS B 24 17.106 4.381 3.666 1.00 0.00 N ATOM 1803 CA CYS B 24 16.520 5.704 3.505 1.00 0.00 C ATOM 1804 C CYS B 24 15.329 5.863 4.442 1.00 0.00 C ATOM 1805 O CYS B 24 15.113 6.932 5.017 1.00 0.00 O ATOM 1806 CB CYS B 24 16.087 5.925 2.054 1.00 0.00 C ATOM 1807 SG CYS B 24 17.460 6.172 0.905 1.00 0.00 S ATOM 0 H CYS B 24 17.029 3.782 2.844 1.00 0.00 H new ATOM 0 HA CYS B 24 17.271 6.453 3.758 1.00 0.00 H new ATOM 0 HB2 CYS B 24 15.502 5.066 1.726 1.00 0.00 H new ATOM 0 HB3 CYS B 24 15.430 6.793 2.010 1.00 0.00 H new ATOM 0 HG CYS B 24 18.001 5.024 0.623 1.00 0.00 H new ATOM 1813 N ALA B 25 14.580 4.778 4.624 1.00 0.00 N ATOM 1814 CA ALA B 25 13.443 4.795 5.525 1.00 0.00 C ATOM 1815 C ALA B 25 13.968 4.884 6.941 1.00 0.00 C ATOM 1816 O ALA B 25 13.374 5.520 7.811 1.00 0.00 O ATOM 1817 CB ALA B 25 12.589 3.549 5.340 1.00 0.00 C ATOM 0 H ALA B 25 14.743 3.884 4.160 1.00 0.00 H new ATOM 0 HA ALA B 25 12.808 5.655 5.310 1.00 0.00 H new ATOM 0 HB1 ALA B 25 11.742 3.583 6.026 1.00 0.00 H new ATOM 0 HB2 ALA B 25 12.224 3.507 4.314 1.00 0.00 H new ATOM 0 HB3 ALA B 25 13.189 2.663 5.548 1.00 0.00 H new ATOM 1823 N THR B 26 15.120 4.255 7.140 1.00 0.00 N ATOM 1824 CA THR B 26 15.792 4.260 8.422 1.00 0.00 C ATOM 1825 C THR B 26 16.269 5.668 8.739 1.00 0.00 C ATOM 1826 O THR B 26 16.157 6.138 9.870 1.00 0.00 O ATOM 1827 CB THR B 26 16.976 3.296 8.390 1.00 0.00 C ATOM 1828 OG1 THR B 26 16.682 2.166 7.588 1.00 0.00 O ATOM 1829 CG2 THR B 26 17.376 2.796 9.754 1.00 0.00 C ATOM 0 H THR B 26 15.609 3.730 6.415 1.00 0.00 H new ATOM 0 HA THR B 26 15.098 3.936 9.197 1.00 0.00 H new ATOM 0 HB THR B 26 17.804 3.871 7.975 1.00 0.00 H new ATOM 0 HG1 THR B 26 16.458 2.459 6.680 1.00 0.00 H new ATOM 0 HG21 THR B 26 18.222 2.116 9.658 1.00 0.00 H new ATOM 0 HG22 THR B 26 17.658 3.640 10.383 1.00 0.00 H new ATOM 0 HG23 THR B 26 16.537 2.269 10.209 1.00 0.00 H new ATOM 1837 N GLN B 27 16.784 6.345 7.716 1.00 0.00 N ATOM 1838 CA GLN B 27 17.260 7.710 7.869 1.00 0.00 C ATOM 1839 C GLN B 27 16.138 8.583 8.410 1.00 0.00 C ATOM 1840 O GLN B 27 16.337 9.378 9.330 1.00 0.00 O ATOM 1841 CB GLN B 27 17.755 8.260 6.529 1.00 0.00 C ATOM 1842 CG GLN B 27 18.827 7.402 5.878 1.00 0.00 C ATOM 1843 CD GLN B 27 19.725 8.199 4.951 1.00 0.00 C ATOM 1844 OE1 GLN B 27 20.053 7.754 3.851 1.00 0.00 O ATOM 1845 NE2 GLN B 27 20.128 9.385 5.393 1.00 0.00 N ATOM 0 H GLN B 27 16.881 5.967 6.773 1.00 0.00 H new ATOM 0 HA GLN B 27 18.094 7.716 8.571 1.00 0.00 H new ATOM 0 HB2 GLN B 27 16.909 8.349 5.847 1.00 0.00 H new ATOM 0 HB3 GLN B 27 18.149 9.265 6.681 1.00 0.00 H new ATOM 0 HG2 GLN B 27 19.434 6.934 6.653 1.00 0.00 H new ATOM 0 HG3 GLN B 27 18.352 6.598 5.316 1.00 0.00 H new ATOM 0 HE21 GLN B 27 19.832 9.714 6.312 1.00 0.00 H new ATOM 0 HE22 GLN B 27 20.734 9.966 4.814 1.00 0.00 H new ATOM 1854 N ALA B 28 14.953 8.413 7.835 1.00 0.00 N ATOM 1855 CA ALA B 28 13.782 9.167 8.259 1.00 0.00 C ATOM 1856 C ALA B 28 13.175 8.552 9.517 1.00 0.00 C ATOM 1857 O ALA B 28 12.361 9.176 10.198 1.00 0.00 O ATOM 1858 CB ALA B 28 12.751 9.219 7.142 1.00 0.00 C ATOM 0 H ALA B 28 14.779 7.758 7.073 1.00 0.00 H new ATOM 0 HA ALA B 28 14.094 10.186 8.490 1.00 0.00 H new ATOM 0 HB1 ALA B 28 11.882 9.786 7.475 1.00 0.00 H new ATOM 0 HB2 ALA B 28 13.186 9.702 6.267 1.00 0.00 H new ATOM 0 HB3 ALA B 28 12.445 8.206 6.882 1.00 0.00 H new ATOM 1864 N LEU B 29 13.580 7.321 9.817 1.00 0.00 N ATOM 1865 CA LEU B 29 13.084 6.615 10.991 1.00 0.00 C ATOM 1866 C LEU B 29 13.849 7.029 12.244 1.00 0.00 C ATOM 1867 O LEU B 29 13.282 7.113 13.333 1.00 0.00 O ATOM 1868 CB LEU B 29 13.199 5.109 10.789 1.00 0.00 C ATOM 1869 CG LEU B 29 12.111 4.508 9.907 1.00 0.00 C ATOM 1870 CD1 LEU B 29 12.665 3.346 9.111 1.00 0.00 C ATOM 1871 CD2 LEU B 29 10.924 4.065 10.748 1.00 0.00 C ATOM 0 H LEU B 29 14.252 6.792 9.261 1.00 0.00 H new ATOM 0 HA LEU B 29 12.035 6.881 11.125 1.00 0.00 H new ATOM 0 HB2 LEU B 29 14.171 4.887 10.349 1.00 0.00 H new ATOM 0 HB3 LEU B 29 13.171 4.621 11.763 1.00 0.00 H new ATOM 0 HG LEU B 29 11.767 5.272 9.210 1.00 0.00 H new ATOM 0 HD11 LEU B 29 11.878 2.926 8.485 1.00 0.00 H new ATOM 0 HD12 LEU B 29 13.483 3.694 8.480 1.00 0.00 H new ATOM 0 HD13 LEU B 29 13.034 2.580 9.794 1.00 0.00 H new ATOM 0 HD21 LEU B 29 10.158 3.639 10.100 1.00 0.00 H new ATOM 0 HD22 LEU B 29 11.249 3.314 11.469 1.00 0.00 H new ATOM 0 HD23 LEU B 29 10.513 4.924 11.279 1.00 0.00 H new ATOM 1883 N GLU B 30 15.145 7.282 12.081 1.00 0.00 N ATOM 1884 CA GLU B 30 15.993 7.681 13.197 1.00 0.00 C ATOM 1885 C GLU B 30 15.977 9.194 13.388 1.00 0.00 C ATOM 1886 O GLU B 30 16.130 9.690 14.505 1.00 0.00 O ATOM 1887 CB GLU B 30 17.428 7.203 12.968 1.00 0.00 C ATOM 1888 CG GLU B 30 18.024 7.690 11.661 1.00 0.00 C ATOM 1889 CD GLU B 30 19.089 8.750 11.865 1.00 0.00 C ATOM 1890 OE1 GLU B 30 18.725 9.937 12.006 1.00 0.00 O ATOM 1891 OE2 GLU B 30 20.286 8.394 11.884 1.00 0.00 O ATOM 0 H GLU B 30 15.630 7.217 11.186 1.00 0.00 H new ATOM 0 HA GLU B 30 15.598 7.217 14.101 1.00 0.00 H new ATOM 0 HB2 GLU B 30 18.053 7.545 13.793 1.00 0.00 H new ATOM 0 HB3 GLU B 30 17.447 6.113 12.984 1.00 0.00 H new ATOM 0 HG2 GLU B 30 18.456 6.845 11.126 1.00 0.00 H new ATOM 0 HG3 GLU B 30 17.230 8.094 11.032 1.00 0.00 H new ATOM 1898 N LYS B 31 15.790 9.924 12.293 1.00 0.00 N ATOM 1899 CA LYS B 31 15.753 11.380 12.342 1.00 0.00 C ATOM 1900 C LYS B 31 14.361 11.874 12.708 1.00 0.00 C ATOM 1901 O LYS B 31 14.160 13.059 12.978 1.00 0.00 O ATOM 1902 CB LYS B 31 16.180 11.971 10.997 1.00 0.00 C ATOM 1903 CG LYS B 31 17.676 12.218 10.889 1.00 0.00 C ATOM 1904 CD LYS B 31 18.300 11.374 9.789 1.00 0.00 C ATOM 1905 CE LYS B 31 19.636 11.941 9.338 1.00 0.00 C ATOM 1906 NZ LYS B 31 20.061 11.384 8.023 1.00 0.00 N ATOM 0 H LYS B 31 15.662 9.530 11.361 1.00 0.00 H new ATOM 0 HA LYS B 31 16.451 11.710 13.111 1.00 0.00 H new ATOM 0 HB2 LYS B 31 15.873 11.295 10.199 1.00 0.00 H new ATOM 0 HB3 LYS B 31 15.652 12.912 10.839 1.00 0.00 H new ATOM 0 HG2 LYS B 31 17.858 13.274 10.687 1.00 0.00 H new ATOM 0 HG3 LYS B 31 18.154 11.988 11.841 1.00 0.00 H new ATOM 0 HD2 LYS B 31 18.439 10.354 10.147 1.00 0.00 H new ATOM 0 HD3 LYS B 31 17.620 11.323 8.939 1.00 0.00 H new ATOM 0 HE2 LYS B 31 19.564 13.026 9.266 1.00 0.00 H new ATOM 0 HE3 LYS B 31 20.396 11.721 10.088 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 20.894 11.903 7.679 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 20.302 10.378 8.133 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 19.285 11.481 7.338 1.00 0.00 H new ATOM 1920 N TYR B 32 13.401 10.958 12.718 1.00 0.00 N ATOM 1921 CA TYR B 32 12.026 11.299 13.054 1.00 0.00 C ATOM 1922 C TYR B 32 11.306 10.110 13.677 1.00 0.00 C ATOM 1923 O TYR B 32 11.922 9.266 14.329 1.00 0.00 O ATOM 1924 CB TYR B 32 11.272 11.768 11.808 1.00 0.00 C ATOM 1925 CG TYR B 32 12.144 12.495 10.810 1.00 0.00 C ATOM 1926 CD1 TYR B 32 13.092 11.812 10.059 1.00 0.00 C ATOM 1927 CD2 TYR B 32 12.019 13.866 10.618 1.00 0.00 C ATOM 1928 CE1 TYR B 32 13.892 12.471 9.146 1.00 0.00 C ATOM 1929 CE2 TYR B 32 12.816 14.533 9.706 1.00 0.00 C ATOM 1930 CZ TYR B 32 13.749 13.832 8.974 1.00 0.00 C ATOM 1931 OH TYR B 32 14.543 14.492 8.064 1.00 0.00 O ATOM 0 H TYR B 32 13.550 9.973 12.497 1.00 0.00 H new ATOM 0 HA TYR B 32 12.050 12.110 13.782 1.00 0.00 H new ATOM 0 HB2 TYR B 32 10.820 10.904 11.321 1.00 0.00 H new ATOM 0 HB3 TYR B 32 10.457 12.425 12.113 1.00 0.00 H new ATOM 0 HD1 TYR B 32 13.206 10.746 10.191 1.00 0.00 H new ATOM 0 HD2 TYR B 32 11.288 14.419 11.190 1.00 0.00 H new ATOM 0 HE1 TYR B 32 14.625 11.924 8.571 1.00 0.00 H new ATOM 0 HE2 TYR B 32 12.708 15.599 9.568 1.00 0.00 H new ATOM 0 HH TYR B 32 14.316 15.445 8.063 1.00 0.00 H new ATOM 1941 N ASN B 33 9.997 10.050 13.467 1.00 0.00 N ATOM 1942 CA ASN B 33 9.183 8.966 14.001 1.00 0.00 C ATOM 1943 C ASN B 33 7.716 9.176 13.653 1.00 0.00 C ATOM 1944 O ASN B 33 6.822 8.725 14.369 1.00 0.00 O ATOM 1945 CB ASN B 33 9.356 8.860 15.517 1.00 0.00 C ATOM 1946 CG ASN B 33 9.801 7.478 15.948 1.00 0.00 C ATOM 1947 OD1 ASN B 33 9.666 7.103 17.113 1.00 0.00 O ATOM 1948 ND2 ASN B 33 10.337 6.709 15.006 1.00 0.00 N ATOM 0 H ASN B 33 9.475 10.742 12.929 1.00 0.00 H new ATOM 0 HA ASN B 33 9.518 8.034 13.547 1.00 0.00 H new ATOM 0 HB2 ASN B 33 10.088 9.596 15.849 1.00 0.00 H new ATOM 0 HB3 ASN B 33 8.413 9.105 16.006 1.00 0.00 H new ATOM 0 HD21 ASN B 33 10.656 5.768 15.236 1.00 0.00 H new ATOM 0 HD22 ASN B 33 10.430 7.060 14.053 1.00 0.00 H new ATOM 1955 N ILE B 34 7.480 9.861 12.540 1.00 0.00 N ATOM 1956 CA ILE B 34 6.126 10.132 12.079 1.00 0.00 C ATOM 1957 C ILE B 34 5.885 9.485 10.722 1.00 0.00 C ATOM 1958 O ILE B 34 6.394 9.954 9.706 1.00 0.00 O ATOM 1959 CB ILE B 34 5.859 11.645 11.961 1.00 0.00 C ATOM 1960 CG1 ILE B 34 6.614 12.409 13.051 1.00 0.00 C ATOM 1961 CG2 ILE B 34 4.364 11.928 12.033 1.00 0.00 C ATOM 1962 CD1 ILE B 34 6.032 12.224 14.432 1.00 0.00 C ATOM 0 H ILE B 34 8.212 10.239 11.939 1.00 0.00 H new ATOM 0 HA ILE B 34 5.446 9.711 12.819 1.00 0.00 H new ATOM 0 HB ILE B 34 6.223 11.989 10.993 1.00 0.00 H new ATOM 0 HG12 ILE B 34 7.654 12.083 13.057 1.00 0.00 H new ATOM 0 HG13 ILE B 34 6.614 13.471 12.805 1.00 0.00 H new ATOM 0 HG21 ILE B 34 4.192 13.001 11.948 1.00 0.00 H new ATOM 0 HG22 ILE B 34 3.857 11.414 11.217 1.00 0.00 H new ATOM 0 HG23 ILE B 34 3.972 11.572 12.986 1.00 0.00 H new ATOM 0 HD11 ILE B 34 6.618 12.794 15.153 1.00 0.00 H new ATOM 0 HD12 ILE B 34 5.001 12.577 14.442 1.00 0.00 H new ATOM 0 HD13 ILE B 34 6.057 11.167 14.699 1.00 0.00 H new ATOM 1974 N GLU B 35 5.111 8.404 10.711 1.00 0.00 N ATOM 1975 CA GLU B 35 4.809 7.693 9.475 1.00 0.00 C ATOM 1976 C GLU B 35 4.818 8.649 8.286 1.00 0.00 C ATOM 1977 O GLU B 35 5.632 8.515 7.373 1.00 0.00 O ATOM 1978 CB GLU B 35 3.450 7.005 9.584 1.00 0.00 C ATOM 1979 CG GLU B 35 3.173 6.415 10.958 1.00 0.00 C ATOM 1980 CD GLU B 35 2.459 7.388 11.875 1.00 0.00 C ATOM 1981 OE1 GLU B 35 1.372 7.872 11.495 1.00 0.00 O ATOM 1982 OE2 GLU B 35 2.986 7.665 12.973 1.00 0.00 O ATOM 0 H GLU B 35 4.682 8.002 11.544 1.00 0.00 H new ATOM 0 HA GLU B 35 5.579 6.938 9.316 1.00 0.00 H new ATOM 0 HB2 GLU B 35 2.668 7.725 9.343 1.00 0.00 H new ATOM 0 HB3 GLU B 35 3.394 6.211 8.839 1.00 0.00 H new ATOM 0 HG2 GLU B 35 2.569 5.515 10.848 1.00 0.00 H new ATOM 0 HG3 GLU B 35 4.115 6.113 11.417 1.00 0.00 H new ATOM 1989 N LYS B 36 3.913 9.620 8.307 1.00 0.00 N ATOM 1990 CA LYS B 36 3.821 10.604 7.235 1.00 0.00 C ATOM 1991 C LYS B 36 5.161 11.302 7.016 1.00 0.00 C ATOM 1992 O LYS B 36 5.664 11.362 5.893 1.00 0.00 O ATOM 1993 CB LYS B 36 2.745 11.638 7.565 1.00 0.00 C ATOM 1994 CG LYS B 36 2.394 11.695 9.043 1.00 0.00 C ATOM 1995 CD LYS B 36 1.698 12.996 9.401 1.00 0.00 C ATOM 1996 CE LYS B 36 2.617 14.191 9.203 1.00 0.00 C ATOM 1997 NZ LYS B 36 2.791 14.976 10.455 1.00 0.00 N ATOM 0 H LYS B 36 3.232 9.747 9.055 1.00 0.00 H new ATOM 0 HA LYS B 36 3.552 10.082 6.317 1.00 0.00 H new ATOM 0 HB2 LYS B 36 3.086 12.622 7.242 1.00 0.00 H new ATOM 0 HB3 LYS B 36 1.845 11.409 6.994 1.00 0.00 H new ATOM 0 HG2 LYS B 36 1.749 10.854 9.297 1.00 0.00 H new ATOM 0 HG3 LYS B 36 3.302 11.591 9.638 1.00 0.00 H new ATOM 0 HD2 LYS B 36 0.807 13.115 8.785 1.00 0.00 H new ATOM 0 HD3 LYS B 36 1.366 12.959 10.438 1.00 0.00 H new ATOM 0 HE2 LYS B 36 3.590 13.846 8.854 1.00 0.00 H new ATOM 0 HE3 LYS B 36 2.210 14.836 8.425 1.00 0.00 H new ATOM 0 HZ1 LYS B 36 3.744 15.393 10.474 1.00 0.00 H new ATOM 0 HZ2 LYS B 36 2.080 15.735 10.491 1.00 0.00 H new ATOM 0 HZ3 LYS B 36 2.671 14.350 11.277 1.00 0.00 H new ATOM 2011 N ASP B 37 5.737 11.829 8.094 1.00 0.00 N ATOM 2012 CA ASP B 37 7.017 12.523 8.016 1.00 0.00 C ATOM 2013 C ASP B 37 8.074 11.639 7.364 1.00 0.00 C ATOM 2014 O ASP B 37 8.619 11.977 6.312 1.00 0.00 O ATOM 2015 CB ASP B 37 7.477 12.945 9.413 1.00 0.00 C ATOM 2016 CG ASP B 37 7.041 14.355 9.764 1.00 0.00 C ATOM 2017 OD1 ASP B 37 6.043 14.830 9.184 1.00 0.00 O ATOM 2018 OD2 ASP B 37 7.698 14.983 10.621 1.00 0.00 O ATOM 0 H ASP B 37 5.336 11.788 9.031 1.00 0.00 H new ATOM 0 HA ASP B 37 6.884 13.413 7.401 1.00 0.00 H new ATOM 0 HB2 ASP B 37 7.076 12.249 10.150 1.00 0.00 H new ATOM 0 HB3 ASP B 37 8.563 12.879 9.470 1.00 0.00 H new ATOM 2023 N ILE B 38 8.355 10.504 7.992 1.00 0.00 N ATOM 2024 CA ILE B 38 9.343 9.567 7.474 1.00 0.00 C ATOM 2025 C ILE B 38 9.153 9.344 5.978 1.00 0.00 C ATOM 2026 O ILE B 38 10.106 9.421 5.203 1.00 0.00 O ATOM 2027 CB ILE B 38 9.262 8.210 8.199 1.00 0.00 C ATOM 2028 CG1 ILE B 38 9.033 8.421 9.698 1.00 0.00 C ATOM 2029 CG2 ILE B 38 10.530 7.404 7.960 1.00 0.00 C ATOM 2030 CD1 ILE B 38 8.167 7.355 10.333 1.00 0.00 C ATOM 0 H ILE B 38 7.912 10.210 8.862 1.00 0.00 H new ATOM 0 HA ILE B 38 10.324 10.007 7.652 1.00 0.00 H new ATOM 0 HB ILE B 38 8.418 7.650 7.796 1.00 0.00 H new ATOM 0 HG12 ILE B 38 9.998 8.444 10.205 1.00 0.00 H new ATOM 0 HG13 ILE B 38 8.569 9.395 9.853 1.00 0.00 H new ATOM 0 HG21 ILE B 38 10.457 6.448 8.479 1.00 0.00 H new ATOM 0 HG22 ILE B 38 10.653 7.228 6.891 1.00 0.00 H new ATOM 0 HG23 ILE B 38 11.390 7.957 8.338 1.00 0.00 H new ATOM 0 HD11 ILE B 38 8.047 7.568 11.395 1.00 0.00 H new ATOM 0 HD12 ILE B 38 7.189 7.347 9.852 1.00 0.00 H new ATOM 0 HD13 ILE B 38 8.640 6.381 10.210 1.00 0.00 H new ATOM 2042 N ALA B 39 7.915 9.072 5.579 1.00 0.00 N ATOM 2043 CA ALA B 39 7.599 8.843 4.175 1.00 0.00 C ATOM 2044 C ALA B 39 7.891 10.084 3.340 1.00 0.00 C ATOM 2045 O ALA B 39 8.301 9.986 2.183 1.00 0.00 O ATOM 2046 CB ALA B 39 6.141 8.435 4.021 1.00 0.00 C ATOM 0 H ALA B 39 7.115 9.005 6.208 1.00 0.00 H new ATOM 0 HA ALA B 39 8.232 8.033 3.813 1.00 0.00 H new ATOM 0 HB1 ALA B 39 5.919 8.267 2.967 1.00 0.00 H new ATOM 0 HB2 ALA B 39 5.959 7.517 4.581 1.00 0.00 H new ATOM 0 HB3 ALA B 39 5.499 9.228 4.405 1.00 0.00 H new ATOM 2052 N ALA B 40 7.679 11.253 3.937 1.00 0.00 N ATOM 2053 CA ALA B 40 7.919 12.517 3.253 1.00 0.00 C ATOM 2054 C ALA B 40 9.388 12.665 2.877 1.00 0.00 C ATOM 2055 O ALA B 40 9.735 12.744 1.698 1.00 0.00 O ATOM 2056 CB ALA B 40 7.479 13.681 4.127 1.00 0.00 C ATOM 0 H ALA B 40 7.341 11.350 4.894 1.00 0.00 H new ATOM 0 HA ALA B 40 7.332 12.523 2.335 1.00 0.00 H new ATOM 0 HB1 ALA B 40 7.664 14.619 3.604 1.00 0.00 H new ATOM 0 HB2 ALA B 40 6.415 13.591 4.345 1.00 0.00 H new ATOM 0 HB3 ALA B 40 8.042 13.669 5.060 1.00 0.00 H new ATOM 2062 N HIS B 41 10.249 12.706 3.888 1.00 0.00 N ATOM 2063 CA HIS B 41 11.683 12.848 3.667 1.00 0.00 C ATOM 2064 C HIS B 41 12.195 11.779 2.708 1.00 0.00 C ATOM 2065 O HIS B 41 12.827 12.088 1.697 1.00 0.00 O ATOM 2066 CB HIS B 41 12.442 12.761 4.994 1.00 0.00 C ATOM 2067 CG HIS B 41 11.564 12.907 6.199 1.00 0.00 C ATOM 2068 ND1 HIS B 41 11.609 12.044 7.274 1.00 0.00 N ATOM 2069 CD2 HIS B 41 10.613 13.826 6.495 1.00 0.00 C ATOM 2070 CE1 HIS B 41 10.723 12.425 8.178 1.00 0.00 C ATOM 2071 NE2 HIS B 41 10.107 13.503 7.730 1.00 0.00 N ATOM 0 H HIS B 41 9.978 12.643 4.869 1.00 0.00 H new ATOM 0 HA HIS B 41 11.857 13.827 3.221 1.00 0.00 H new ATOM 0 HB2 HIS B 41 12.958 11.802 5.045 1.00 0.00 H new ATOM 0 HB3 HIS B 41 13.207 13.537 5.017 1.00 0.00 H new ATOM 0 HD2 HIS B 41 10.310 14.657 5.875 1.00 0.00 H new ATOM 0 HE1 HIS B 41 10.535 11.937 9.123 1.00 0.00 H new ATOM 0 HE2 HIS B 41 9.374 14.014 8.222 1.00 0.00 H new ATOM 2080 N ILE B 42 11.919 10.520 3.032 1.00 0.00 N ATOM 2081 CA ILE B 42 12.355 9.407 2.199 1.00 0.00 C ATOM 2082 C ILE B 42 12.113 9.694 0.721 1.00 0.00 C ATOM 2083 O ILE B 42 13.057 9.838 -0.053 1.00 0.00 O ATOM 2084 CB ILE B 42 11.633 8.100 2.583 1.00 0.00 C ATOM 2085 CG1 ILE B 42 11.878 7.768 4.056 1.00 0.00 C ATOM 2086 CG2 ILE B 42 12.099 6.957 1.693 1.00 0.00 C ATOM 2087 CD1 ILE B 42 10.990 6.663 4.585 1.00 0.00 C ATOM 0 H ILE B 42 11.396 10.246 3.864 1.00 0.00 H new ATOM 0 HA ILE B 42 13.425 9.286 2.370 1.00 0.00 H new ATOM 0 HB ILE B 42 10.562 8.238 2.435 1.00 0.00 H new ATOM 0 HG12 ILE B 42 12.921 7.478 4.186 1.00 0.00 H new ATOM 0 HG13 ILE B 42 11.720 8.666 4.653 1.00 0.00 H new ATOM 0 HG21 ILE B 42 11.581 6.041 1.976 1.00 0.00 H new ATOM 0 HG22 ILE B 42 11.877 7.193 0.652 1.00 0.00 H new ATOM 0 HG23 ILE B 42 13.173 6.818 1.813 1.00 0.00 H new ATOM 0 HD11 ILE B 42 11.220 6.482 5.635 1.00 0.00 H new ATOM 0 HD12 ILE B 42 9.945 6.958 4.488 1.00 0.00 H new ATOM 0 HD13 ILE B 42 11.164 5.751 4.013 1.00 0.00 H new ATOM 2099 N LYS B 43 10.844 9.780 0.336 1.00 0.00 N ATOM 2100 CA LYS B 43 10.485 10.053 -1.051 1.00 0.00 C ATOM 2101 C LYS B 43 11.372 11.146 -1.638 1.00 0.00 C ATOM 2102 O LYS B 43 11.948 10.983 -2.713 1.00 0.00 O ATOM 2103 CB LYS B 43 9.011 10.462 -1.146 1.00 0.00 C ATOM 2104 CG LYS B 43 8.662 11.202 -2.429 1.00 0.00 C ATOM 2105 CD LYS B 43 7.159 11.358 -2.593 1.00 0.00 C ATOM 2106 CE LYS B 43 6.782 12.787 -2.953 1.00 0.00 C ATOM 2107 NZ LYS B 43 7.306 13.180 -4.290 1.00 0.00 N ATOM 0 H LYS B 43 10.048 9.665 0.964 1.00 0.00 H new ATOM 0 HA LYS B 43 10.638 9.141 -1.628 1.00 0.00 H new ATOM 0 HB2 LYS B 43 8.390 9.569 -1.072 1.00 0.00 H new ATOM 0 HB3 LYS B 43 8.763 11.094 -0.294 1.00 0.00 H new ATOM 0 HG2 LYS B 43 9.132 12.185 -2.422 1.00 0.00 H new ATOM 0 HG3 LYS B 43 9.068 10.661 -3.284 1.00 0.00 H new ATOM 0 HD2 LYS B 43 6.805 10.681 -3.370 1.00 0.00 H new ATOM 0 HD3 LYS B 43 6.659 11.071 -1.668 1.00 0.00 H new ATOM 0 HE2 LYS B 43 5.697 12.889 -2.944 1.00 0.00 H new ATOM 0 HE3 LYS B 43 7.172 13.467 -2.196 1.00 0.00 H new ATOM 0 HZ1 LYS B 43 7.027 14.160 -4.498 1.00 0.00 H new ATOM 0 HZ2 LYS B 43 8.343 13.107 -4.291 1.00 0.00 H new ATOM 0 HZ3 LYS B 43 6.914 12.547 -5.016 1.00 0.00 H new ATOM 2121 N LYS B 44 11.473 12.264 -0.926 1.00 0.00 N ATOM 2122 CA LYS B 44 12.285 13.388 -1.376 1.00 0.00 C ATOM 2123 C LYS B 44 13.726 12.960 -1.633 1.00 0.00 C ATOM 2124 O LYS B 44 14.318 13.313 -2.653 1.00 0.00 O ATOM 2125 CB LYS B 44 12.252 14.511 -0.337 1.00 0.00 C ATOM 2126 CG LYS B 44 11.009 15.383 -0.421 1.00 0.00 C ATOM 2127 CD LYS B 44 10.819 16.205 0.844 1.00 0.00 C ATOM 2128 CE LYS B 44 11.528 17.548 0.755 1.00 0.00 C ATOM 2129 NZ LYS B 44 12.498 17.594 -0.374 1.00 0.00 N ATOM 0 H LYS B 44 11.002 12.415 -0.034 1.00 0.00 H new ATOM 0 HA LYS B 44 11.866 13.752 -2.314 1.00 0.00 H new ATOM 0 HB2 LYS B 44 12.312 14.074 0.660 1.00 0.00 H new ATOM 0 HB3 LYS B 44 13.135 15.138 -0.464 1.00 0.00 H new ATOM 0 HG2 LYS B 44 11.088 16.049 -1.280 1.00 0.00 H new ATOM 0 HG3 LYS B 44 10.133 14.755 -0.583 1.00 0.00 H new ATOM 0 HD2 LYS B 44 9.755 16.366 1.017 1.00 0.00 H new ATOM 0 HD3 LYS B 44 11.200 15.648 1.700 1.00 0.00 H new ATOM 0 HE2 LYS B 44 10.790 18.340 0.631 1.00 0.00 H new ATOM 0 HE3 LYS B 44 12.051 17.744 1.691 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 13.066 18.463 -0.308 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 13.125 16.766 -0.327 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 11.981 17.586 -1.276 1.00 0.00 H new ATOM 2143 N GLU B 45 14.285 12.201 -0.698 1.00 0.00 N ATOM 2144 CA GLU B 45 15.659 11.730 -0.820 1.00 0.00 C ATOM 2145 C GLU B 45 15.796 10.721 -1.955 1.00 0.00 C ATOM 2146 O GLU B 45 16.820 10.676 -2.635 1.00 0.00 O ATOM 2147 CB GLU B 45 16.123 11.099 0.495 1.00 0.00 C ATOM 2148 CG GLU B 45 16.559 12.114 1.538 1.00 0.00 C ATOM 2149 CD GLU B 45 16.005 11.810 2.916 1.00 0.00 C ATOM 2150 OE1 GLU B 45 16.430 10.801 3.518 1.00 0.00 O ATOM 2151 OE2 GLU B 45 15.147 12.581 3.394 1.00 0.00 O ATOM 0 H GLU B 45 13.809 11.899 0.152 1.00 0.00 H new ATOM 0 HA GLU B 45 16.289 12.590 -1.047 1.00 0.00 H new ATOM 0 HB2 GLU B 45 15.313 10.496 0.904 1.00 0.00 H new ATOM 0 HB3 GLU B 45 16.952 10.422 0.290 1.00 0.00 H new ATOM 0 HG2 GLU B 45 17.648 12.136 1.585 1.00 0.00 H new ATOM 0 HG3 GLU B 45 16.233 13.108 1.231 1.00 0.00 H new ATOM 2158 N PHE B 46 14.761 9.913 -2.153 1.00 0.00 N ATOM 2159 CA PHE B 46 14.773 8.904 -3.207 1.00 0.00 C ATOM 2160 C PHE B 46 14.640 9.548 -4.580 1.00 0.00 C ATOM 2161 O PHE B 46 15.193 9.056 -5.564 1.00 0.00 O ATOM 2162 CB PHE B 46 13.646 7.895 -2.989 1.00 0.00 C ATOM 2163 CG PHE B 46 14.137 6.528 -2.614 1.00 0.00 C ATOM 2164 CD1 PHE B 46 14.622 6.279 -1.340 1.00 0.00 C ATOM 2165 CD2 PHE B 46 14.121 5.494 -3.536 1.00 0.00 C ATOM 2166 CE1 PHE B 46 15.081 5.024 -0.993 1.00 0.00 C ATOM 2167 CE2 PHE B 46 14.578 4.236 -3.195 1.00 0.00 C ATOM 2168 CZ PHE B 46 15.060 4.001 -1.922 1.00 0.00 C ATOM 0 H PHE B 46 13.905 9.936 -1.599 1.00 0.00 H new ATOM 0 HA PHE B 46 15.729 8.382 -3.165 1.00 0.00 H new ATOM 0 HB2 PHE B 46 12.985 8.264 -2.205 1.00 0.00 H new ATOM 0 HB3 PHE B 46 13.051 7.823 -3.900 1.00 0.00 H new ATOM 0 HD1 PHE B 46 14.641 7.075 -0.611 1.00 0.00 H new ATOM 0 HD2 PHE B 46 13.747 5.674 -4.533 1.00 0.00 H new ATOM 0 HE1 PHE B 46 15.456 4.842 0.003 1.00 0.00 H new ATOM 0 HE2 PHE B 46 14.559 3.438 -3.922 1.00 0.00 H new ATOM 0 HZ PHE B 46 15.420 3.019 -1.653 1.00 0.00 H new ATOM 2178 N ASP B 47 13.907 10.653 -4.639 1.00 0.00 N ATOM 2179 CA ASP B 47 13.705 11.365 -5.892 1.00 0.00 C ATOM 2180 C ASP B 47 14.986 12.065 -6.333 1.00 0.00 C ATOM 2181 O ASP B 47 15.298 12.119 -7.522 1.00 0.00 O ATOM 2182 CB ASP B 47 12.575 12.386 -5.746 1.00 0.00 C ATOM 2183 CG ASP B 47 11.205 11.738 -5.781 1.00 0.00 C ATOM 2184 OD1 ASP B 47 11.088 10.573 -5.349 1.00 0.00 O ATOM 2185 OD2 ASP B 47 10.248 12.397 -6.241 1.00 0.00 O ATOM 0 H ASP B 47 13.443 11.074 -3.834 1.00 0.00 H new ATOM 0 HA ASP B 47 13.430 10.637 -6.655 1.00 0.00 H new ATOM 0 HB2 ASP B 47 12.695 12.926 -4.807 1.00 0.00 H new ATOM 0 HB3 ASP B 47 12.647 13.121 -6.547 1.00 0.00 H new ATOM 2190 N LYS B 48 15.721 12.607 -5.368 1.00 0.00 N ATOM 2191 CA LYS B 48 16.962 13.311 -5.662 1.00 0.00 C ATOM 2192 C LYS B 48 18.165 12.371 -5.631 1.00 0.00 C ATOM 2193 O LYS B 48 19.195 12.650 -6.245 1.00 0.00 O ATOM 2194 CB LYS B 48 17.169 14.452 -4.665 1.00 0.00 C ATOM 2195 CG LYS B 48 16.724 15.807 -5.190 1.00 0.00 C ATOM 2196 CD LYS B 48 17.897 16.760 -5.326 1.00 0.00 C ATOM 2197 CE LYS B 48 18.854 16.309 -6.417 1.00 0.00 C ATOM 2198 NZ LYS B 48 18.129 15.703 -7.569 1.00 0.00 N ATOM 0 H LYS B 48 15.479 12.572 -4.378 1.00 0.00 H new ATOM 0 HA LYS B 48 16.880 13.718 -6.670 1.00 0.00 H new ATOM 0 HB2 LYS B 48 16.620 14.228 -3.750 1.00 0.00 H new ATOM 0 HB3 LYS B 48 18.225 14.504 -4.399 1.00 0.00 H new ATOM 0 HG2 LYS B 48 16.240 15.683 -6.159 1.00 0.00 H new ATOM 0 HG3 LYS B 48 15.982 16.235 -4.516 1.00 0.00 H new ATOM 0 HD2 LYS B 48 17.530 17.761 -5.553 1.00 0.00 H new ATOM 0 HD3 LYS B 48 18.429 16.823 -4.377 1.00 0.00 H new ATOM 0 HE2 LYS B 48 19.439 17.161 -6.763 1.00 0.00 H new ATOM 0 HE3 LYS B 48 19.557 15.584 -6.007 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 18.551 16.037 -8.459 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 18.202 14.667 -7.519 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 17.128 15.981 -7.534 1.00 0.00 H new ATOM 2212 N LYS B 49 18.035 11.263 -4.909 1.00 0.00 N ATOM 2213 CA LYS B 49 19.123 10.296 -4.799 1.00 0.00 C ATOM 2214 C LYS B 49 19.100 9.301 -5.953 1.00 0.00 C ATOM 2215 O LYS B 49 20.108 8.659 -6.249 1.00 0.00 O ATOM 2216 CB LYS B 49 19.041 9.549 -3.467 1.00 0.00 C ATOM 2217 CG LYS B 49 20.380 9.012 -2.989 1.00 0.00 C ATOM 2218 CD LYS B 49 20.583 7.566 -3.411 1.00 0.00 C ATOM 2219 CE LYS B 49 22.005 7.319 -3.884 1.00 0.00 C ATOM 2220 NZ LYS B 49 22.069 6.229 -4.896 1.00 0.00 N ATOM 0 H LYS B 49 17.191 11.012 -4.393 1.00 0.00 H new ATOM 0 HA LYS B 49 20.062 10.848 -4.843 1.00 0.00 H new ATOM 0 HB2 LYS B 49 18.635 10.219 -2.709 1.00 0.00 H new ATOM 0 HB3 LYS B 49 18.341 8.720 -3.567 1.00 0.00 H new ATOM 0 HG2 LYS B 49 21.185 9.626 -3.393 1.00 0.00 H new ATOM 0 HG3 LYS B 49 20.436 9.087 -1.903 1.00 0.00 H new ATOM 0 HD2 LYS B 49 20.357 6.906 -2.573 1.00 0.00 H new ATOM 0 HD3 LYS B 49 19.884 7.317 -4.210 1.00 0.00 H new ATOM 0 HE2 LYS B 49 22.410 8.236 -4.311 1.00 0.00 H new ATOM 0 HE3 LYS B 49 22.632 7.060 -3.031 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 22.803 5.545 -4.623 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 21.149 5.747 -4.946 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 22.300 6.632 -5.826 1.00 0.00 H new ATOM 2234 N TYR B 50 17.947 9.167 -6.602 1.00 0.00 N ATOM 2235 CA TYR B 50 17.814 8.237 -7.717 1.00 0.00 C ATOM 2236 C TYR B 50 17.140 8.893 -8.919 1.00 0.00 C ATOM 2237 O TYR B 50 17.765 9.076 -9.964 1.00 0.00 O ATOM 2238 CB TYR B 50 17.017 7.005 -7.286 1.00 0.00 C ATOM 2239 CG TYR B 50 17.410 6.474 -5.927 1.00 0.00 C ATOM 2240 CD1 TYR B 50 18.502 5.628 -5.780 1.00 0.00 C ATOM 2241 CD2 TYR B 50 16.689 6.819 -4.791 1.00 0.00 C ATOM 2242 CE1 TYR B 50 18.864 5.141 -4.539 1.00 0.00 C ATOM 2243 CE2 TYR B 50 17.045 6.337 -3.547 1.00 0.00 C ATOM 2244 CZ TYR B 50 18.132 5.498 -3.425 1.00 0.00 C ATOM 2245 OH TYR B 50 18.491 5.015 -2.188 1.00 0.00 O ATOM 0 H TYR B 50 17.098 9.686 -6.377 1.00 0.00 H new ATOM 0 HA TYR B 50 18.818 7.935 -8.015 1.00 0.00 H new ATOM 0 HB2 TYR B 50 15.956 7.254 -7.276 1.00 0.00 H new ATOM 0 HB3 TYR B 50 17.153 6.218 -8.027 1.00 0.00 H new ATOM 0 HD1 TYR B 50 19.077 5.347 -6.650 1.00 0.00 H new ATOM 0 HD2 TYR B 50 15.836 7.475 -4.882 1.00 0.00 H new ATOM 0 HE1 TYR B 50 19.716 4.484 -4.441 1.00 0.00 H new ATOM 0 HE2 TYR B 50 16.474 6.616 -2.674 1.00 0.00 H new ATOM 0 HH TYR B 50 18.053 5.545 -1.490 1.00 0.00 H new ATOM 2255 N ASN B 51 15.862 9.235 -8.764 1.00 0.00 N ATOM 2256 CA ASN B 51 15.093 9.859 -9.835 1.00 0.00 C ATOM 2257 C ASN B 51 13.596 9.669 -9.596 1.00 0.00 C ATOM 2258 O ASN B 51 13.108 8.540 -9.559 1.00 0.00 O ATOM 2259 CB ASN B 51 15.475 9.262 -11.191 1.00 0.00 C ATOM 2260 CG ASN B 51 14.467 9.595 -12.273 1.00 0.00 C ATOM 2261 OD1 ASN B 51 14.024 8.720 -13.018 1.00 0.00 O ATOM 2262 ND2 ASN B 51 14.100 10.868 -12.367 1.00 0.00 N ATOM 0 H ASN B 51 15.337 9.089 -7.902 1.00 0.00 H new ATOM 0 HA ASN B 51 15.323 10.925 -9.840 1.00 0.00 H new ATOM 0 HB2 ASN B 51 16.456 9.634 -11.485 1.00 0.00 H new ATOM 0 HB3 ASN B 51 15.559 8.179 -11.098 1.00 0.00 H new ATOM 0 HD21 ASN B 51 13.426 11.153 -13.077 1.00 0.00 H new ATOM 0 HD22 ASN B 51 14.492 11.560 -11.729 1.00 0.00 H new ATOM 2269 N PRO B 52 12.845 10.770 -9.428 1.00 0.00 N ATOM 2270 CA PRO B 52 11.399 10.704 -9.192 1.00 0.00 C ATOM 2271 C PRO B 52 10.651 10.025 -10.345 1.00 0.00 C ATOM 2272 O PRO B 52 11.244 9.748 -11.387 1.00 0.00 O ATOM 2273 CB PRO B 52 10.982 12.173 -9.067 1.00 0.00 C ATOM 2274 CG PRO B 52 12.085 12.949 -9.704 1.00 0.00 C ATOM 2275 CD PRO B 52 13.336 12.157 -9.456 1.00 0.00 C ATOM 0 HA PRO B 52 11.160 10.109 -8.310 1.00 0.00 H new ATOM 0 HB2 PRO B 52 10.031 12.356 -9.568 1.00 0.00 H new ATOM 0 HB3 PRO B 52 10.852 12.458 -8.023 1.00 0.00 H new ATOM 0 HG2 PRO B 52 11.908 13.076 -10.772 1.00 0.00 H new ATOM 0 HG3 PRO B 52 12.162 13.947 -9.272 1.00 0.00 H new ATOM 0 HD2 PRO B 52 14.074 12.309 -10.244 1.00 0.00 H new ATOM 0 HD3 PRO B 52 13.812 12.437 -8.516 1.00 0.00 H new ATOM 2283 N THR B 53 9.348 9.753 -10.165 1.00 0.00 N ATOM 2284 CA THR B 53 8.631 10.078 -8.932 1.00 0.00 C ATOM 2285 C THR B 53 8.388 8.829 -8.095 1.00 0.00 C ATOM 2286 O THR B 53 7.929 7.807 -8.603 1.00 0.00 O ATOM 2287 CB THR B 53 7.299 10.756 -9.257 1.00 0.00 C ATOM 2288 OG1 THR B 53 7.506 11.910 -10.052 1.00 0.00 O ATOM 2289 CG2 THR B 53 6.523 11.177 -8.027 1.00 0.00 C ATOM 0 H THR B 53 8.767 9.302 -10.872 1.00 0.00 H new ATOM 0 HA THR B 53 9.250 10.764 -8.353 1.00 0.00 H new ATOM 0 HB THR B 53 6.717 10.006 -9.792 1.00 0.00 H new ATOM 0 HG1 THR B 53 6.643 12.329 -10.251 1.00 0.00 H new ATOM 0 HG21 THR B 53 5.589 11.651 -8.330 1.00 0.00 H new ATOM 0 HG22 THR B 53 6.304 10.300 -7.417 1.00 0.00 H new ATOM 0 HG23 THR B 53 7.116 11.883 -7.446 1.00 0.00 H new ATOM 2297 N TRP B 54 8.706 8.920 -6.810 1.00 0.00 N ATOM 2298 CA TRP B 54 8.530 7.799 -5.899 1.00 0.00 C ATOM 2299 C TRP B 54 7.284 7.968 -5.035 1.00 0.00 C ATOM 2300 O TRP B 54 6.807 9.081 -4.813 1.00 0.00 O ATOM 2301 CB TRP B 54 9.755 7.652 -4.994 1.00 0.00 C ATOM 2302 CG TRP B 54 11.024 7.394 -5.744 1.00 0.00 C ATOM 2303 CD1 TRP B 54 11.711 8.279 -6.524 1.00 0.00 C ATOM 2304 CD2 TRP B 54 11.760 6.168 -5.782 1.00 0.00 C ATOM 2305 NE1 TRP B 54 12.828 7.677 -7.047 1.00 0.00 N ATOM 2306 CE2 TRP B 54 12.882 6.380 -6.605 1.00 0.00 C ATOM 2307 CE3 TRP B 54 11.580 4.911 -5.199 1.00 0.00 C ATOM 2308 CZ2 TRP B 54 13.818 5.380 -6.860 1.00 0.00 C ATOM 2309 CZ3 TRP B 54 12.509 3.920 -5.452 1.00 0.00 C ATOM 2310 CH2 TRP B 54 13.615 4.159 -6.276 1.00 0.00 C ATOM 0 H TRP B 54 9.088 9.760 -6.376 1.00 0.00 H new ATOM 0 HA TRP B 54 8.410 6.902 -6.507 1.00 0.00 H new ATOM 0 HB2 TRP B 54 9.870 8.560 -4.402 1.00 0.00 H new ATOM 0 HB3 TRP B 54 9.584 6.834 -4.294 1.00 0.00 H new ATOM 0 HD1 TRP B 54 11.418 9.303 -6.703 1.00 0.00 H new ATOM 0 HE1 TRP B 54 13.507 8.122 -7.664 1.00 0.00 H new ATOM 0 HE3 TRP B 54 10.730 4.717 -4.562 1.00 0.00 H new ATOM 0 HZ2 TRP B 54 14.672 5.562 -7.495 1.00 0.00 H new ATOM 0 HZ3 TRP B 54 12.380 2.945 -5.007 1.00 0.00 H new ATOM 0 HH2 TRP B 54 14.323 3.363 -6.455 1.00 0.00 H new ATOM 2321 N HIS B 55 6.786 6.847 -4.532 1.00 0.00 N ATOM 2322 CA HIS B 55 5.615 6.830 -3.664 1.00 0.00 C ATOM 2323 C HIS B 55 5.946 6.031 -2.411 1.00 0.00 C ATOM 2324 O HIS B 55 5.952 4.800 -2.434 1.00 0.00 O ATOM 2325 CB HIS B 55 4.416 6.219 -4.391 1.00 0.00 C ATOM 2326 CG HIS B 55 4.029 6.961 -5.633 1.00 0.00 C ATOM 2327 ND1 HIS B 55 2.734 7.345 -5.911 1.00 0.00 N ATOM 2328 CD2 HIS B 55 4.777 7.393 -6.677 1.00 0.00 C ATOM 2329 CE1 HIS B 55 2.701 7.977 -7.070 1.00 0.00 C ATOM 2330 NE2 HIS B 55 3.928 8.021 -7.555 1.00 0.00 N ATOM 0 H HIS B 55 7.181 5.924 -4.713 1.00 0.00 H new ATOM 0 HA HIS B 55 5.350 7.850 -3.387 1.00 0.00 H new ATOM 0 HB2 HIS B 55 4.647 5.186 -4.651 1.00 0.00 H new ATOM 0 HB3 HIS B 55 3.564 6.194 -3.712 1.00 0.00 H new ATOM 0 HD1 HIS B 55 1.926 7.168 -5.314 1.00 0.00 H new ATOM 0 HD2 HIS B 55 5.843 7.267 -6.796 1.00 0.00 H new ATOM 0 HE1 HIS B 55 1.820 8.388 -7.541 1.00 0.00 H new ATOM 2339 N CYS B 56 6.267 6.732 -1.331 1.00 0.00 N ATOM 2340 CA CYS B 56 6.650 6.067 -0.089 1.00 0.00 C ATOM 2341 C CYS B 56 5.567 6.133 0.981 1.00 0.00 C ATOM 2342 O CYS B 56 5.074 7.207 1.325 1.00 0.00 O ATOM 2343 CB CYS B 56 7.943 6.679 0.453 1.00 0.00 C ATOM 2344 SG CYS B 56 9.053 7.314 -0.825 1.00 0.00 S ATOM 0 H CYS B 56 6.271 7.751 -1.288 1.00 0.00 H new ATOM 0 HA CYS B 56 6.800 5.015 -0.330 1.00 0.00 H new ATOM 0 HB2 CYS B 56 7.690 7.491 1.135 1.00 0.00 H new ATOM 0 HB3 CYS B 56 8.472 5.926 1.037 1.00 0.00 H new ATOM 0 HG CYS B 56 8.904 6.619 -1.914 1.00 0.00 H new ATOM 2350 N ILE B 57 5.234 4.966 1.526 1.00 0.00 N ATOM 2351 CA ILE B 57 4.244 4.857 2.592 1.00 0.00 C ATOM 2352 C ILE B 57 4.856 4.128 3.782 1.00 0.00 C ATOM 2353 O ILE B 57 4.987 2.905 3.771 1.00 0.00 O ATOM 2354 CB ILE B 57 2.977 4.102 2.140 1.00 0.00 C ATOM 2355 CG1 ILE B 57 2.470 4.648 0.801 1.00 0.00 C ATOM 2356 CG2 ILE B 57 1.896 4.201 3.210 1.00 0.00 C ATOM 2357 CD1 ILE B 57 2.354 6.155 0.754 1.00 0.00 C ATOM 0 H ILE B 57 5.640 4.074 1.243 1.00 0.00 H new ATOM 0 HA ILE B 57 3.950 5.870 2.867 1.00 0.00 H new ATOM 0 HB ILE B 57 3.229 3.051 2.000 1.00 0.00 H new ATOM 0 HG12 ILE B 57 3.144 4.321 0.009 1.00 0.00 H new ATOM 0 HG13 ILE B 57 1.494 4.212 0.589 1.00 0.00 H new ATOM 0 HG21 ILE B 57 1.007 3.664 2.880 1.00 0.00 H new ATOM 0 HG22 ILE B 57 2.261 3.761 4.138 1.00 0.00 H new ATOM 0 HG23 ILE B 57 1.646 5.248 3.379 1.00 0.00 H new ATOM 0 HD11 ILE B 57 1.989 6.461 -0.226 1.00 0.00 H new ATOM 0 HD12 ILE B 57 1.657 6.490 1.522 1.00 0.00 H new ATOM 0 HD13 ILE B 57 3.332 6.601 0.932 1.00 0.00 H new ATOM 2369 N VAL B 58 5.250 4.887 4.797 1.00 0.00 N ATOM 2370 CA VAL B 58 5.871 4.306 5.979 1.00 0.00 C ATOM 2371 C VAL B 58 4.949 4.361 7.188 1.00 0.00 C ATOM 2372 O VAL B 58 4.451 5.423 7.559 1.00 0.00 O ATOM 2373 CB VAL B 58 7.193 5.017 6.319 1.00 0.00 C ATOM 2374 CG1 VAL B 58 6.993 6.520 6.346 1.00 0.00 C ATOM 2375 CG2 VAL B 58 7.745 4.520 7.646 1.00 0.00 C ATOM 0 H VAL B 58 5.151 5.902 4.825 1.00 0.00 H new ATOM 0 HA VAL B 58 6.073 3.262 5.742 1.00 0.00 H new ATOM 0 HB VAL B 58 7.921 4.782 5.543 1.00 0.00 H new ATOM 0 HG11 VAL B 58 7.937 7.008 6.588 1.00 0.00 H new ATOM 0 HG12 VAL B 58 6.649 6.859 5.369 1.00 0.00 H new ATOM 0 HG13 VAL B 58 6.249 6.775 7.101 1.00 0.00 H new ATOM 0 HG21 VAL B 58 8.680 5.035 7.867 1.00 0.00 H new ATOM 0 HG22 VAL B 58 7.024 4.721 8.438 1.00 0.00 H new ATOM 0 HG23 VAL B 58 7.928 3.447 7.585 1.00 0.00 H new ATOM 2385 N GLY B 59 4.739 3.202 7.801 1.00 0.00 N ATOM 2386 CA GLY B 59 3.888 3.119 8.971 1.00 0.00 C ATOM 2387 C GLY B 59 4.403 2.104 9.970 1.00 0.00 C ATOM 2388 O GLY B 59 5.387 2.354 10.666 1.00 0.00 O ATOM 0 H GLY B 59 5.146 2.314 7.506 1.00 0.00 H new ATOM 0 HA2 GLY B 59 3.827 4.098 9.446 1.00 0.00 H new ATOM 0 HA3 GLY B 59 2.877 2.849 8.667 1.00 0.00 H new ATOM 2392 N ARG B 60 3.742 0.955 10.040 1.00 0.00 N ATOM 2393 CA ARG B 60 4.141 -0.096 10.955 1.00 0.00 C ATOM 2394 C ARG B 60 3.100 -1.210 11.003 1.00 0.00 C ATOM 2395 O ARG B 60 3.440 -2.380 11.179 1.00 0.00 O ATOM 2396 CB ARG B 60 4.349 0.490 12.341 1.00 0.00 C ATOM 2397 CG ARG B 60 3.125 1.195 12.899 1.00 0.00 C ATOM 2398 CD ARG B 60 3.475 2.010 14.131 1.00 0.00 C ATOM 2399 NE ARG B 60 2.964 3.376 14.046 1.00 0.00 N ATOM 2400 CZ ARG B 60 3.569 4.424 14.598 1.00 0.00 C ATOM 2401 NH1 ARG B 60 4.702 4.262 15.268 1.00 0.00 N ATOM 2402 NH2 ARG B 60 3.042 5.635 14.480 1.00 0.00 N ATOM 0 H ARG B 60 2.926 0.731 9.471 1.00 0.00 H new ATOM 0 HA ARG B 60 5.076 -0.529 10.599 1.00 0.00 H new ATOM 0 HB2 ARG B 60 4.639 -0.309 13.023 1.00 0.00 H new ATOM 0 HB3 ARG B 60 5.179 1.196 12.306 1.00 0.00 H new ATOM 0 HG2 ARG B 60 2.699 1.848 12.137 1.00 0.00 H new ATOM 0 HG3 ARG B 60 2.362 0.459 13.151 1.00 0.00 H new ATOM 0 HD2 ARG B 60 3.065 1.524 15.016 1.00 0.00 H new ATOM 0 HD3 ARG B 60 4.558 2.035 14.254 1.00 0.00 H new ATOM 0 HE ARG B 60 2.095 3.535 13.535 1.00 0.00 H new ATOM 0 HH11 ARG B 60 5.111 3.332 15.361 1.00 0.00 H new ATOM 0 HH12 ARG B 60 5.164 5.067 15.690 1.00 0.00 H new ATOM 0 HH21 ARG B 60 2.171 5.764 13.965 1.00 0.00 H new ATOM 0 HH22 ARG B 60 3.508 6.437 14.904 1.00 0.00 H new ATOM 2416 N ASN B 61 1.833 -0.841 10.847 1.00 0.00 N ATOM 2417 CA ASN B 61 0.750 -1.815 10.875 1.00 0.00 C ATOM 2418 C ASN B 61 -0.361 -1.429 9.906 1.00 0.00 C ATOM 2419 O ASN B 61 -1.540 -1.461 10.260 1.00 0.00 O ATOM 2420 CB ASN B 61 0.179 -1.938 12.287 1.00 0.00 C ATOM 2421 CG ASN B 61 1.165 -2.552 13.262 1.00 0.00 C ATOM 2422 OD1 ASN B 61 1.034 -3.714 13.646 1.00 0.00 O ATOM 2423 ND2 ASN B 61 2.159 -1.772 13.668 1.00 0.00 N ATOM 0 H ASN B 61 1.532 0.123 10.700 1.00 0.00 H new ATOM 0 HA ASN B 61 1.161 -2.777 10.568 1.00 0.00 H new ATOM 0 HB2 ASN B 61 -0.113 -0.951 12.644 1.00 0.00 H new ATOM 0 HB3 ASN B 61 -0.725 -2.547 12.258 1.00 0.00 H new ATOM 0 HD21 ASN B 61 2.853 -2.130 14.324 1.00 0.00 H new ATOM 0 HD22 ASN B 61 2.229 -0.814 13.324 1.00 0.00 H new ATOM 2430 N PHE B 62 0.013 -1.066 8.684 1.00 0.00 N ATOM 2431 CA PHE B 62 -0.960 -0.681 7.677 1.00 0.00 C ATOM 2432 C PHE B 62 -1.029 -1.722 6.567 1.00 0.00 C ATOM 2433 O PHE B 62 -0.407 -2.782 6.654 1.00 0.00 O ATOM 2434 CB PHE B 62 -0.605 0.688 7.096 1.00 0.00 C ATOM 2435 CG PHE B 62 0.538 0.650 6.124 1.00 0.00 C ATOM 2436 CD1 PHE B 62 1.848 0.608 6.574 1.00 0.00 C ATOM 2437 CD2 PHE B 62 0.303 0.656 4.760 1.00 0.00 C ATOM 2438 CE1 PHE B 62 2.902 0.573 5.681 1.00 0.00 C ATOM 2439 CE2 PHE B 62 1.351 0.622 3.862 1.00 0.00 C ATOM 2440 CZ PHE B 62 2.652 0.581 4.322 1.00 0.00 C ATOM 0 H PHE B 62 0.983 -1.031 8.370 1.00 0.00 H new ATOM 0 HA PHE B 62 -1.939 -0.620 8.152 1.00 0.00 H new ATOM 0 HB2 PHE B 62 -1.482 1.100 6.597 1.00 0.00 H new ATOM 0 HB3 PHE B 62 -0.355 1.366 7.912 1.00 0.00 H new ATOM 0 HD1 PHE B 62 2.048 0.603 7.635 1.00 0.00 H new ATOM 0 HD2 PHE B 62 -0.713 0.688 4.394 1.00 0.00 H new ATOM 0 HE1 PHE B 62 3.919 0.539 6.044 1.00 0.00 H new ATOM 0 HE2 PHE B 62 1.153 0.627 2.800 1.00 0.00 H new ATOM 0 HZ PHE B 62 3.473 0.555 3.621 1.00 0.00 H new ATOM 2450 N GLY B 63 -1.787 -1.413 5.525 1.00 0.00 N ATOM 2451 CA GLY B 63 -1.927 -2.326 4.409 1.00 0.00 C ATOM 2452 C GLY B 63 -1.877 -1.602 3.082 1.00 0.00 C ATOM 2453 O GLY B 63 -2.873 -1.029 2.641 1.00 0.00 O ATOM 0 H GLY B 63 -2.310 -0.542 5.432 1.00 0.00 H new ATOM 0 HA2 GLY B 63 -1.132 -3.071 4.447 1.00 0.00 H new ATOM 0 HA3 GLY B 63 -2.872 -2.863 4.495 1.00 0.00 H new ATOM 2457 N SER B 64 -0.711 -1.614 2.450 1.00 0.00 N ATOM 2458 CA SER B 64 -0.538 -0.938 1.174 1.00 0.00 C ATOM 2459 C SER B 64 -0.926 -1.836 0.007 1.00 0.00 C ATOM 2460 O SER B 64 -0.373 -2.920 -0.175 1.00 0.00 O ATOM 2461 CB SER B 64 0.903 -0.455 1.012 1.00 0.00 C ATOM 2462 OG SER B 64 1.811 -1.319 1.672 1.00 0.00 O ATOM 0 H SER B 64 0.125 -2.083 2.799 1.00 0.00 H new ATOM 0 HA SER B 64 -1.203 -0.075 1.168 1.00 0.00 H new ATOM 0 HB2 SER B 64 1.154 -0.400 -0.047 1.00 0.00 H new ATOM 0 HB3 SER B 64 0.999 0.553 1.415 1.00 0.00 H new ATOM 0 HG SER B 64 1.975 -0.989 2.580 1.00 0.00 H new ATOM 2468 N TYR B 65 -1.881 -1.363 -0.784 1.00 0.00 N ATOM 2469 CA TYR B 65 -2.358 -2.098 -1.946 1.00 0.00 C ATOM 2470 C TYR B 65 -2.347 -1.205 -3.183 1.00 0.00 C ATOM 2471 O TYR B 65 -3.392 -0.729 -3.629 1.00 0.00 O ATOM 2472 CB TYR B 65 -3.771 -2.627 -1.697 1.00 0.00 C ATOM 2473 CG TYR B 65 -4.168 -3.755 -2.622 1.00 0.00 C ATOM 2474 CD1 TYR B 65 -3.638 -5.028 -2.464 1.00 0.00 C ATOM 2475 CD2 TYR B 65 -5.073 -3.543 -3.654 1.00 0.00 C ATOM 2476 CE1 TYR B 65 -3.999 -6.061 -3.309 1.00 0.00 C ATOM 2477 CE2 TYR B 65 -5.439 -4.570 -4.503 1.00 0.00 C ATOM 2478 CZ TYR B 65 -4.900 -5.827 -4.327 1.00 0.00 C ATOM 2479 OH TYR B 65 -5.262 -6.851 -5.170 1.00 0.00 O ATOM 0 H TYR B 65 -2.343 -0.465 -0.639 1.00 0.00 H new ATOM 0 HA TYR B 65 -1.690 -2.942 -2.117 1.00 0.00 H new ATOM 0 HB2 TYR B 65 -3.844 -2.972 -0.666 1.00 0.00 H new ATOM 0 HB3 TYR B 65 -4.482 -1.808 -1.811 1.00 0.00 H new ATOM 0 HD1 TYR B 65 -2.932 -5.215 -1.668 1.00 0.00 H new ATOM 0 HD2 TYR B 65 -5.497 -2.560 -3.795 1.00 0.00 H new ATOM 0 HE1 TYR B 65 -3.578 -7.046 -3.173 1.00 0.00 H new ATOM 0 HE2 TYR B 65 -6.144 -4.389 -5.301 1.00 0.00 H new ATOM 0 HH TYR B 65 -5.905 -6.519 -5.831 1.00 0.00 H new ATOM 2489 N VAL B 66 -1.156 -0.972 -3.725 1.00 0.00 N ATOM 2490 CA VAL B 66 -1.005 -0.127 -4.903 1.00 0.00 C ATOM 2491 C VAL B 66 -0.305 -0.872 -6.034 1.00 0.00 C ATOM 2492 O VAL B 66 0.306 -1.920 -5.820 1.00 0.00 O ATOM 2493 CB VAL B 66 -0.203 1.146 -4.578 1.00 0.00 C ATOM 2494 CG1 VAL B 66 -0.947 1.999 -3.563 1.00 0.00 C ATOM 2495 CG2 VAL B 66 1.184 0.787 -4.069 1.00 0.00 C ATOM 0 H VAL B 66 -0.282 -1.357 -3.367 1.00 0.00 H new ATOM 0 HA VAL B 66 -2.010 0.150 -5.221 1.00 0.00 H new ATOM 0 HB VAL B 66 -0.089 1.727 -5.493 1.00 0.00 H new ATOM 0 HG11 VAL B 66 -0.366 2.895 -3.345 1.00 0.00 H new ATOM 0 HG12 VAL B 66 -1.917 2.286 -3.970 1.00 0.00 H new ATOM 0 HG13 VAL B 66 -1.093 1.429 -2.646 1.00 0.00 H new ATOM 0 HG21 VAL B 66 1.737 1.699 -3.844 1.00 0.00 H new ATOM 0 HG22 VAL B 66 1.095 0.185 -3.165 1.00 0.00 H new ATOM 0 HG23 VAL B 66 1.716 0.219 -4.832 1.00 0.00 H new ATOM 2505 N THR B 67 -0.397 -0.320 -7.238 1.00 0.00 N ATOM 2506 CA THR B 67 0.227 -0.924 -8.407 1.00 0.00 C ATOM 2507 C THR B 67 1.701 -0.539 -8.490 1.00 0.00 C ATOM 2508 O THR B 67 2.048 0.642 -8.428 1.00 0.00 O ATOM 2509 CB THR B 67 -0.496 -0.486 -9.678 1.00 0.00 C ATOM 2510 OG1 THR B 67 -0.177 -1.344 -10.759 1.00 0.00 O ATOM 2511 CG2 THR B 67 -0.157 0.924 -10.098 1.00 0.00 C ATOM 0 H THR B 67 -0.899 0.547 -7.430 1.00 0.00 H new ATOM 0 HA THR B 67 0.154 -2.007 -8.311 1.00 0.00 H new ATOM 0 HB THR B 67 -1.558 -0.533 -9.438 1.00 0.00 H new ATOM 0 HG1 THR B 67 -0.652 -1.047 -11.563 1.00 0.00 H new ATOM 0 HG21 THR B 67 -0.703 1.174 -11.007 1.00 0.00 H new ATOM 0 HG22 THR B 67 -0.437 1.617 -9.305 1.00 0.00 H new ATOM 0 HG23 THR B 67 0.914 1.000 -10.286 1.00 0.00 H new ATOM 2519 N HIS B 68 2.563 -1.538 -8.629 1.00 0.00 N ATOM 2520 CA HIS B 68 3.997 -1.301 -8.718 1.00 0.00 C ATOM 2521 C HIS B 68 4.487 -1.451 -10.155 1.00 0.00 C ATOM 2522 O HIS B 68 4.377 -2.523 -10.750 1.00 0.00 O ATOM 2523 CB HIS B 68 4.755 -2.265 -7.804 1.00 0.00 C ATOM 2524 CG HIS B 68 4.620 -3.700 -8.205 1.00 0.00 C ATOM 2525 ND1 HIS B 68 3.454 -4.237 -8.709 1.00 0.00 N ATOM 2526 CD2 HIS B 68 5.517 -4.716 -8.175 1.00 0.00 C ATOM 2527 CE1 HIS B 68 3.639 -5.519 -8.970 1.00 0.00 C ATOM 2528 NE2 HIS B 68 4.881 -5.834 -8.657 1.00 0.00 N ATOM 0 H HIS B 68 2.293 -2.520 -8.683 1.00 0.00 H new ATOM 0 HA HIS B 68 4.190 -0.279 -8.393 1.00 0.00 H new ATOM 0 HB2 HIS B 68 5.811 -1.995 -7.801 1.00 0.00 H new ATOM 0 HB3 HIS B 68 4.392 -2.146 -6.783 1.00 0.00 H new ATOM 0 HD2 HIS B 68 6.541 -4.657 -7.836 1.00 0.00 H new ATOM 0 HE1 HIS B 68 2.898 -6.195 -9.372 1.00 0.00 H new ATOM 0 HE2 HIS B 68 5.301 -6.758 -8.757 1.00 0.00 H new ATOM 2537 N GLU B 69 5.027 -0.370 -10.704 1.00 0.00 N ATOM 2538 CA GLU B 69 5.538 -0.378 -12.071 1.00 0.00 C ATOM 2539 C GLU B 69 7.004 0.040 -12.101 1.00 0.00 C ATOM 2540 O GLU B 69 7.541 0.524 -11.105 1.00 0.00 O ATOM 2541 CB GLU B 69 4.708 0.558 -12.953 1.00 0.00 C ATOM 2542 CG GLU B 69 4.049 1.691 -12.184 1.00 0.00 C ATOM 2543 CD GLU B 69 2.902 2.324 -12.947 1.00 0.00 C ATOM 2544 OE1 GLU B 69 1.767 1.810 -12.845 1.00 0.00 O ATOM 2545 OE2 GLU B 69 3.137 3.330 -13.647 1.00 0.00 O ATOM 0 H GLU B 69 5.123 0.525 -10.224 1.00 0.00 H new ATOM 0 HA GLU B 69 5.459 -1.393 -12.459 1.00 0.00 H new ATOM 0 HB2 GLU B 69 5.350 0.980 -13.726 1.00 0.00 H new ATOM 0 HB3 GLU B 69 3.937 -0.022 -13.460 1.00 0.00 H new ATOM 0 HG2 GLU B 69 3.681 1.312 -11.231 1.00 0.00 H new ATOM 0 HG3 GLU B 69 4.794 2.453 -11.958 1.00 0.00 H new ATOM 2552 N THR B 70 7.648 -0.148 -13.247 1.00 0.00 N ATOM 2553 CA THR B 70 9.053 0.212 -13.400 1.00 0.00 C ATOM 2554 C THR B 70 9.951 -0.815 -12.716 1.00 0.00 C ATOM 2555 O THR B 70 10.216 -1.885 -13.264 1.00 0.00 O ATOM 2556 CB THR B 70 9.308 1.601 -12.812 1.00 0.00 C ATOM 2557 OG1 THR B 70 8.401 2.548 -13.349 1.00 0.00 O ATOM 2558 CG2 THR B 70 10.710 2.111 -13.067 1.00 0.00 C ATOM 0 H THR B 70 7.221 -0.547 -14.083 1.00 0.00 H new ATOM 0 HA THR B 70 9.289 0.225 -14.464 1.00 0.00 H new ATOM 0 HB THR B 70 9.170 1.489 -11.737 1.00 0.00 H new ATOM 0 HG1 THR B 70 8.579 3.429 -12.959 1.00 0.00 H new ATOM 0 HG21 THR B 70 10.824 3.100 -12.624 1.00 0.00 H new ATOM 0 HG22 THR B 70 11.432 1.428 -12.620 1.00 0.00 H new ATOM 0 HG23 THR B 70 10.885 2.172 -14.141 1.00 0.00 H new ATOM 2566 N LYS B 71 10.415 -0.480 -11.516 1.00 0.00 N ATOM 2567 CA LYS B 71 11.281 -1.373 -10.755 1.00 0.00 C ATOM 2568 C LYS B 71 11.798 -0.684 -9.498 1.00 0.00 C ATOM 2569 O LYS B 71 12.954 -0.860 -9.112 1.00 0.00 O ATOM 2570 CB LYS B 71 12.456 -1.838 -11.619 1.00 0.00 C ATOM 2571 CG LYS B 71 12.980 -3.214 -11.243 1.00 0.00 C ATOM 2572 CD LYS B 71 13.072 -4.128 -12.455 1.00 0.00 C ATOM 2573 CE LYS B 71 14.056 -3.594 -13.483 1.00 0.00 C ATOM 2574 NZ LYS B 71 14.536 -4.664 -14.401 1.00 0.00 N ATOM 0 H LYS B 71 10.206 0.403 -11.050 1.00 0.00 H new ATOM 0 HA LYS B 71 10.695 -2.242 -10.456 1.00 0.00 H new ATOM 0 HB2 LYS B 71 12.146 -1.850 -12.664 1.00 0.00 H new ATOM 0 HB3 LYS B 71 13.267 -1.114 -11.535 1.00 0.00 H new ATOM 0 HG2 LYS B 71 13.964 -3.116 -10.785 1.00 0.00 H new ATOM 0 HG3 LYS B 71 12.324 -3.663 -10.497 1.00 0.00 H new ATOM 0 HD2 LYS B 71 13.380 -5.124 -12.138 1.00 0.00 H new ATOM 0 HD3 LYS B 71 12.087 -4.229 -12.911 1.00 0.00 H new ATOM 0 HE2 LYS B 71 13.581 -2.804 -14.064 1.00 0.00 H new ATOM 0 HE3 LYS B 71 14.908 -3.146 -12.971 1.00 0.00 H new ATOM 0 HZ1 LYS B 71 15.205 -4.259 -15.087 1.00 0.00 H new ATOM 0 HZ2 LYS B 71 15.012 -5.406 -13.850 1.00 0.00 H new ATOM 0 HZ3 LYS B 71 13.727 -5.075 -14.908 1.00 0.00 H new ATOM 2588 N HIS B 72 10.935 0.100 -8.860 1.00 0.00 N ATOM 2589 CA HIS B 72 11.303 0.816 -7.645 1.00 0.00 C ATOM 2590 C HIS B 72 10.174 0.768 -6.620 1.00 0.00 C ATOM 2591 O HIS B 72 9.813 1.785 -6.028 1.00 0.00 O ATOM 2592 CB HIS B 72 11.654 2.269 -7.970 1.00 0.00 C ATOM 2593 CG HIS B 72 12.496 2.416 -9.199 1.00 0.00 C ATOM 2594 ND1 HIS B 72 13.783 2.909 -9.176 1.00 0.00 N ATOM 2595 CD2 HIS B 72 12.229 2.126 -10.495 1.00 0.00 C ATOM 2596 CE1 HIS B 72 14.273 2.916 -10.403 1.00 0.00 C ATOM 2597 NE2 HIS B 72 13.350 2.444 -11.222 1.00 0.00 N ATOM 0 H HIS B 72 9.974 0.255 -9.165 1.00 0.00 H new ATOM 0 HA HIS B 72 12.177 0.327 -7.216 1.00 0.00 H new ATOM 0 HB2 HIS B 72 10.733 2.837 -8.099 1.00 0.00 H new ATOM 0 HB3 HIS B 72 12.182 2.706 -7.122 1.00 0.00 H new ATOM 0 HD1 HIS B 72 14.280 3.220 -8.341 1.00 0.00 H new ATOM 0 HD2 HIS B 72 11.307 1.720 -10.884 1.00 0.00 H new ATOM 0 HE1 HIS B 72 15.260 3.250 -10.688 1.00 0.00 H new ATOM 2606 N PHE B 73 9.624 -0.423 -6.416 1.00 0.00 N ATOM 2607 CA PHE B 73 8.539 -0.614 -5.460 1.00 0.00 C ATOM 2608 C PHE B 73 8.945 -1.622 -4.389 1.00 0.00 C ATOM 2609 O PHE B 73 8.693 -2.818 -4.525 1.00 0.00 O ATOM 2610 CB PHE B 73 7.270 -1.083 -6.185 1.00 0.00 C ATOM 2611 CG PHE B 73 6.336 -1.896 -5.327 1.00 0.00 C ATOM 2612 CD1 PHE B 73 5.533 -1.284 -4.377 1.00 0.00 C ATOM 2613 CD2 PHE B 73 6.264 -3.272 -5.472 1.00 0.00 C ATOM 2614 CE1 PHE B 73 4.677 -2.030 -3.588 1.00 0.00 C ATOM 2615 CE2 PHE B 73 5.411 -4.023 -4.685 1.00 0.00 C ATOM 2616 CZ PHE B 73 4.616 -3.401 -3.743 1.00 0.00 C ATOM 0 H PHE B 73 9.912 -1.273 -6.901 1.00 0.00 H new ATOM 0 HA PHE B 73 8.330 0.339 -4.974 1.00 0.00 H new ATOM 0 HB2 PHE B 73 6.735 -0.210 -6.560 1.00 0.00 H new ATOM 0 HB3 PHE B 73 7.558 -1.677 -7.052 1.00 0.00 H new ATOM 0 HD1 PHE B 73 5.577 -0.212 -4.252 1.00 0.00 H new ATOM 0 HD2 PHE B 73 6.882 -3.764 -6.209 1.00 0.00 H new ATOM 0 HE1 PHE B 73 4.057 -1.541 -2.851 1.00 0.00 H new ATOM 0 HE2 PHE B 73 5.366 -5.095 -4.807 1.00 0.00 H new ATOM 0 HZ PHE B 73 3.948 -3.986 -3.128 1.00 0.00 H new ATOM 2626 N ILE B 74 9.578 -1.134 -3.328 1.00 0.00 N ATOM 2627 CA ILE B 74 10.018 -2.001 -2.246 1.00 0.00 C ATOM 2628 C ILE B 74 9.132 -1.856 -1.014 1.00 0.00 C ATOM 2629 O ILE B 74 8.657 -0.766 -0.699 1.00 0.00 O ATOM 2630 CB ILE B 74 11.476 -1.711 -1.842 1.00 0.00 C ATOM 2631 CG1 ILE B 74 12.035 -2.896 -1.036 1.00 0.00 C ATOM 2632 CG2 ILE B 74 11.552 -0.404 -1.054 1.00 0.00 C ATOM 2633 CD1 ILE B 74 13.234 -2.570 -0.169 1.00 0.00 C ATOM 0 H ILE B 74 9.796 -0.146 -3.196 1.00 0.00 H new ATOM 0 HA ILE B 74 9.945 -3.021 -2.625 1.00 0.00 H new ATOM 0 HB ILE B 74 12.089 -1.592 -2.735 1.00 0.00 H new ATOM 0 HG12 ILE B 74 11.242 -3.290 -0.400 1.00 0.00 H new ATOM 0 HG13 ILE B 74 12.312 -3.690 -1.730 1.00 0.00 H new ATOM 0 HG21 ILE B 74 12.587 -0.208 -0.773 1.00 0.00 H new ATOM 0 HG22 ILE B 74 11.182 0.415 -1.671 1.00 0.00 H new ATOM 0 HG23 ILE B 74 10.941 -0.485 -0.155 1.00 0.00 H new ATOM 0 HD11 ILE B 74 13.556 -3.467 0.360 1.00 0.00 H new ATOM 0 HD12 ILE B 74 14.048 -2.207 -0.796 1.00 0.00 H new ATOM 0 HD13 ILE B 74 12.962 -1.801 0.554 1.00 0.00 H new ATOM 2645 N TYR B 75 8.931 -2.965 -0.312 1.00 0.00 N ATOM 2646 CA TYR B 75 8.122 -2.970 0.897 1.00 0.00 C ATOM 2647 C TYR B 75 8.831 -3.744 2.001 1.00 0.00 C ATOM 2648 O TYR B 75 9.307 -4.857 1.783 1.00 0.00 O ATOM 2649 CB TYR B 75 6.744 -3.587 0.626 1.00 0.00 C ATOM 2650 CG TYR B 75 5.672 -3.208 1.636 1.00 0.00 C ATOM 2651 CD1 TYR B 75 5.960 -2.403 2.738 1.00 0.00 C ATOM 2652 CD2 TYR B 75 4.367 -3.661 1.485 1.00 0.00 C ATOM 2653 CE1 TYR B 75 4.980 -2.065 3.652 1.00 0.00 C ATOM 2654 CE2 TYR B 75 3.383 -3.326 2.396 1.00 0.00 C ATOM 2655 CZ TYR B 75 3.694 -2.528 3.477 1.00 0.00 C ATOM 2656 OH TYR B 75 2.716 -2.193 4.385 1.00 0.00 O ATOM 0 H TYR B 75 9.319 -3.874 -0.562 1.00 0.00 H new ATOM 0 HA TYR B 75 7.982 -1.938 1.219 1.00 0.00 H new ATOM 0 HB2 TYR B 75 6.413 -3.283 -0.367 1.00 0.00 H new ATOM 0 HB3 TYR B 75 6.843 -4.672 0.611 1.00 0.00 H new ATOM 0 HD1 TYR B 75 6.966 -2.037 2.880 1.00 0.00 H new ATOM 0 HD2 TYR B 75 4.117 -4.286 0.641 1.00 0.00 H new ATOM 0 HE1 TYR B 75 5.221 -1.441 4.500 1.00 0.00 H new ATOM 0 HE2 TYR B 75 2.374 -3.688 2.262 1.00 0.00 H new ATOM 0 HH TYR B 75 2.884 -1.291 4.729 1.00 0.00 H new ATOM 2666 N PHE B 76 8.907 -3.146 3.183 1.00 0.00 N ATOM 2667 CA PHE B 76 9.569 -3.783 4.314 1.00 0.00 C ATOM 2668 C PHE B 76 9.093 -3.194 5.636 1.00 0.00 C ATOM 2669 O PHE B 76 8.535 -2.098 5.677 1.00 0.00 O ATOM 2670 CB PHE B 76 11.087 -3.628 4.197 1.00 0.00 C ATOM 2671 CG PHE B 76 11.523 -2.250 3.781 1.00 0.00 C ATOM 2672 CD1 PHE B 76 11.598 -1.909 2.440 1.00 0.00 C ATOM 2673 CD2 PHE B 76 11.857 -1.299 4.731 1.00 0.00 C ATOM 2674 CE1 PHE B 76 11.998 -0.644 2.055 1.00 0.00 C ATOM 2675 CE2 PHE B 76 12.259 -0.032 4.352 1.00 0.00 C ATOM 2676 CZ PHE B 76 12.329 0.296 3.012 1.00 0.00 C ATOM 0 H PHE B 76 8.520 -2.224 3.383 1.00 0.00 H new ATOM 0 HA PHE B 76 9.311 -4.842 4.297 1.00 0.00 H new ATOM 0 HB2 PHE B 76 11.543 -3.870 5.157 1.00 0.00 H new ATOM 0 HB3 PHE B 76 11.463 -4.352 3.474 1.00 0.00 H new ATOM 0 HD1 PHE B 76 11.341 -2.640 1.688 1.00 0.00 H new ATOM 0 HD2 PHE B 76 11.803 -1.550 5.780 1.00 0.00 H new ATOM 0 HE1 PHE B 76 12.052 -0.390 1.007 1.00 0.00 H new ATOM 0 HE2 PHE B 76 12.518 0.700 5.102 1.00 0.00 H new ATOM 0 HZ PHE B 76 12.642 1.285 2.713 1.00 0.00 H new ATOM 2686 N TYR B 77 9.330 -3.930 6.715 1.00 0.00 N ATOM 2687 CA TYR B 77 8.939 -3.488 8.048 1.00 0.00 C ATOM 2688 C TYR B 77 10.156 -3.425 8.966 1.00 0.00 C ATOM 2689 O TYR B 77 10.729 -4.455 9.322 1.00 0.00 O ATOM 2690 CB TYR B 77 7.887 -4.432 8.634 1.00 0.00 C ATOM 2691 CG TYR B 77 7.603 -4.199 10.102 1.00 0.00 C ATOM 2692 CD1 TYR B 77 8.480 -4.651 11.080 1.00 0.00 C ATOM 2693 CD2 TYR B 77 6.456 -3.527 10.509 1.00 0.00 C ATOM 2694 CE1 TYR B 77 8.222 -4.442 12.422 1.00 0.00 C ATOM 2695 CE2 TYR B 77 6.192 -3.314 11.848 1.00 0.00 C ATOM 2696 CZ TYR B 77 7.077 -3.772 12.801 1.00 0.00 C ATOM 2697 OH TYR B 77 6.816 -3.562 14.135 1.00 0.00 O ATOM 0 H TYR B 77 9.793 -4.839 6.693 1.00 0.00 H new ATOM 0 HA TYR B 77 8.509 -2.490 7.968 1.00 0.00 H new ATOM 0 HB2 TYR B 77 6.960 -4.320 8.072 1.00 0.00 H new ATOM 0 HB3 TYR B 77 8.220 -5.461 8.497 1.00 0.00 H new ATOM 0 HD1 TYR B 77 9.378 -5.174 10.787 1.00 0.00 H new ATOM 0 HD2 TYR B 77 5.760 -3.166 9.766 1.00 0.00 H new ATOM 0 HE1 TYR B 77 8.913 -4.801 13.170 1.00 0.00 H new ATOM 0 HE2 TYR B 77 5.296 -2.791 12.147 1.00 0.00 H new ATOM 0 HH TYR B 77 5.971 -3.075 14.230 1.00 0.00 H new ATOM 2707 N LEU B 78 10.549 -2.212 9.342 1.00 0.00 N ATOM 2708 CA LEU B 78 11.704 -2.022 10.212 1.00 0.00 C ATOM 2709 C LEU B 78 11.407 -2.523 11.623 1.00 0.00 C ATOM 2710 O LEU B 78 10.263 -2.843 11.946 1.00 0.00 O ATOM 2711 CB LEU B 78 12.106 -0.545 10.255 1.00 0.00 C ATOM 2712 CG LEU B 78 12.757 -0.002 8.978 1.00 0.00 C ATOM 2713 CD1 LEU B 78 14.189 -0.498 8.854 1.00 0.00 C ATOM 2714 CD2 LEU B 78 11.948 -0.396 7.751 1.00 0.00 C ATOM 0 H LEU B 78 10.086 -1.348 9.059 1.00 0.00 H new ATOM 0 HA LEU B 78 12.533 -2.601 9.805 1.00 0.00 H new ATOM 0 HB2 LEU B 78 11.218 0.049 10.471 1.00 0.00 H new ATOM 0 HB3 LEU B 78 12.797 -0.398 11.085 1.00 0.00 H new ATOM 0 HG LEU B 78 12.774 1.086 9.041 1.00 0.00 H new ATOM 0 HD11 LEU B 78 14.634 -0.102 7.941 1.00 0.00 H new ATOM 0 HD12 LEU B 78 14.767 -0.161 9.715 1.00 0.00 H new ATOM 0 HD13 LEU B 78 14.195 -1.587 8.817 1.00 0.00 H new ATOM 0 HD21 LEU B 78 12.428 -0.000 6.856 1.00 0.00 H new ATOM 0 HD22 LEU B 78 11.895 -1.483 7.684 1.00 0.00 H new ATOM 0 HD23 LEU B 78 10.941 0.012 7.833 1.00 0.00 H new ATOM 2726 N GLY B 79 12.447 -2.594 12.452 1.00 0.00 N ATOM 2727 CA GLY B 79 12.294 -3.061 13.822 1.00 0.00 C ATOM 2728 C GLY B 79 10.882 -2.904 14.351 1.00 0.00 C ATOM 2729 O GLY B 79 10.335 -3.823 14.960 1.00 0.00 O ATOM 0 H GLY B 79 13.400 -2.334 12.197 1.00 0.00 H new ATOM 0 HA2 GLY B 79 12.581 -4.111 13.875 1.00 0.00 H new ATOM 0 HA3 GLY B 79 12.980 -2.510 14.466 1.00 0.00 H new ATOM 2733 N GLN B 80 10.289 -1.738 14.120 1.00 0.00 N ATOM 2734 CA GLN B 80 8.932 -1.469 14.581 1.00 0.00 C ATOM 2735 C GLN B 80 8.235 -0.464 13.668 1.00 0.00 C ATOM 2736 O GLN B 80 7.468 0.381 14.131 1.00 0.00 O ATOM 2737 CB GLN B 80 8.953 -0.944 16.018 1.00 0.00 C ATOM 2738 CG GLN B 80 7.570 -0.795 16.629 1.00 0.00 C ATOM 2739 CD GLN B 80 7.616 -0.426 18.100 1.00 0.00 C ATOM 2740 OE1 GLN B 80 6.966 0.525 18.533 1.00 0.00 O ATOM 2741 NE2 GLN B 80 8.385 -1.180 18.877 1.00 0.00 N ATOM 0 H GLN B 80 10.726 -0.965 13.617 1.00 0.00 H new ATOM 0 HA GLN B 80 8.374 -2.405 14.553 1.00 0.00 H new ATOM 0 HB2 GLN B 80 9.543 -1.621 16.635 1.00 0.00 H new ATOM 0 HB3 GLN B 80 9.456 0.023 16.036 1.00 0.00 H new ATOM 0 HG2 GLN B 80 7.017 -0.030 16.084 1.00 0.00 H new ATOM 0 HG3 GLN B 80 7.022 -1.730 16.510 1.00 0.00 H new ATOM 0 HE21 GLN B 80 8.907 -1.959 18.476 1.00 0.00 H new ATOM 0 HE22 GLN B 80 8.454 -0.980 19.875 1.00 0.00 H new ATOM 2750 N VAL B 81 8.508 -0.560 12.372 1.00 0.00 N ATOM 2751 CA VAL B 81 7.909 0.342 11.395 1.00 0.00 C ATOM 2752 C VAL B 81 7.795 -0.324 10.027 1.00 0.00 C ATOM 2753 O VAL B 81 8.340 -1.404 9.804 1.00 0.00 O ATOM 2754 CB VAL B 81 8.726 1.639 11.259 1.00 0.00 C ATOM 2755 CG1 VAL B 81 8.124 2.547 10.195 1.00 0.00 C ATOM 2756 CG2 VAL B 81 8.810 2.357 12.596 1.00 0.00 C ATOM 0 H VAL B 81 9.141 -1.254 11.973 1.00 0.00 H new ATOM 0 HA VAL B 81 6.911 0.586 11.758 1.00 0.00 H new ATOM 0 HB VAL B 81 9.737 1.377 10.946 1.00 0.00 H new ATOM 0 HG11 VAL B 81 8.717 3.458 10.116 1.00 0.00 H new ATOM 0 HG12 VAL B 81 8.122 2.031 9.235 1.00 0.00 H new ATOM 0 HG13 VAL B 81 7.101 2.803 10.472 1.00 0.00 H new ATOM 0 HG21 VAL B 81 9.391 3.272 12.482 1.00 0.00 H new ATOM 0 HG22 VAL B 81 7.806 2.605 12.939 1.00 0.00 H new ATOM 0 HG23 VAL B 81 9.293 1.709 13.327 1.00 0.00 H new ATOM 2766 N ALA B 82 7.083 0.329 9.115 1.00 0.00 N ATOM 2767 CA ALA B 82 6.897 -0.199 7.768 1.00 0.00 C ATOM 2768 C ALA B 82 7.131 0.884 6.719 1.00 0.00 C ATOM 2769 O ALA B 82 6.894 2.065 6.969 1.00 0.00 O ATOM 2770 CB ALA B 82 5.501 -0.784 7.623 1.00 0.00 C ATOM 0 H ALA B 82 6.625 1.225 9.284 1.00 0.00 H new ATOM 0 HA ALA B 82 7.630 -0.989 7.606 1.00 0.00 H new ATOM 0 HB1 ALA B 82 5.373 -1.175 6.614 1.00 0.00 H new ATOM 0 HB2 ALA B 82 5.368 -1.590 8.344 1.00 0.00 H new ATOM 0 HB3 ALA B 82 4.760 -0.006 7.807 1.00 0.00 H new ATOM 2776 N ILE B 83 7.598 0.474 5.544 1.00 0.00 N ATOM 2777 CA ILE B 83 7.863 1.416 4.460 1.00 0.00 C ATOM 2778 C ILE B 83 7.437 0.840 3.112 1.00 0.00 C ATOM 2779 O ILE B 83 7.771 -0.297 2.778 1.00 0.00 O ATOM 2780 CB ILE B 83 9.356 1.800 4.391 1.00 0.00 C ATOM 2781 CG1 ILE B 83 10.070 1.436 5.697 1.00 0.00 C ATOM 2782 CG2 ILE B 83 9.507 3.284 4.090 1.00 0.00 C ATOM 2783 CD1 ILE B 83 9.697 2.327 6.865 1.00 0.00 C ATOM 0 H ILE B 83 7.800 -0.500 5.318 1.00 0.00 H new ATOM 0 HA ILE B 83 7.277 2.310 4.674 1.00 0.00 H new ATOM 0 HB ILE B 83 9.821 1.235 3.583 1.00 0.00 H new ATOM 0 HG12 ILE B 83 9.837 0.402 5.952 1.00 0.00 H new ATOM 0 HG13 ILE B 83 11.147 1.491 5.539 1.00 0.00 H new ATOM 0 HG21 ILE B 83 10.565 3.540 4.044 1.00 0.00 H new ATOM 0 HG22 ILE B 83 9.037 3.511 3.133 1.00 0.00 H new ATOM 0 HG23 ILE B 83 9.027 3.866 4.877 1.00 0.00 H new ATOM 0 HD11 ILE B 83 10.242 2.009 7.754 1.00 0.00 H new ATOM 0 HD12 ILE B 83 9.955 3.360 6.632 1.00 0.00 H new ATOM 0 HD13 ILE B 83 8.625 2.254 7.051 1.00 0.00 H new ATOM 2795 N LEU B 84 6.699 1.635 2.342 1.00 0.00 N ATOM 2796 CA LEU B 84 6.227 1.210 1.028 1.00 0.00 C ATOM 2797 C LEU B 84 6.731 2.158 -0.059 1.00 0.00 C ATOM 2798 O LEU B 84 6.063 3.132 -0.403 1.00 0.00 O ATOM 2799 CB LEU B 84 4.697 1.152 1.010 1.00 0.00 C ATOM 2800 CG LEU B 84 4.052 1.284 -0.372 1.00 0.00 C ATOM 2801 CD1 LEU B 84 3.970 -0.073 -1.053 1.00 0.00 C ATOM 2802 CD2 LEU B 84 2.669 1.908 -0.256 1.00 0.00 C ATOM 0 H LEU B 84 6.415 2.578 2.606 1.00 0.00 H new ATOM 0 HA LEU B 84 6.621 0.214 0.826 1.00 0.00 H new ATOM 0 HB2 LEU B 84 4.381 0.207 1.451 1.00 0.00 H new ATOM 0 HB3 LEU B 84 4.312 1.947 1.649 1.00 0.00 H new ATOM 0 HG LEU B 84 4.675 1.938 -0.983 1.00 0.00 H new ATOM 0 HD11 LEU B 84 3.509 0.040 -2.034 1.00 0.00 H new ATOM 0 HD12 LEU B 84 4.973 -0.483 -1.168 1.00 0.00 H new ATOM 0 HD13 LEU B 84 3.369 -0.749 -0.445 1.00 0.00 H new ATOM 0 HD21 LEU B 84 2.225 1.995 -1.248 1.00 0.00 H new ATOM 0 HD22 LEU B 84 2.037 1.279 0.371 1.00 0.00 H new ATOM 0 HD23 LEU B 84 2.753 2.898 0.192 1.00 0.00 H new ATOM 2814 N LEU B 85 7.915 1.867 -0.590 1.00 0.00 N ATOM 2815 CA LEU B 85 8.513 2.695 -1.631 1.00 0.00 C ATOM 2816 C LEU B 85 8.156 2.174 -3.018 1.00 0.00 C ATOM 2817 O LEU B 85 8.401 1.011 -3.336 1.00 0.00 O ATOM 2818 CB LEU B 85 10.034 2.734 -1.470 1.00 0.00 C ATOM 2819 CG LEU B 85 10.609 4.097 -1.086 1.00 0.00 C ATOM 2820 CD1 LEU B 85 10.198 4.464 0.330 1.00 0.00 C ATOM 2821 CD2 LEU B 85 12.125 4.091 -1.220 1.00 0.00 C ATOM 0 H LEU B 85 8.479 1.063 -0.316 1.00 0.00 H new ATOM 0 HA LEU B 85 8.114 3.704 -1.527 1.00 0.00 H new ATOM 0 HB2 LEU B 85 10.322 2.008 -0.710 1.00 0.00 H new ATOM 0 HB3 LEU B 85 10.492 2.414 -2.406 1.00 0.00 H new ATOM 0 HG LEU B 85 10.208 4.848 -1.766 1.00 0.00 H new ATOM 0 HD11 LEU B 85 10.615 5.437 0.589 1.00 0.00 H new ATOM 0 HD12 LEU B 85 9.111 4.506 0.394 1.00 0.00 H new ATOM 0 HD13 LEU B 85 10.573 3.712 1.024 1.00 0.00 H new ATOM 0 HD21 LEU B 85 12.519 5.069 -0.943 1.00 0.00 H new ATOM 0 HD22 LEU B 85 12.545 3.331 -0.562 1.00 0.00 H new ATOM 0 HD23 LEU B 85 12.398 3.869 -2.252 1.00 0.00 H new ATOM 2833 N PHE B 86 7.576 3.041 -3.841 1.00 0.00 N ATOM 2834 CA PHE B 86 7.187 2.661 -5.198 1.00 0.00 C ATOM 2835 C PHE B 86 6.945 3.889 -6.071 1.00 0.00 C ATOM 2836 O PHE B 86 6.253 4.824 -5.669 1.00 0.00 O ATOM 2837 CB PHE B 86 5.930 1.791 -5.163 1.00 0.00 C ATOM 2838 CG PHE B 86 4.659 2.577 -4.998 1.00 0.00 C ATOM 2839 CD1 PHE B 86 4.008 3.109 -6.100 1.00 0.00 C ATOM 2840 CD2 PHE B 86 4.118 2.784 -3.740 1.00 0.00 C ATOM 2841 CE1 PHE B 86 2.841 3.832 -5.949 1.00 0.00 C ATOM 2842 CE2 PHE B 86 2.951 3.506 -3.583 1.00 0.00 C ATOM 2843 CZ PHE B 86 2.311 4.031 -4.689 1.00 0.00 C ATOM 0 H PHE B 86 7.365 4.008 -3.595 1.00 0.00 H new ATOM 0 HA PHE B 86 8.008 2.091 -5.634 1.00 0.00 H new ATOM 0 HB2 PHE B 86 5.873 1.213 -6.085 1.00 0.00 H new ATOM 0 HB3 PHE B 86 6.015 1.077 -4.344 1.00 0.00 H new ATOM 0 HD1 PHE B 86 4.418 2.956 -7.088 1.00 0.00 H new ATOM 0 HD2 PHE B 86 4.614 2.376 -2.872 1.00 0.00 H new ATOM 0 HE1 PHE B 86 2.343 4.242 -6.815 1.00 0.00 H new ATOM 0 HE2 PHE B 86 2.539 3.660 -2.597 1.00 0.00 H new ATOM 0 HZ PHE B 86 1.398 4.596 -4.569 1.00 0.00 H new ATOM 2853 N LYS B 87 7.513 3.874 -7.275 1.00 0.00 N ATOM 2854 CA LYS B 87 7.353 4.980 -8.212 1.00 0.00 C ATOM 2855 C LYS B 87 6.190 4.715 -9.157 1.00 0.00 C ATOM 2856 O LYS B 87 5.864 3.566 -9.451 1.00 0.00 O ATOM 2857 CB LYS B 87 8.634 5.185 -9.020 1.00 0.00 C ATOM 2858 CG LYS B 87 9.837 5.557 -8.173 1.00 0.00 C ATOM 2859 CD LYS B 87 11.134 5.118 -8.832 1.00 0.00 C ATOM 2860 CE LYS B 87 11.385 5.873 -10.127 1.00 0.00 C ATOM 2861 NZ LYS B 87 11.587 4.950 -11.278 1.00 0.00 N ATOM 0 H LYS B 87 8.088 3.107 -7.623 1.00 0.00 H new ATOM 0 HA LYS B 87 7.145 5.883 -7.638 1.00 0.00 H new ATOM 0 HB2 LYS B 87 8.857 4.270 -9.570 1.00 0.00 H new ATOM 0 HB3 LYS B 87 8.465 5.968 -9.759 1.00 0.00 H new ATOM 0 HG2 LYS B 87 9.854 6.635 -8.015 1.00 0.00 H new ATOM 0 HG3 LYS B 87 9.750 5.092 -7.191 1.00 0.00 H new ATOM 0 HD2 LYS B 87 11.965 5.283 -8.147 1.00 0.00 H new ATOM 0 HD3 LYS B 87 11.096 4.048 -9.035 1.00 0.00 H new ATOM 0 HE2 LYS B 87 10.541 6.531 -10.333 1.00 0.00 H new ATOM 0 HE3 LYS B 87 12.263 6.508 -10.012 1.00 0.00 H new ATOM 0 HZ1 LYS B 87 11.468 5.474 -12.168 1.00 0.00 H new ATOM 0 HZ2 LYS B 87 12.546 4.549 -11.238 1.00 0.00 H new ATOM 0 HZ3 LYS B 87 10.888 4.181 -11.233 1.00 0.00 H new ATOM 2875 N SER B 88 5.573 5.786 -9.636 1.00 0.00 N ATOM 2876 CA SER B 88 4.452 5.673 -10.557 1.00 0.00 C ATOM 2877 C SER B 88 4.832 6.235 -11.916 1.00 0.00 C ATOM 2878 O SER B 88 3.974 6.578 -12.729 1.00 0.00 O ATOM 2879 CB SER B 88 3.235 6.408 -10.009 1.00 0.00 C ATOM 2880 OG SER B 88 2.065 5.618 -10.128 1.00 0.00 O ATOM 0 H SER B 88 5.831 6.745 -9.401 1.00 0.00 H new ATOM 0 HA SER B 88 4.200 4.618 -10.668 1.00 0.00 H new ATOM 0 HB2 SER B 88 3.401 6.662 -8.962 1.00 0.00 H new ATOM 0 HB3 SER B 88 3.100 7.346 -10.547 1.00 0.00 H new ATOM 0 HG SER B 88 1.321 6.065 -9.673 1.00 0.00 H new ATOM 2886 N GLY B 89 6.130 6.324 -12.142 1.00 0.00 N ATOM 2887 CA GLY B 89 6.637 6.846 -13.398 1.00 0.00 C ATOM 2888 C GLY B 89 7.026 8.309 -13.302 1.00 0.00 C ATOM 2889 O GLY B 89 7.813 8.656 -12.397 1.00 0.00 O ATOM 2890 OXT GLY B 89 6.543 9.107 -14.133 1.00 0.00 O ATOM 0 H GLY B 89 6.849 6.043 -11.476 1.00 0.00 H new ATOM 0 HA2 GLY B 89 7.504 6.262 -13.707 1.00 0.00 H new ATOM 0 HA3 GLY B 89 5.878 6.725 -14.171 1.00 0.00 H new TER 2894 GLY B 89