USER MOD reduce.3.24.130724 H: found=0, std=0, add=1738, rem=0, adj=66 USER MOD reduce.3.24.130724 removed 1734 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 44 THR OG1 : rot 135:sc= -0.253 USER MOD Set 1.2: B 68 CYS SG : rot 116:sc= 0.569 USER MOD Set 1.3: B 107 CYS SG : rot 95:sc= 0.971 USER MOD Set 2.1: B 35 TYR OH : rot 180:sc=-0.000735 USER MOD Set 2.2: B 103 MET CE :methyl -119:sc= -2.12 (180deg=-6.18!) USER MOD Set 3.1: B 101 LYS NZ :NH3+ -178:sc= 0 (180deg=0) USER MOD Set 3.2: B 102 SER OG : rot -179:sc= -1.5 USER MOD Set 4.1: A 101 LYS NZ :NH3+ -123:sc=-0.00425 (180deg=0) USER MOD Set 4.2: A 102 SER OG : rot 180:sc= -1.49 USER MOD Set 5.1: A 44 THR OG1 : rot 135:sc= -0.108 USER MOD Set 5.2: A 68 CYS SG : rot 125:sc= 0.618 USER MOD Set 5.3: A 107 CYS SG : rot 82:sc= 0.858 USER MOD Set 6.1: A 35 TYR OH : rot 180:sc=-0.000476 USER MOD Set 6.2: A 103 MET CE :methyl -117:sc= -2.13 (180deg=-6.17!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 165:sc= 1.29 (180deg=0.706) USER MOD Single : A 19 SER OG : rot -49:sc= -0.519 USER MOD Single : A 20 ASN : amide:sc= -3.38 K(o=-3.4,f=-4.8!) USER MOD Single : A 23 LYS NZ :NH3+ -163:sc= -2.61 (180deg=-2.78) USER MOD Single : A 25 SER OG : rot -173:sc= 0.24 USER MOD Single : A 31 GLN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 32 ASN : amide:sc= -1.63 K(o=-1.6,f=-3.3) USER MOD Single : A 33 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 SER OG : rot -140:sc= -0.185 USER MOD Single : A 42 GLN : amide:sc= -1.87! K(o=-1.9!,f=-0.67) USER MOD Single : A 45 SER OG : rot -72:sc= 1.01 USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 47 CYS SG : rot -160:sc= -4.13! USER MOD Single : A 50 HIS : no HD1:sc= -1.47 K(o=-1.5,f=-0.17) USER MOD Single : A 51 CYS SG : rot -110:sc= -1.06 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 THR OG1 : rot -41:sc= 1.12 USER MOD Single : A 59 ASN : amide:sc= -4.64 K(o=-4.6,f=-3.9!) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 LYS NZ :NH3+ -171:sc= 0.567 (180deg=0.525) USER MOD Single : A 64 TYR OH : rot -69:sc= -2.63! USER MOD Single : A 67 THR OG1 : rot 48:sc= 0.576 USER MOD Single : A 71 MET CE :methyl 179:sc= -0.397 (180deg=-0.403) USER MOD Single : A 72 GLN : amide:sc= 0.022 K(o=0.022,f=-0.58) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 ASN : amide:sc= -2.64 K(o=-2.6,f=-6.4!) USER MOD Single : A 79 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 84 CYS SG : rot 180:sc= -0.353 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 89 THR OG1 : rot 55:sc= -0.215 USER MOD Single : A 90 THR OG1 : rot -132:sc= 0.0197 USER MOD Single : A 93 SER OG : rot 63:sc= 1.15 USER MOD Single : A 95 THR OG1 : rot 150:sc= -1.58 USER MOD Single : A 100 ASN : amide:sc= -1.12 K(o=-1.1,f=-8!) USER MOD Single : A 104 TYR OH : rot 180:sc= 0 USER MOD Single : A 105 CYS SG : rot 5:sc= 0.194 USER MOD Single : A 108 THR OG1 : rot 180:sc= -0.601 USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 172:sc= 1.32 (180deg=0.788) USER MOD Single : B 19 SER OG : rot -46:sc= -0.515 USER MOD Single : B 20 ASN : amide:sc= -3.45 K(o=-3.4,f=-4.8!) USER MOD Single : B 23 LYS NZ :NH3+ -164:sc= -2.59 (180deg=-2.74) USER MOD Single : B 25 SER OG : rot -173:sc= 0.401 USER MOD Single : B 31 GLN : amide:sc= 0 X(o=0,f=-0.43) USER MOD Single : B 32 ASN : amide:sc= -1.77 K(o=-1.8,f=-3.1) USER MOD Single : B 33 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 34 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 36 SER OG : rot 180:sc= 0 USER MOD Single : B 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 41 SER OG : rot -140:sc= -0.195 USER MOD Single : B 42 GLN : amide:sc= -1.9! K(o=-1.9!,f=-0.73) USER MOD Single : B 45 SER OG : rot -77:sc= 0.913 USER MOD Single : B 46 SER OG : rot 180:sc= 0 USER MOD Single : B 47 CYS SG : rot -150:sc= -4.13 USER MOD Single : B 50 HIS : no HD1:sc= -1.51 K(o=-1.5,f=-0.19) USER MOD Single : B 51 CYS SG : rot -110:sc= -1.06 USER MOD Single : B 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 56 THR OG1 : rot -53:sc= 1.2 USER MOD Single : B 59 ASN : amide:sc= -4.67 K(o=-4.7,f=-3.9!) USER MOD Single : B 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 63 LYS NZ :NH3+ -173:sc= 0.597 (180deg=0.535) USER MOD Single : B 64 TYR OH : rot -81:sc= -2.3! USER MOD Single : B 67 THR OG1 : rot 48:sc= 0.493 USER MOD Single : B 71 MET CE :methyl 179:sc= -0.399 (180deg=-0.407) USER MOD Single : B 72 GLN : amide:sc= 0.0225 K(o=0.023,f=-0.57) USER MOD Single : B 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 74 ASN : amide:sc= -2.68 K(o=-2.7,f=-6.3!) USER MOD Single : B 79 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 80 THR OG1 : rot 180:sc= 0 USER MOD Single : B 83 SER OG : rot 180:sc= 0 USER MOD Single : B 84 CYS SG : rot 180:sc= -0.349 USER MOD Single : B 88 SER OG : rot 180:sc= 0 USER MOD Single : B 89 THR OG1 : rot 51:sc= -0.235 USER MOD Single : B 90 THR OG1 : rot -133:sc= 0.0549 USER MOD Single : B 93 SER OG : rot 57:sc= 1.22 USER MOD Single : B 95 THR OG1 : rot 150:sc= -1.58 USER MOD Single : B 100 ASN : amide:sc= -1.07 K(o=-1.1,f=-7.9!) USER MOD Single : B 104 TYR OH : rot 180:sc= 0 USER MOD Single : B 105 CYS SG : rot -1:sc= 0.157 USER MOD Single : B 108 THR OG1 : rot 180:sc= -0.604 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 29.911 0.808 -16.103 1.00 0.00 N ATOM 2 CA MET A 1 29.752 0.843 -14.625 1.00 0.00 C ATOM 3 C MET A 1 28.360 0.378 -14.209 1.00 0.00 C ATOM 4 O MET A 1 27.831 0.816 -13.188 1.00 0.00 O ATOM 5 CB MET A 1 29.995 2.274 -14.144 1.00 0.00 C ATOM 6 CG MET A 1 31.456 2.692 -14.191 1.00 0.00 C ATOM 7 SD MET A 1 32.053 2.941 -15.874 1.00 0.00 S ATOM 8 CE MET A 1 32.255 4.720 -15.903 1.00 0.00 C ATOM 0 H1 MET A 1 30.751 1.357 -16.375 1.00 0.00 H new ATOM 0 H2 MET A 1 30.024 -0.177 -16.417 1.00 0.00 H new ATOM 0 H3 MET A 1 29.068 1.220 -16.553 1.00 0.00 H new ATOM 0 HA MET A 1 30.474 0.165 -14.171 1.00 0.00 H new ATOM 0 HB2 MET A 1 29.410 2.959 -14.758 1.00 0.00 H new ATOM 0 HB3 MET A 1 29.631 2.372 -13.121 1.00 0.00 H new ATOM 0 HG2 MET A 1 31.585 3.614 -13.624 1.00 0.00 H new ATOM 0 HG3 MET A 1 32.064 1.930 -13.703 1.00 0.00 H new ATOM 0 HE1 MET A 1 32.620 5.029 -16.882 1.00 0.00 H new ATOM 0 HE2 MET A 1 31.296 5.198 -15.706 1.00 0.00 H new ATOM 0 HE3 MET A 1 32.972 5.017 -15.138 1.00 0.00 H new ATOM 18 N GLU A 2 27.774 -0.512 -15.008 1.00 0.00 N ATOM 19 CA GLU A 2 26.439 -1.043 -14.731 1.00 0.00 C ATOM 20 C GLU A 2 25.379 0.046 -14.877 1.00 0.00 C ATOM 21 O GLU A 2 24.586 0.031 -15.819 1.00 0.00 O ATOM 22 CB GLU A 2 26.378 -1.656 -13.328 1.00 0.00 C ATOM 23 CG GLU A 2 25.577 -2.945 -13.263 1.00 0.00 C ATOM 24 CD GLU A 2 25.035 -3.226 -11.875 1.00 0.00 C ATOM 25 OE1 GLU A 2 24.172 -2.455 -11.407 1.00 0.00 O ATOM 26 OE2 GLU A 2 25.473 -4.219 -11.256 1.00 0.00 O ATOM 0 H GLU A 2 28.204 -0.882 -15.856 1.00 0.00 H new ATOM 0 HA GLU A 2 26.233 -1.826 -15.461 1.00 0.00 H new ATOM 0 HB2 GLU A 2 27.393 -1.851 -12.981 1.00 0.00 H new ATOM 0 HB3 GLU A 2 25.940 -0.931 -12.642 1.00 0.00 H new ATOM 0 HG2 GLU A 2 24.748 -2.889 -13.968 1.00 0.00 H new ATOM 0 HG3 GLU A 2 26.208 -3.776 -13.578 1.00 0.00 H new ATOM 33 N GLY A 3 25.372 0.992 -13.943 1.00 0.00 N ATOM 34 CA GLY A 3 24.405 2.073 -13.993 1.00 0.00 C ATOM 35 C GLY A 3 24.379 2.897 -12.719 1.00 0.00 C ATOM 36 O GLY A 3 23.313 3.312 -12.266 1.00 0.00 O ATOM 0 H GLY A 3 26.017 1.029 -13.154 1.00 0.00 H new ATOM 0 HA2 GLY A 3 24.637 2.723 -14.836 1.00 0.00 H new ATOM 0 HA3 GLY A 3 23.413 1.659 -14.173 1.00 0.00 H new ATOM 40 N VAL A 4 25.554 3.139 -12.142 1.00 0.00 N ATOM 41 CA VAL A 4 25.656 3.921 -10.915 1.00 0.00 C ATOM 42 C VAL A 4 25.762 5.410 -11.229 1.00 0.00 C ATOM 43 O VAL A 4 26.779 5.874 -11.744 1.00 0.00 O ATOM 44 CB VAL A 4 26.874 3.495 -10.074 1.00 0.00 C ATOM 45 CG1 VAL A 4 26.843 4.165 -8.708 1.00 0.00 C ATOM 46 CG2 VAL A 4 26.924 1.980 -9.935 1.00 0.00 C ATOM 0 H VAL A 4 26.447 2.805 -12.505 1.00 0.00 H new ATOM 0 HA VAL A 4 24.749 3.734 -10.340 1.00 0.00 H new ATOM 0 HB VAL A 4 27.779 3.819 -10.589 1.00 0.00 H new ATOM 0 HG11 VAL A 4 27.712 3.851 -8.129 1.00 0.00 H new ATOM 0 HG12 VAL A 4 26.862 5.248 -8.833 1.00 0.00 H new ATOM 0 HG13 VAL A 4 25.933 3.877 -8.182 1.00 0.00 H new ATOM 0 HG21 VAL A 4 27.791 1.698 -9.338 1.00 0.00 H new ATOM 0 HG22 VAL A 4 26.016 1.629 -9.444 1.00 0.00 H new ATOM 0 HG23 VAL A 4 27.001 1.526 -10.923 1.00 0.00 H new ATOM 56 N ASP A 5 24.702 6.154 -10.925 1.00 0.00 N ATOM 57 CA ASP A 5 24.682 7.589 -11.186 1.00 0.00 C ATOM 58 C ASP A 5 24.012 8.357 -10.042 1.00 0.00 C ATOM 59 O ASP A 5 22.785 8.392 -9.956 1.00 0.00 O ATOM 60 CB ASP A 5 23.949 7.872 -12.498 1.00 0.00 C ATOM 61 CG ASP A 5 24.594 8.993 -13.291 1.00 0.00 C ATOM 62 OD1 ASP A 5 25.497 8.702 -14.103 1.00 0.00 O ATOM 63 OD2 ASP A 5 24.194 10.161 -13.100 1.00 0.00 O ATOM 0 H ASP A 5 23.850 5.789 -10.500 1.00 0.00 H new ATOM 0 HA ASP A 5 25.715 7.929 -11.263 1.00 0.00 H new ATOM 0 HB2 ASP A 5 23.931 6.966 -13.104 1.00 0.00 H new ATOM 0 HB3 ASP A 5 22.913 8.132 -12.283 1.00 0.00 H new ATOM 68 N PRO A 6 24.800 8.992 -9.148 1.00 0.00 N ATOM 69 CA PRO A 6 24.249 9.759 -8.025 1.00 0.00 C ATOM 70 C PRO A 6 23.467 10.978 -8.506 1.00 0.00 C ATOM 71 O PRO A 6 24.030 11.884 -9.119 1.00 0.00 O ATOM 72 CB PRO A 6 25.489 10.198 -7.230 1.00 0.00 C ATOM 73 CG PRO A 6 26.599 9.335 -7.726 1.00 0.00 C ATOM 74 CD PRO A 6 26.271 9.022 -9.154 1.00 0.00 C ATOM 0 HA PRO A 6 23.547 9.170 -7.435 1.00 0.00 H new ATOM 0 HB2 PRO A 6 25.708 11.253 -7.393 1.00 0.00 H new ATOM 0 HB3 PRO A 6 25.337 10.066 -6.159 1.00 0.00 H new ATOM 0 HG2 PRO A 6 27.557 9.849 -7.649 1.00 0.00 H new ATOM 0 HG3 PRO A 6 26.678 8.423 -7.135 1.00 0.00 H new ATOM 0 HD2 PRO A 6 26.658 9.781 -9.834 1.00 0.00 H new ATOM 0 HD3 PRO A 6 26.694 8.068 -9.467 1.00 0.00 H new ATOM 82 N ALA A 7 22.166 10.990 -8.235 1.00 0.00 N ATOM 83 CA ALA A 7 21.311 12.096 -8.654 1.00 0.00 C ATOM 84 C ALA A 7 21.317 12.231 -10.168 1.00 0.00 C ATOM 85 O ALA A 7 22.139 12.952 -10.734 1.00 0.00 O ATOM 86 CB ALA A 7 21.763 13.398 -8.018 1.00 0.00 C ATOM 0 H ALA A 7 21.681 10.249 -7.729 1.00 0.00 H new ATOM 0 HA ALA A 7 20.295 11.880 -8.322 1.00 0.00 H new ATOM 0 HB1 ALA A 7 21.111 14.208 -8.345 1.00 0.00 H new ATOM 0 HB2 ALA A 7 21.715 13.309 -6.933 1.00 0.00 H new ATOM 0 HB3 ALA A 7 22.788 13.613 -8.319 1.00 0.00 H new ATOM 92 N VAL A 8 20.404 11.530 -10.821 1.00 0.00 N ATOM 93 CA VAL A 8 20.315 11.568 -12.276 1.00 0.00 C ATOM 94 C VAL A 8 19.116 12.379 -12.721 1.00 0.00 C ATOM 95 O VAL A 8 19.241 13.405 -13.390 1.00 0.00 O ATOM 96 CB VAL A 8 20.170 10.156 -12.919 1.00 0.00 C ATOM 97 CG1 VAL A 8 21.003 10.066 -14.179 1.00 0.00 C ATOM 98 CG2 VAL A 8 20.528 9.037 -11.954 1.00 0.00 C ATOM 0 H VAL A 8 19.715 10.929 -10.370 1.00 0.00 H new ATOM 0 HA VAL A 8 21.251 12.019 -12.607 1.00 0.00 H new ATOM 0 HB VAL A 8 19.119 10.024 -13.176 1.00 0.00 H new ATOM 0 HG11 VAL A 8 20.893 9.074 -14.618 1.00 0.00 H new ATOM 0 HG12 VAL A 8 20.666 10.818 -14.892 1.00 0.00 H new ATOM 0 HG13 VAL A 8 22.051 10.240 -13.936 1.00 0.00 H new ATOM 0 HG21 VAL A 8 20.410 8.075 -12.453 1.00 0.00 H new ATOM 0 HG22 VAL A 8 21.562 9.153 -11.630 1.00 0.00 H new ATOM 0 HG23 VAL A 8 19.869 9.080 -11.087 1.00 0.00 H new ATOM 108 N GLU A 9 17.951 11.868 -12.369 1.00 0.00 N ATOM 109 CA GLU A 9 16.696 12.479 -12.745 1.00 0.00 C ATOM 110 C GLU A 9 16.239 13.488 -11.697 1.00 0.00 C ATOM 111 O GLU A 9 15.197 13.317 -11.062 1.00 0.00 O ATOM 112 CB GLU A 9 15.638 11.389 -12.950 1.00 0.00 C ATOM 113 CG GLU A 9 16.174 10.091 -13.547 1.00 0.00 C ATOM 114 CD GLU A 9 15.072 9.193 -14.073 1.00 0.00 C ATOM 115 OE1 GLU A 9 13.990 9.154 -13.450 1.00 0.00 O ATOM 116 OE2 GLU A 9 15.290 8.530 -15.109 1.00 0.00 O ATOM 0 H GLU A 9 17.851 11.018 -11.814 1.00 0.00 H new ATOM 0 HA GLU A 9 16.836 13.022 -13.680 1.00 0.00 H new ATOM 0 HB2 GLU A 9 15.172 11.167 -11.990 1.00 0.00 H new ATOM 0 HB3 GLU A 9 14.856 11.778 -13.602 1.00 0.00 H new ATOM 0 HG2 GLU A 9 16.864 10.326 -14.357 1.00 0.00 H new ATOM 0 HG3 GLU A 9 16.744 9.554 -12.788 1.00 0.00 H new ATOM 123 N GLU A 10 17.027 14.546 -11.523 1.00 0.00 N ATOM 124 CA GLU A 10 16.708 15.591 -10.558 1.00 0.00 C ATOM 125 C GLU A 10 15.360 16.228 -10.878 1.00 0.00 C ATOM 126 O GLU A 10 15.164 16.782 -11.960 1.00 0.00 O ATOM 127 CB GLU A 10 17.806 16.657 -10.555 1.00 0.00 C ATOM 128 CG GLU A 10 17.668 17.669 -9.431 1.00 0.00 C ATOM 129 CD GLU A 10 16.701 18.787 -9.772 1.00 0.00 C ATOM 130 OE1 GLU A 10 17.075 19.675 -10.566 1.00 0.00 O ATOM 131 OE2 GLU A 10 15.568 18.773 -9.246 1.00 0.00 O ATOM 0 H GLU A 10 17.893 14.701 -12.040 1.00 0.00 H new ATOM 0 HA GLU A 10 16.648 15.139 -9.568 1.00 0.00 H new ATOM 0 HB2 GLU A 10 18.776 16.167 -10.474 1.00 0.00 H new ATOM 0 HB3 GLU A 10 17.793 17.183 -11.510 1.00 0.00 H new ATOM 0 HG2 GLU A 10 17.328 17.161 -8.529 1.00 0.00 H new ATOM 0 HG3 GLU A 10 18.646 18.095 -9.207 1.00 0.00 H new ATOM 138 N ALA A 11 14.429 16.140 -9.933 1.00 0.00 N ATOM 139 CA ALA A 11 13.096 16.701 -10.120 1.00 0.00 C ATOM 140 C ALA A 11 12.903 17.969 -9.295 1.00 0.00 C ATOM 141 O ALA A 11 13.423 18.087 -8.186 1.00 0.00 O ATOM 142 CB ALA A 11 12.038 15.669 -9.760 1.00 0.00 C ATOM 0 H ALA A 11 14.573 15.686 -9.031 1.00 0.00 H new ATOM 0 HA ALA A 11 12.989 16.970 -11.171 1.00 0.00 H new ATOM 0 HB1 ALA A 11 11.047 16.099 -9.903 1.00 0.00 H new ATOM 0 HB2 ALA A 11 12.150 14.794 -10.400 1.00 0.00 H new ATOM 0 HB3 ALA A 11 12.158 15.373 -8.718 1.00 0.00 H new ATOM 148 N ALA A 12 12.142 18.909 -9.846 1.00 0.00 N ATOM 149 CA ALA A 12 11.863 20.172 -9.171 1.00 0.00 C ATOM 150 C ALA A 12 13.144 20.940 -8.861 1.00 0.00 C ATOM 151 O ALA A 12 13.959 20.509 -8.046 1.00 0.00 O ATOM 152 CB ALA A 12 11.074 19.926 -7.894 1.00 0.00 C ATOM 0 H ALA A 12 11.705 18.819 -10.763 1.00 0.00 H new ATOM 0 HA ALA A 12 11.266 20.783 -9.848 1.00 0.00 H new ATOM 0 HB1 ALA A 12 10.873 20.877 -7.401 1.00 0.00 H new ATOM 0 HB2 ALA A 12 10.131 19.437 -8.138 1.00 0.00 H new ATOM 0 HB3 ALA A 12 11.652 19.287 -7.227 1.00 0.00 H new ATOM 158 N PHE A 13 13.309 22.088 -9.511 1.00 0.00 N ATOM 159 CA PHE A 13 14.483 22.926 -9.303 1.00 0.00 C ATOM 160 C PHE A 13 14.083 24.265 -8.694 1.00 0.00 C ATOM 161 O PHE A 13 14.705 25.294 -8.961 1.00 0.00 O ATOM 162 CB PHE A 13 15.220 23.150 -10.625 1.00 0.00 C ATOM 163 CG PHE A 13 16.717 23.128 -10.489 1.00 0.00 C ATOM 164 CD1 PHE A 13 17.343 23.822 -9.466 1.00 0.00 C ATOM 165 CD2 PHE A 13 17.496 22.414 -11.385 1.00 0.00 C ATOM 166 CE1 PHE A 13 18.719 23.802 -9.339 1.00 0.00 C ATOM 167 CE2 PHE A 13 18.872 22.392 -11.264 1.00 0.00 C ATOM 168 CZ PHE A 13 19.484 23.087 -10.239 1.00 0.00 C ATOM 0 H PHE A 13 12.642 22.459 -10.188 1.00 0.00 H new ATOM 0 HA PHE A 13 15.151 22.413 -8.611 1.00 0.00 H new ATOM 0 HB2 PHE A 13 14.916 22.381 -11.336 1.00 0.00 H new ATOM 0 HB3 PHE A 13 14.915 24.109 -11.044 1.00 0.00 H new ATOM 0 HD1 PHE A 13 16.749 24.384 -8.761 1.00 0.00 H new ATOM 0 HD2 PHE A 13 17.022 21.868 -12.187 1.00 0.00 H new ATOM 0 HE1 PHE A 13 19.196 24.345 -8.536 1.00 0.00 H new ATOM 0 HE2 PHE A 13 19.468 21.832 -11.970 1.00 0.00 H new ATOM 0 HZ PHE A 13 20.559 23.071 -10.142 1.00 0.00 H new ATOM 178 N VAL A 14 13.035 24.244 -7.875 1.00 0.00 N ATOM 179 CA VAL A 14 12.543 25.454 -7.226 1.00 0.00 C ATOM 180 C VAL A 14 12.959 25.493 -5.759 1.00 0.00 C ATOM 181 O VAL A 14 12.974 24.466 -5.080 1.00 0.00 O ATOM 182 CB VAL A 14 11.005 25.553 -7.318 1.00 0.00 C ATOM 183 CG1 VAL A 14 10.517 26.902 -6.807 1.00 0.00 C ATOM 184 CG2 VAL A 14 10.530 25.311 -8.747 1.00 0.00 C ATOM 0 H VAL A 14 12.510 23.400 -7.645 1.00 0.00 H new ATOM 0 HA VAL A 14 12.985 26.301 -7.750 1.00 0.00 H new ATOM 0 HB VAL A 14 10.578 24.776 -6.683 1.00 0.00 H new ATOM 0 HG11 VAL A 14 9.431 26.948 -6.882 1.00 0.00 H new ATOM 0 HG12 VAL A 14 10.815 27.026 -5.766 1.00 0.00 H new ATOM 0 HG13 VAL A 14 10.956 27.699 -7.407 1.00 0.00 H new ATOM 0 HG21 VAL A 14 9.443 25.386 -8.787 1.00 0.00 H new ATOM 0 HG22 VAL A 14 10.970 26.058 -9.408 1.00 0.00 H new ATOM 0 HG23 VAL A 14 10.837 24.316 -9.069 1.00 0.00 H new ATOM 194 N ALA A 15 13.298 26.685 -5.274 1.00 0.00 N ATOM 195 CA ALA A 15 13.716 26.859 -3.887 1.00 0.00 C ATOM 196 C ALA A 15 15.006 26.098 -3.604 1.00 0.00 C ATOM 197 O ALA A 15 14.990 25.035 -2.982 1.00 0.00 O ATOM 198 CB ALA A 15 12.614 26.408 -2.938 1.00 0.00 C ATOM 0 H ALA A 15 13.291 27.545 -5.822 1.00 0.00 H new ATOM 0 HA ALA A 15 13.906 27.920 -3.723 1.00 0.00 H new ATOM 0 HB1 ALA A 15 12.943 26.545 -1.908 1.00 0.00 H new ATOM 0 HB2 ALA A 15 11.717 27.001 -3.114 1.00 0.00 H new ATOM 0 HB3 ALA A 15 12.393 25.355 -3.112 1.00 0.00 H new ATOM 204 N ASP A 16 16.123 26.650 -4.064 1.00 0.00 N ATOM 205 CA ASP A 16 17.426 26.025 -3.863 1.00 0.00 C ATOM 206 C ASP A 16 17.731 25.860 -2.378 1.00 0.00 C ATOM 207 O ASP A 16 18.442 24.935 -1.979 1.00 0.00 O ATOM 208 CB ASP A 16 18.522 26.856 -4.532 1.00 0.00 C ATOM 209 CG ASP A 16 18.417 28.331 -4.199 1.00 0.00 C ATOM 210 OD1 ASP A 16 18.955 28.743 -3.149 1.00 0.00 O ATOM 211 OD2 ASP A 16 17.796 29.074 -4.987 1.00 0.00 O ATOM 0 H ASP A 16 16.153 27.530 -4.579 1.00 0.00 H new ATOM 0 HA ASP A 16 17.399 25.036 -4.320 1.00 0.00 H new ATOM 0 HB2 ASP A 16 19.498 26.485 -4.218 1.00 0.00 H new ATOM 0 HB3 ASP A 16 18.464 26.726 -5.613 1.00 0.00 H new ATOM 216 N ASP A 17 17.190 26.762 -1.560 1.00 0.00 N ATOM 217 CA ASP A 17 17.406 26.722 -0.116 1.00 0.00 C ATOM 218 C ASP A 17 16.987 25.375 0.467 1.00 0.00 C ATOM 219 O ASP A 17 17.741 24.745 1.206 1.00 0.00 O ATOM 220 CB ASP A 17 16.627 27.848 0.566 1.00 0.00 C ATOM 221 CG ASP A 17 17.184 28.189 1.935 1.00 0.00 C ATOM 222 OD1 ASP A 17 18.406 28.032 2.134 1.00 0.00 O ATOM 223 OD2 ASP A 17 16.395 28.611 2.807 1.00 0.00 O ATOM 0 H ASP A 17 16.598 27.531 -1.875 1.00 0.00 H new ATOM 0 HA ASP A 17 18.472 26.858 0.068 1.00 0.00 H new ATOM 0 HB2 ASP A 17 16.651 28.737 -0.065 1.00 0.00 H new ATOM 0 HB3 ASP A 17 15.582 27.555 0.665 1.00 0.00 H new ATOM 228 N VAL A 18 15.781 24.939 0.126 1.00 0.00 N ATOM 229 CA VAL A 18 15.262 23.666 0.611 1.00 0.00 C ATOM 230 C VAL A 18 15.805 22.503 -0.212 1.00 0.00 C ATOM 231 O VAL A 18 15.979 21.396 0.298 1.00 0.00 O ATOM 232 CB VAL A 18 13.723 23.637 0.566 1.00 0.00 C ATOM 233 CG1 VAL A 18 13.189 22.386 1.245 1.00 0.00 C ATOM 234 CG2 VAL A 18 13.148 24.888 1.210 1.00 0.00 C ATOM 0 H VAL A 18 15.143 25.449 -0.485 1.00 0.00 H new ATOM 0 HA VAL A 18 15.591 23.561 1.645 1.00 0.00 H new ATOM 0 HB VAL A 18 13.410 23.615 -0.478 1.00 0.00 H new ATOM 0 HG11 VAL A 18 12.100 22.385 1.202 1.00 0.00 H new ATOM 0 HG12 VAL A 18 13.573 21.503 0.734 1.00 0.00 H new ATOM 0 HG13 VAL A 18 13.511 22.372 2.286 1.00 0.00 H new ATOM 0 HG21 VAL A 18 12.059 24.851 1.169 1.00 0.00 H new ATOM 0 HG22 VAL A 18 13.471 24.943 2.250 1.00 0.00 H new ATOM 0 HG23 VAL A 18 13.501 25.769 0.673 1.00 0.00 H new ATOM 244 N SER A 19 16.063 22.759 -1.490 1.00 0.00 N ATOM 245 CA SER A 19 16.575 21.732 -2.388 1.00 0.00 C ATOM 246 C SER A 19 17.906 21.169 -1.895 1.00 0.00 C ATOM 247 O SER A 19 18.146 19.965 -1.973 1.00 0.00 O ATOM 248 CB SER A 19 16.735 22.295 -3.804 1.00 0.00 C ATOM 249 OG SER A 19 17.993 22.928 -3.970 1.00 0.00 O ATOM 0 H SER A 19 15.926 23.670 -1.927 1.00 0.00 H new ATOM 0 HA SER A 19 15.851 20.917 -2.405 1.00 0.00 H new ATOM 0 HB2 SER A 19 16.633 21.489 -4.531 1.00 0.00 H new ATOM 0 HB3 SER A 19 15.937 23.010 -4.005 1.00 0.00 H new ATOM 0 HG SER A 19 18.146 23.551 -3.229 1.00 0.00 H new ATOM 255 N ASN A 20 18.772 22.044 -1.397 1.00 0.00 N ATOM 256 CA ASN A 20 20.078 21.616 -0.905 1.00 0.00 C ATOM 257 C ASN A 20 19.951 20.818 0.391 1.00 0.00 C ATOM 258 O ASN A 20 20.618 19.804 0.565 1.00 0.00 O ATOM 259 CB ASN A 20 20.998 22.823 -0.697 1.00 0.00 C ATOM 260 CG ASN A 20 20.529 23.736 0.418 1.00 0.00 C ATOM 261 OD1 ASN A 20 20.600 23.383 1.596 1.00 0.00 O ATOM 262 ND2 ASN A 20 20.048 24.916 0.054 1.00 0.00 N ATOM 0 H ASN A 20 18.597 23.046 -1.323 1.00 0.00 H new ATOM 0 HA ASN A 20 20.518 20.964 -1.660 1.00 0.00 H new ATOM 0 HB2 ASN A 20 22.005 22.472 -0.473 1.00 0.00 H new ATOM 0 HB3 ASN A 20 21.058 23.392 -1.625 1.00 0.00 H new ATOM 0 HD21 ASN A 20 19.718 25.573 0.762 1.00 0.00 H new ATOM 0 HD22 ASN A 20 20.008 25.168 -0.934 1.00 0.00 H new ATOM 269 N ILE A 21 19.092 21.284 1.296 1.00 0.00 N ATOM 270 CA ILE A 21 18.886 20.617 2.583 1.00 0.00 C ATOM 271 C ILE A 21 18.496 19.150 2.395 1.00 0.00 C ATOM 272 O ILE A 21 19.118 18.256 2.969 1.00 0.00 O ATOM 273 CB ILE A 21 17.781 21.337 3.405 1.00 0.00 C ATOM 274 CG1 ILE A 21 18.202 22.773 3.717 1.00 0.00 C ATOM 275 CG2 ILE A 21 17.459 20.589 4.698 1.00 0.00 C ATOM 276 CD1 ILE A 21 17.171 23.547 4.509 1.00 0.00 C ATOM 0 H ILE A 21 18.526 22.122 1.163 1.00 0.00 H new ATOM 0 HA ILE A 21 19.831 20.663 3.124 1.00 0.00 H new ATOM 0 HB ILE A 21 16.876 21.353 2.797 1.00 0.00 H new ATOM 0 HG12 ILE A 21 19.138 22.755 4.275 1.00 0.00 H new ATOM 0 HG13 ILE A 21 18.398 23.297 2.781 1.00 0.00 H new ATOM 0 HG21 ILE A 21 16.682 21.124 5.244 1.00 0.00 H new ATOM 0 HG22 ILE A 21 17.109 19.585 4.460 1.00 0.00 H new ATOM 0 HG23 ILE A 21 18.356 20.524 5.314 1.00 0.00 H new ATOM 0 HD11 ILE A 21 17.537 24.557 4.694 1.00 0.00 H new ATOM 0 HD12 ILE A 21 16.240 23.596 3.944 1.00 0.00 H new ATOM 0 HD13 ILE A 21 16.992 23.046 5.460 1.00 0.00 H new ATOM 288 N ILE A 22 17.458 18.911 1.608 1.00 0.00 N ATOM 289 CA ILE A 22 16.986 17.555 1.375 1.00 0.00 C ATOM 290 C ILE A 22 18.075 16.676 0.759 1.00 0.00 C ATOM 291 O ILE A 22 18.329 15.574 1.240 1.00 0.00 O ATOM 292 CB ILE A 22 15.723 17.539 0.485 1.00 0.00 C ATOM 293 CG1 ILE A 22 15.171 16.117 0.363 1.00 0.00 C ATOM 294 CG2 ILE A 22 16.019 18.122 -0.888 1.00 0.00 C ATOM 295 CD1 ILE A 22 14.706 15.534 1.681 1.00 0.00 C ATOM 0 H ILE A 22 16.929 19.635 1.122 1.00 0.00 H new ATOM 0 HA ILE A 22 16.725 17.142 2.349 1.00 0.00 H new ATOM 0 HB ILE A 22 14.965 18.163 0.958 1.00 0.00 H new ATOM 0 HG12 ILE A 22 14.337 16.119 -0.339 1.00 0.00 H new ATOM 0 HG13 ILE A 22 15.941 15.472 -0.059 1.00 0.00 H new ATOM 0 HG21 ILE A 22 15.114 18.100 -1.496 1.00 0.00 H new ATOM 0 HG22 ILE A 22 16.358 19.152 -0.780 1.00 0.00 H new ATOM 0 HG23 ILE A 22 16.797 17.533 -1.374 1.00 0.00 H new ATOM 0 HD11 ILE A 22 14.327 14.525 1.519 1.00 0.00 H new ATOM 0 HD12 ILE A 22 15.542 15.500 2.379 1.00 0.00 H new ATOM 0 HD13 ILE A 22 13.913 16.157 2.095 1.00 0.00 H new ATOM 307 N LYS A 23 18.721 17.158 -0.300 1.00 0.00 N ATOM 308 CA LYS A 23 19.772 16.387 -0.958 1.00 0.00 C ATOM 309 C LYS A 23 20.943 16.140 -0.026 1.00 0.00 C ATOM 310 O LYS A 23 21.349 14.997 0.181 1.00 0.00 O ATOM 311 CB LYS A 23 20.241 17.093 -2.220 1.00 0.00 C ATOM 312 CG LYS A 23 19.342 16.826 -3.407 1.00 0.00 C ATOM 313 CD LYS A 23 19.808 17.588 -4.640 1.00 0.00 C ATOM 314 CE LYS A 23 19.905 16.683 -5.857 1.00 0.00 C ATOM 315 NZ LYS A 23 19.271 17.291 -7.059 1.00 0.00 N ATOM 0 H LYS A 23 18.537 18.070 -0.718 1.00 0.00 H new ATOM 0 HA LYS A 23 19.351 15.419 -1.232 1.00 0.00 H new ATOM 0 HB2 LYS A 23 20.284 18.167 -2.036 1.00 0.00 H new ATOM 0 HB3 LYS A 23 21.255 16.769 -2.457 1.00 0.00 H new ATOM 0 HG2 LYS A 23 19.328 15.757 -3.622 1.00 0.00 H new ATOM 0 HG3 LYS A 23 18.320 17.115 -3.163 1.00 0.00 H new ATOM 0 HD2 LYS A 23 19.115 18.403 -4.847 1.00 0.00 H new ATOM 0 HD3 LYS A 23 20.781 18.039 -4.443 1.00 0.00 H new ATOM 0 HE2 LYS A 23 20.953 16.472 -6.068 1.00 0.00 H new ATOM 0 HE3 LYS A 23 19.425 15.729 -5.638 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 19.100 16.553 -7.772 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 18.367 17.729 -6.790 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 19.903 18.016 -7.456 1.00 0.00 H new ATOM 329 N GLU A 24 21.474 17.210 0.556 1.00 0.00 N ATOM 330 CA GLU A 24 22.590 17.089 1.493 1.00 0.00 C ATOM 331 C GLU A 24 22.258 16.056 2.565 1.00 0.00 C ATOM 332 O GLU A 24 23.126 15.313 3.024 1.00 0.00 O ATOM 333 CB GLU A 24 22.905 18.444 2.139 1.00 0.00 C ATOM 334 CG GLU A 24 24.098 19.153 1.518 1.00 0.00 C ATOM 335 CD GLU A 24 23.934 19.376 0.029 1.00 0.00 C ATOM 336 OE1 GLU A 24 23.787 18.379 -0.710 1.00 0.00 O ATOM 337 OE2 GLU A 24 23.953 20.549 -0.402 1.00 0.00 O ATOM 0 H GLU A 24 21.154 18.166 0.398 1.00 0.00 H new ATOM 0 HA GLU A 24 23.472 16.760 0.943 1.00 0.00 H new ATOM 0 HB2 GLU A 24 22.029 19.087 2.059 1.00 0.00 H new ATOM 0 HB3 GLU A 24 23.095 18.295 3.202 1.00 0.00 H new ATOM 0 HG2 GLU A 24 24.242 20.114 2.012 1.00 0.00 H new ATOM 0 HG3 GLU A 24 24.998 18.565 1.696 1.00 0.00 H new ATOM 344 N SER A 25 20.985 16.012 2.945 1.00 0.00 N ATOM 345 CA SER A 25 20.528 15.065 3.944 1.00 0.00 C ATOM 346 C SER A 25 20.536 13.651 3.378 1.00 0.00 C ATOM 347 O SER A 25 21.060 12.750 4.009 1.00 0.00 O ATOM 348 CB SER A 25 19.124 15.431 4.429 1.00 0.00 C ATOM 349 OG SER A 25 19.175 16.428 5.434 1.00 0.00 O ATOM 0 H SER A 25 20.256 16.622 2.574 1.00 0.00 H new ATOM 0 HA SER A 25 21.210 15.106 4.793 1.00 0.00 H new ATOM 0 HB2 SER A 25 18.527 15.787 3.589 1.00 0.00 H new ATOM 0 HB3 SER A 25 18.627 14.542 4.819 1.00 0.00 H new ATOM 0 HG SER A 25 18.278 16.567 5.803 1.00 0.00 H new ATOM 355 N ILE A 26 19.985 13.460 2.173 1.00 0.00 N ATOM 356 CA ILE A 26 19.975 12.131 1.544 1.00 0.00 C ATOM 357 C ILE A 26 21.403 11.638 1.377 1.00 0.00 C ATOM 358 O ILE A 26 21.725 10.495 1.683 1.00 0.00 O ATOM 359 CB ILE A 26 19.234 12.146 0.168 1.00 0.00 C ATOM 360 CG1 ILE A 26 17.744 11.962 0.392 1.00 0.00 C ATOM 361 CG2 ILE A 26 19.735 11.065 -0.797 1.00 0.00 C ATOM 362 CD1 ILE A 26 17.037 13.238 0.757 1.00 0.00 C ATOM 0 H ILE A 26 19.546 14.196 1.620 1.00 0.00 H new ATOM 0 HA ILE A 26 19.428 11.449 2.195 1.00 0.00 H new ATOM 0 HB ILE A 26 19.443 13.112 -0.292 1.00 0.00 H new ATOM 0 HG12 ILE A 26 17.295 11.552 -0.513 1.00 0.00 H new ATOM 0 HG13 ILE A 26 17.590 11.230 1.185 1.00 0.00 H new ATOM 0 HG21 ILE A 26 19.181 11.128 -1.734 1.00 0.00 H new ATOM 0 HG22 ILE A 26 20.797 11.216 -0.993 1.00 0.00 H new ATOM 0 HG23 ILE A 26 19.584 10.082 -0.352 1.00 0.00 H new ATOM 0 HD11 ILE A 26 15.976 13.037 0.903 1.00 0.00 H new ATOM 0 HD12 ILE A 26 17.461 13.638 1.678 1.00 0.00 H new ATOM 0 HD13 ILE A 26 17.161 13.965 -0.045 1.00 0.00 H new ATOM 374 N ASP A 27 22.262 12.521 0.904 1.00 0.00 N ATOM 375 CA ASP A 27 23.662 12.191 0.706 1.00 0.00 C ATOM 376 C ASP A 27 24.234 11.551 1.979 1.00 0.00 C ATOM 377 O ASP A 27 25.016 10.604 1.925 1.00 0.00 O ATOM 378 CB ASP A 27 24.419 13.477 0.341 1.00 0.00 C ATOM 379 CG ASP A 27 25.927 13.299 0.302 1.00 0.00 C ATOM 380 OD1 ASP A 27 26.456 12.959 -0.777 1.00 0.00 O ATOM 381 OD2 ASP A 27 26.575 13.499 1.350 1.00 0.00 O ATOM 0 H ASP A 27 22.014 13.477 0.648 1.00 0.00 H new ATOM 0 HA ASP A 27 23.772 11.470 -0.104 1.00 0.00 H new ATOM 0 HB2 ASP A 27 24.077 13.827 -0.633 1.00 0.00 H new ATOM 0 HB3 ASP A 27 24.171 14.254 1.064 1.00 0.00 H new ATOM 386 N ALA A 28 23.803 12.068 3.121 1.00 0.00 N ATOM 387 CA ALA A 28 24.249 11.562 4.414 1.00 0.00 C ATOM 388 C ALA A 28 23.364 10.427 4.930 1.00 0.00 C ATOM 389 O ALA A 28 23.859 9.430 5.451 1.00 0.00 O ATOM 390 CB ALA A 28 24.271 12.703 5.421 1.00 0.00 C ATOM 0 H ALA A 28 23.141 12.842 3.179 1.00 0.00 H new ATOM 0 HA ALA A 28 25.251 11.154 4.284 1.00 0.00 H new ATOM 0 HB1 ALA A 28 24.604 12.328 6.389 1.00 0.00 H new ATOM 0 HB2 ALA A 28 24.956 13.478 5.077 1.00 0.00 H new ATOM 0 HB3 ALA A 28 23.269 13.121 5.519 1.00 0.00 H new ATOM 396 N VAL A 29 22.056 10.595 4.785 1.00 0.00 N ATOM 397 CA VAL A 29 21.080 9.621 5.239 1.00 0.00 C ATOM 398 C VAL A 29 21.084 8.365 4.359 1.00 0.00 C ATOM 399 O VAL A 29 20.461 7.359 4.695 1.00 0.00 O ATOM 400 CB VAL A 29 19.685 10.333 5.359 1.00 0.00 C ATOM 401 CG1 VAL A 29 18.481 9.545 4.874 1.00 0.00 C ATOM 402 CG2 VAL A 29 19.452 10.736 6.793 1.00 0.00 C ATOM 0 H VAL A 29 21.643 11.418 4.346 1.00 0.00 H new ATOM 0 HA VAL A 29 21.341 9.248 6.229 1.00 0.00 H new ATOM 0 HB VAL A 29 19.757 11.187 4.686 1.00 0.00 H new ATOM 0 HG11 VAL A 29 17.578 10.141 5.008 1.00 0.00 H new ATOM 0 HG12 VAL A 29 18.604 9.306 3.818 1.00 0.00 H new ATOM 0 HG13 VAL A 29 18.395 8.622 5.447 1.00 0.00 H new ATOM 0 HG21 VAL A 29 18.484 11.230 6.879 1.00 0.00 H new ATOM 0 HG22 VAL A 29 19.464 9.849 7.427 1.00 0.00 H new ATOM 0 HG23 VAL A 29 20.239 11.420 7.111 1.00 0.00 H new ATOM 412 N LEU A 30 21.825 8.406 3.250 1.00 0.00 N ATOM 413 CA LEU A 30 21.927 7.256 2.368 1.00 0.00 C ATOM 414 C LEU A 30 23.378 6.780 2.236 1.00 0.00 C ATOM 415 O LEU A 30 23.620 5.589 2.041 1.00 0.00 O ATOM 416 CB LEU A 30 21.324 7.575 1.002 1.00 0.00 C ATOM 417 CG LEU A 30 19.792 7.612 0.983 1.00 0.00 C ATOM 418 CD1 LEU A 30 19.233 6.249 1.282 1.00 0.00 C ATOM 419 CD2 LEU A 30 19.250 8.580 2.009 1.00 0.00 C ATOM 0 H LEU A 30 22.358 9.221 2.948 1.00 0.00 H new ATOM 0 HA LEU A 30 21.357 6.439 2.810 1.00 0.00 H new ATOM 0 HB2 LEU A 30 21.703 8.540 0.667 1.00 0.00 H new ATOM 0 HB3 LEU A 30 21.667 6.831 0.283 1.00 0.00 H new ATOM 0 HG LEU A 30 19.491 7.937 -0.013 1.00 0.00 H new ATOM 0 HD11 LEU A 30 18.144 6.291 1.265 1.00 0.00 H new ATOM 0 HD12 LEU A 30 19.581 5.540 0.530 1.00 0.00 H new ATOM 0 HD13 LEU A 30 19.568 5.926 2.268 1.00 0.00 H new ATOM 0 HD21 LEU A 30 18.161 8.581 1.968 1.00 0.00 H new ATOM 0 HD22 LEU A 30 19.576 8.276 3.004 1.00 0.00 H new ATOM 0 HD23 LEU A 30 19.622 9.582 1.796 1.00 0.00 H new ATOM 431 N GLN A 31 24.350 7.695 2.348 1.00 0.00 N ATOM 432 CA GLN A 31 25.755 7.307 2.243 1.00 0.00 C ATOM 433 C GLN A 31 26.340 6.895 3.599 1.00 0.00 C ATOM 434 O GLN A 31 27.380 6.238 3.650 1.00 0.00 O ATOM 435 CB GLN A 31 26.588 8.439 1.648 1.00 0.00 C ATOM 436 CG GLN A 31 27.911 7.981 1.091 1.00 0.00 C ATOM 437 CD GLN A 31 28.657 9.083 0.365 1.00 0.00 C ATOM 438 OE1 GLN A 31 28.063 9.866 -0.375 1.00 0.00 O ATOM 439 NE2 GLN A 31 29.967 9.148 0.574 1.00 0.00 N ATOM 0 H GLN A 31 24.190 8.690 2.508 1.00 0.00 H new ATOM 0 HA GLN A 31 25.795 6.443 1.580 1.00 0.00 H new ATOM 0 HB2 GLN A 31 26.017 8.923 0.856 1.00 0.00 H new ATOM 0 HB3 GLN A 31 26.767 9.191 2.417 1.00 0.00 H new ATOM 0 HG2 GLN A 31 28.531 7.604 1.904 1.00 0.00 H new ATOM 0 HG3 GLN A 31 27.743 7.150 0.406 1.00 0.00 H new ATOM 0 HE21 GLN A 31 30.418 8.477 1.196 1.00 0.00 H new ATOM 0 HE22 GLN A 31 30.522 9.869 0.112 1.00 0.00 H new ATOM 448 N ASN A 32 25.685 7.284 4.700 1.00 0.00 N ATOM 449 CA ASN A 32 26.179 6.944 6.041 1.00 0.00 C ATOM 450 C ASN A 32 26.460 5.447 6.183 1.00 0.00 C ATOM 451 O ASN A 32 27.512 5.049 6.684 1.00 0.00 O ATOM 452 CB ASN A 32 25.184 7.378 7.122 1.00 0.00 C ATOM 453 CG ASN A 32 23.860 6.639 7.038 1.00 0.00 C ATOM 454 OD1 ASN A 32 23.652 5.639 7.726 1.00 0.00 O ATOM 455 ND2 ASN A 32 22.957 7.124 6.194 1.00 0.00 N ATOM 0 H ASN A 32 24.822 7.828 4.691 1.00 0.00 H new ATOM 0 HA ASN A 32 27.115 7.486 6.175 1.00 0.00 H new ATOM 0 HB2 ASN A 32 25.626 7.210 8.104 1.00 0.00 H new ATOM 0 HB3 ASN A 32 25.003 8.449 7.033 1.00 0.00 H new ATOM 0 HD21 ASN A 32 22.051 6.665 6.097 1.00 0.00 H new ATOM 0 HD22 ASN A 32 23.169 7.955 5.642 1.00 0.00 H new ATOM 462 N GLN A 33 25.512 4.622 5.749 1.00 0.00 N ATOM 463 CA GLN A 33 25.660 3.173 5.841 1.00 0.00 C ATOM 464 C GLN A 33 25.563 2.521 4.467 1.00 0.00 C ATOM 465 O GLN A 33 25.518 3.203 3.444 1.00 0.00 O ATOM 466 CB GLN A 33 24.594 2.592 6.772 1.00 0.00 C ATOM 467 CG GLN A 33 25.102 1.453 7.643 1.00 0.00 C ATOM 468 CD GLN A 33 25.279 1.859 9.094 1.00 0.00 C ATOM 469 OE1 GLN A 33 24.329 1.841 9.876 1.00 0.00 O ATOM 470 NE2 GLN A 33 26.501 2.229 9.460 1.00 0.00 N ATOM 0 H GLN A 33 24.635 4.931 5.331 1.00 0.00 H new ATOM 0 HA GLN A 33 26.648 2.961 6.249 1.00 0.00 H new ATOM 0 HB2 GLN A 33 24.212 3.386 7.413 1.00 0.00 H new ATOM 0 HB3 GLN A 33 23.756 2.235 6.173 1.00 0.00 H new ATOM 0 HG2 GLN A 33 24.403 0.618 7.586 1.00 0.00 H new ATOM 0 HG3 GLN A 33 26.055 1.098 7.250 1.00 0.00 H new ATOM 0 HE21 GLN A 33 27.260 2.229 8.778 1.00 0.00 H new ATOM 0 HE22 GLN A 33 26.681 2.513 10.423 1.00 0.00 H new ATOM 479 N GLN A 34 25.532 1.192 4.455 1.00 0.00 N ATOM 480 CA GLN A 34 25.440 0.439 3.211 1.00 0.00 C ATOM 481 C GLN A 34 23.986 0.171 2.840 1.00 0.00 C ATOM 482 O GLN A 34 23.073 0.460 3.615 1.00 0.00 O ATOM 483 CB GLN A 34 26.199 -0.884 3.336 1.00 0.00 C ATOM 484 CG GLN A 34 26.708 -1.423 2.009 1.00 0.00 C ATOM 485 CD GLN A 34 28.121 -1.965 2.102 1.00 0.00 C ATOM 486 OE1 GLN A 34 28.432 -2.772 2.978 1.00 0.00 O ATOM 487 NE2 GLN A 34 28.985 -1.521 1.197 1.00 0.00 N ATOM 0 H GLN A 34 25.569 0.614 5.295 1.00 0.00 H new ATOM 0 HA GLN A 34 25.891 1.038 2.420 1.00 0.00 H new ATOM 0 HB2 GLN A 34 27.044 -0.746 4.010 1.00 0.00 H new ATOM 0 HB3 GLN A 34 25.545 -1.626 3.793 1.00 0.00 H new ATOM 0 HG2 GLN A 34 26.042 -2.213 1.663 1.00 0.00 H new ATOM 0 HG3 GLN A 34 26.676 -0.629 1.263 1.00 0.00 H new ATOM 0 HE21 GLN A 34 28.683 -0.852 0.489 1.00 0.00 H new ATOM 0 HE22 GLN A 34 29.951 -1.849 1.210 1.00 0.00 H new ATOM 496 N TYR A 35 23.778 -0.383 1.652 1.00 0.00 N ATOM 497 CA TYR A 35 22.437 -0.693 1.172 1.00 0.00 C ATOM 498 C TYR A 35 21.766 -1.724 2.081 1.00 0.00 C ATOM 499 O TYR A 35 22.159 -2.890 2.092 1.00 0.00 O ATOM 500 CB TYR A 35 22.536 -1.220 -0.271 1.00 0.00 C ATOM 501 CG TYR A 35 21.270 -1.849 -0.825 1.00 0.00 C ATOM 502 CD1 TYR A 35 20.012 -1.440 -0.403 1.00 0.00 C ATOM 503 CD2 TYR A 35 21.345 -2.853 -1.784 1.00 0.00 C ATOM 504 CE1 TYR A 35 18.865 -2.015 -0.918 1.00 0.00 C ATOM 505 CE2 TYR A 35 20.203 -3.432 -2.302 1.00 0.00 C ATOM 506 CZ TYR A 35 18.967 -3.011 -1.867 1.00 0.00 C ATOM 507 OH TYR A 35 17.827 -3.584 -2.381 1.00 0.00 O ATOM 0 H TYR A 35 24.524 -0.628 1.001 1.00 0.00 H new ATOM 0 HA TYR A 35 21.825 0.209 1.187 1.00 0.00 H new ATOM 0 HB2 TYR A 35 22.826 -0.395 -0.922 1.00 0.00 H new ATOM 0 HB3 TYR A 35 23.337 -1.958 -0.316 1.00 0.00 H new ATOM 0 HD1 TYR A 35 19.928 -0.660 0.339 1.00 0.00 H new ATOM 0 HD2 TYR A 35 22.313 -3.186 -2.130 1.00 0.00 H new ATOM 0 HE1 TYR A 35 17.894 -1.686 -0.579 1.00 0.00 H new ATOM 0 HE2 TYR A 35 20.280 -4.212 -3.045 1.00 0.00 H new ATOM 0 HH TYR A 35 18.073 -4.268 -3.039 1.00 0.00 H new ATOM 517 N SER A 36 20.750 -1.302 2.843 1.00 0.00 N ATOM 518 CA SER A 36 20.055 -2.231 3.735 1.00 0.00 C ATOM 519 C SER A 36 18.544 -2.177 3.527 1.00 0.00 C ATOM 520 O SER A 36 17.933 -1.124 3.684 1.00 0.00 O ATOM 521 CB SER A 36 20.392 -1.913 5.193 1.00 0.00 C ATOM 522 OG SER A 36 21.487 -2.694 5.645 1.00 0.00 O ATOM 0 H SER A 36 20.398 -0.345 2.860 1.00 0.00 H new ATOM 0 HA SER A 36 20.394 -3.239 3.497 1.00 0.00 H new ATOM 0 HB2 SER A 36 20.631 -0.854 5.292 1.00 0.00 H new ATOM 0 HB3 SER A 36 19.522 -2.103 5.821 1.00 0.00 H new ATOM 0 HG SER A 36 21.684 -2.471 6.579 1.00 0.00 H new ATOM 528 N GLU A 37 17.941 -3.322 3.194 1.00 0.00 N ATOM 529 CA GLU A 37 16.489 -3.398 2.984 1.00 0.00 C ATOM 530 C GLU A 37 15.745 -2.926 4.228 1.00 0.00 C ATOM 531 O GLU A 37 14.669 -2.341 4.136 1.00 0.00 O ATOM 532 CB GLU A 37 16.074 -4.827 2.633 1.00 0.00 C ATOM 533 CG GLU A 37 14.587 -4.975 2.348 1.00 0.00 C ATOM 534 CD GLU A 37 14.290 -5.151 0.871 1.00 0.00 C ATOM 535 OE1 GLU A 37 14.671 -4.264 0.078 1.00 0.00 O ATOM 536 OE2 GLU A 37 13.676 -6.176 0.508 1.00 0.00 O ATOM 0 H GLU A 37 18.432 -4.207 3.064 1.00 0.00 H new ATOM 0 HA GLU A 37 16.228 -2.744 2.152 1.00 0.00 H new ATOM 0 HB2 GLU A 37 16.638 -5.156 1.760 1.00 0.00 H new ATOM 0 HB3 GLU A 37 16.346 -5.488 3.456 1.00 0.00 H new ATOM 0 HG2 GLU A 37 14.199 -5.833 2.897 1.00 0.00 H new ATOM 0 HG3 GLU A 37 14.061 -4.095 2.718 1.00 0.00 H new ATOM 543 N ALA A 38 16.343 -3.145 5.391 1.00 0.00 N ATOM 544 CA ALA A 38 15.747 -2.690 6.643 1.00 0.00 C ATOM 545 C ALA A 38 15.939 -1.182 6.814 1.00 0.00 C ATOM 546 O ALA A 38 15.416 -0.586 7.752 1.00 0.00 O ATOM 547 CB ALA A 38 16.354 -3.430 7.822 1.00 0.00 C ATOM 0 H ALA A 38 17.234 -3.631 5.496 1.00 0.00 H new ATOM 0 HA ALA A 38 14.679 -2.904 6.608 1.00 0.00 H new ATOM 0 HB1 ALA A 38 15.897 -3.078 8.747 1.00 0.00 H new ATOM 0 HB2 ALA A 38 16.173 -4.499 7.713 1.00 0.00 H new ATOM 0 HB3 ALA A 38 17.428 -3.245 7.854 1.00 0.00 H new ATOM 553 N LYS A 39 16.703 -0.577 5.904 1.00 0.00 N ATOM 554 CA LYS A 39 16.983 0.841 5.930 1.00 0.00 C ATOM 555 C LYS A 39 16.450 1.535 4.670 1.00 0.00 C ATOM 556 O LYS A 39 16.383 2.755 4.614 1.00 0.00 O ATOM 557 CB LYS A 39 18.493 1.039 6.032 1.00 0.00 C ATOM 558 CG LYS A 39 18.971 1.425 7.415 1.00 0.00 C ATOM 559 CD LYS A 39 18.665 0.344 8.430 1.00 0.00 C ATOM 560 CE LYS A 39 19.724 -0.746 8.421 1.00 0.00 C ATOM 561 NZ LYS A 39 19.893 -1.369 9.763 1.00 0.00 N ATOM 0 H LYS A 39 17.143 -1.069 5.127 1.00 0.00 H new ATOM 0 HA LYS A 39 16.484 1.285 6.791 1.00 0.00 H new ATOM 0 HB2 LYS A 39 18.991 0.118 5.731 1.00 0.00 H new ATOM 0 HB3 LYS A 39 18.796 1.811 5.325 1.00 0.00 H new ATOM 0 HG2 LYS A 39 20.045 1.610 7.391 1.00 0.00 H new ATOM 0 HG3 LYS A 39 18.494 2.357 7.719 1.00 0.00 H new ATOM 0 HD2 LYS A 39 18.604 0.785 9.425 1.00 0.00 H new ATOM 0 HD3 LYS A 39 17.690 -0.093 8.215 1.00 0.00 H new ATOM 0 HE2 LYS A 39 19.449 -1.513 7.697 1.00 0.00 H new ATOM 0 HE3 LYS A 39 20.675 -0.325 8.094 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 20.624 -2.107 9.714 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 20.180 -0.642 10.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 18.993 -1.793 10.065 1.00 0.00 H new ATOM 575 N VAL A 40 16.092 0.759 3.646 1.00 0.00 N ATOM 576 CA VAL A 40 15.590 1.323 2.393 1.00 0.00 C ATOM 577 C VAL A 40 14.469 2.335 2.634 1.00 0.00 C ATOM 578 O VAL A 40 14.326 3.303 1.888 1.00 0.00 O ATOM 579 CB VAL A 40 15.086 0.221 1.438 1.00 0.00 C ATOM 580 CG1 VAL A 40 16.247 -0.611 0.924 1.00 0.00 C ATOM 581 CG2 VAL A 40 14.036 -0.648 2.117 1.00 0.00 C ATOM 0 H VAL A 40 16.140 -0.260 3.660 1.00 0.00 H new ATOM 0 HA VAL A 40 16.431 1.837 1.929 1.00 0.00 H new ATOM 0 HB VAL A 40 14.612 0.699 0.581 1.00 0.00 H new ATOM 0 HG11 VAL A 40 15.872 -1.383 0.252 1.00 0.00 H new ATOM 0 HG12 VAL A 40 16.944 0.031 0.386 1.00 0.00 H new ATOM 0 HG13 VAL A 40 16.759 -1.079 1.764 1.00 0.00 H new ATOM 0 HG21 VAL A 40 13.696 -1.417 1.423 1.00 0.00 H new ATOM 0 HG22 VAL A 40 14.469 -1.120 2.999 1.00 0.00 H new ATOM 0 HG23 VAL A 40 13.190 -0.030 2.416 1.00 0.00 H new ATOM 591 N SER A 41 13.685 2.111 3.685 1.00 0.00 N ATOM 592 CA SER A 41 12.590 3.018 4.025 1.00 0.00 C ATOM 593 C SER A 41 12.943 3.845 5.251 1.00 0.00 C ATOM 594 O SER A 41 12.530 4.998 5.373 1.00 0.00 O ATOM 595 CB SER A 41 11.298 2.236 4.268 1.00 0.00 C ATOM 596 OG SER A 41 10.165 3.082 4.181 1.00 0.00 O ATOM 0 H SER A 41 13.786 1.314 4.314 1.00 0.00 H new ATOM 0 HA SER A 41 12.433 3.693 3.184 1.00 0.00 H new ATOM 0 HB2 SER A 41 11.213 1.433 3.536 1.00 0.00 H new ATOM 0 HB3 SER A 41 11.332 1.769 5.252 1.00 0.00 H new ATOM 0 HG SER A 41 9.521 2.839 4.879 1.00 0.00 H new ATOM 602 N GLN A 42 13.729 3.266 6.144 1.00 0.00 N ATOM 603 CA GLN A 42 14.155 3.976 7.336 1.00 0.00 C ATOM 604 C GLN A 42 15.109 5.092 6.950 1.00 0.00 C ATOM 605 O GLN A 42 15.123 6.159 7.562 1.00 0.00 O ATOM 606 CB GLN A 42 14.804 3.018 8.332 1.00 0.00 C ATOM 607 CG GLN A 42 13.966 1.779 8.631 1.00 0.00 C ATOM 608 CD GLN A 42 12.491 2.072 8.880 1.00 0.00 C ATOM 609 OE1 GLN A 42 11.629 1.251 8.567 1.00 0.00 O ATOM 610 NE2 GLN A 42 12.190 3.239 9.442 1.00 0.00 N ATOM 0 H GLN A 42 14.082 2.312 6.066 1.00 0.00 H new ATOM 0 HA GLN A 42 13.283 4.414 7.822 1.00 0.00 H new ATOM 0 HB2 GLN A 42 15.772 2.705 7.942 1.00 0.00 H new ATOM 0 HB3 GLN A 42 14.993 3.551 9.264 1.00 0.00 H new ATOM 0 HG2 GLN A 42 14.052 1.085 7.795 1.00 0.00 H new ATOM 0 HG3 GLN A 42 14.379 1.277 9.506 1.00 0.00 H new ATOM 0 HE21 GLN A 42 12.933 3.894 9.687 1.00 0.00 H new ATOM 0 HE22 GLN A 42 11.216 3.480 9.628 1.00 0.00 H new ATOM 619 N TRP A 43 15.874 4.852 5.888 1.00 0.00 N ATOM 620 CA TRP A 43 16.803 5.831 5.346 1.00 0.00 C ATOM 621 C TRP A 43 16.103 7.179 5.220 1.00 0.00 C ATOM 622 O TRP A 43 16.430 8.137 5.906 1.00 0.00 O ATOM 623 CB TRP A 43 17.238 5.393 3.936 1.00 0.00 C ATOM 624 CG TRP A 43 18.396 4.442 3.862 1.00 0.00 C ATOM 625 CD1 TRP A 43 19.316 4.165 4.826 1.00 0.00 C ATOM 626 CD2 TRP A 43 18.761 3.649 2.726 1.00 0.00 C ATOM 627 NE1 TRP A 43 20.236 3.272 4.358 1.00 0.00 N ATOM 628 CE2 TRP A 43 19.917 2.935 3.076 1.00 0.00 C ATOM 629 CE3 TRP A 43 18.225 3.475 1.446 1.00 0.00 C ATOM 630 CZ2 TRP A 43 20.550 2.066 2.200 1.00 0.00 C ATOM 631 CZ3 TRP A 43 18.853 2.610 0.573 1.00 0.00 C ATOM 632 CH2 TRP A 43 20.006 1.913 0.952 1.00 0.00 C ATOM 0 H TRP A 43 15.864 3.968 5.379 1.00 0.00 H new ATOM 0 HA TRP A 43 17.665 5.908 6.008 1.00 0.00 H new ATOM 0 HB2 TRP A 43 16.383 4.930 3.443 1.00 0.00 H new ATOM 0 HB3 TRP A 43 17.491 6.285 3.364 1.00 0.00 H new ATOM 0 HD1 TRP A 43 19.318 4.591 5.819 1.00 0.00 H new ATOM 0 HE1 TRP A 43 21.034 2.914 4.883 1.00 0.00 H new ATOM 0 HE3 TRP A 43 17.335 4.008 1.146 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 21.440 1.529 2.491 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 18.448 2.469 -0.418 1.00 0.00 H new ATOM 0 HH2 TRP A 43 20.475 1.242 0.248 1.00 0.00 H new ATOM 643 N THR A 44 15.123 7.210 4.328 1.00 0.00 N ATOM 644 CA THR A 44 14.351 8.408 4.060 1.00 0.00 C ATOM 645 C THR A 44 13.675 8.968 5.311 1.00 0.00 C ATOM 646 O THR A 44 13.350 10.153 5.371 1.00 0.00 O ATOM 647 CB THR A 44 13.321 8.117 2.971 1.00 0.00 C ATOM 648 OG1 THR A 44 12.850 9.323 2.410 1.00 0.00 O ATOM 649 CG2 THR A 44 12.122 7.328 3.435 1.00 0.00 C ATOM 0 H THR A 44 14.843 6.403 3.771 1.00 0.00 H new ATOM 0 HA THR A 44 15.043 9.177 3.717 1.00 0.00 H new ATOM 0 HB THR A 44 13.852 7.506 2.242 1.00 0.00 H new ATOM 0 HG1 THR A 44 12.823 9.241 1.434 1.00 0.00 H new ATOM 0 HG21 THR A 44 11.445 7.169 2.596 1.00 0.00 H new ATOM 0 HG22 THR A 44 12.449 6.364 3.825 1.00 0.00 H new ATOM 0 HG23 THR A 44 11.604 7.880 4.219 1.00 0.00 H new ATOM 657 N SER A 45 13.469 8.117 6.305 1.00 0.00 N ATOM 658 CA SER A 45 12.836 8.550 7.544 1.00 0.00 C ATOM 659 C SER A 45 13.807 9.422 8.309 1.00 0.00 C ATOM 660 O SER A 45 13.450 10.486 8.817 1.00 0.00 O ATOM 661 CB SER A 45 12.388 7.351 8.384 1.00 0.00 C ATOM 662 OG SER A 45 13.436 6.871 9.209 1.00 0.00 O ATOM 0 H SER A 45 13.728 7.131 6.280 1.00 0.00 H new ATOM 0 HA SER A 45 11.940 9.126 7.311 1.00 0.00 H new ATOM 0 HB2 SER A 45 11.538 7.637 9.004 1.00 0.00 H new ATOM 0 HB3 SER A 45 12.047 6.552 7.726 1.00 0.00 H new ATOM 0 HG SER A 45 14.103 6.411 8.657 1.00 0.00 H new ATOM 668 N SER A 46 15.058 8.987 8.333 1.00 0.00 N ATOM 669 CA SER A 46 16.114 9.747 8.971 1.00 0.00 C ATOM 670 C SER A 46 16.316 11.039 8.191 1.00 0.00 C ATOM 671 O SER A 46 16.581 12.096 8.765 1.00 0.00 O ATOM 672 CB SER A 46 17.402 8.921 9.017 1.00 0.00 C ATOM 673 OG SER A 46 17.918 8.851 10.335 1.00 0.00 O ATOM 0 H SER A 46 15.364 8.108 7.915 1.00 0.00 H new ATOM 0 HA SER A 46 15.841 9.987 9.999 1.00 0.00 H new ATOM 0 HB2 SER A 46 17.206 7.915 8.646 1.00 0.00 H new ATOM 0 HB3 SER A 46 18.146 9.365 8.355 1.00 0.00 H new ATOM 0 HG SER A 46 18.739 8.317 10.337 1.00 0.00 H new ATOM 679 N CYS A 47 16.149 10.940 6.869 1.00 0.00 N ATOM 680 CA CYS A 47 16.268 12.085 5.978 1.00 0.00 C ATOM 681 C CYS A 47 15.242 13.118 6.385 1.00 0.00 C ATOM 682 O CYS A 47 15.539 14.298 6.513 1.00 0.00 O ATOM 683 CB CYS A 47 16.020 11.623 4.527 1.00 0.00 C ATOM 684 SG CYS A 47 15.340 12.859 3.378 1.00 0.00 S ATOM 0 H CYS A 47 15.929 10.065 6.393 1.00 0.00 H new ATOM 0 HA CYS A 47 17.265 12.521 6.042 1.00 0.00 H new ATOM 0 HB2 CYS A 47 16.964 11.263 4.119 1.00 0.00 H new ATOM 0 HB3 CYS A 47 15.339 10.772 4.553 1.00 0.00 H new ATOM 0 HG CYS A 47 14.801 12.255 2.361 1.00 0.00 H new ATOM 690 N LEU A 48 14.024 12.641 6.572 1.00 0.00 N ATOM 691 CA LEU A 48 12.921 13.491 6.953 1.00 0.00 C ATOM 692 C LEU A 48 13.205 14.182 8.266 1.00 0.00 C ATOM 693 O LEU A 48 12.868 15.354 8.441 1.00 0.00 O ATOM 694 CB LEU A 48 11.635 12.664 7.003 1.00 0.00 C ATOM 695 CG LEU A 48 10.773 12.738 5.737 1.00 0.00 C ATOM 696 CD1 LEU A 48 11.640 12.849 4.482 1.00 0.00 C ATOM 697 CD2 LEU A 48 9.846 11.529 5.649 1.00 0.00 C ATOM 0 H LEU A 48 13.777 11.657 6.463 1.00 0.00 H new ATOM 0 HA LEU A 48 12.791 14.276 6.208 1.00 0.00 H new ATOM 0 HB2 LEU A 48 11.897 11.622 7.187 1.00 0.00 H new ATOM 0 HB3 LEU A 48 11.038 12.997 7.852 1.00 0.00 H new ATOM 0 HG LEU A 48 10.162 13.638 5.799 1.00 0.00 H new ATOM 0 HD11 LEU A 48 11.000 12.900 3.601 1.00 0.00 H new ATOM 0 HD12 LEU A 48 12.250 13.751 4.540 1.00 0.00 H new ATOM 0 HD13 LEU A 48 12.289 11.976 4.410 1.00 0.00 H new ATOM 0 HD21 LEU A 48 9.242 11.599 4.744 1.00 0.00 H new ATOM 0 HD22 LEU A 48 10.441 10.616 5.619 1.00 0.00 H new ATOM 0 HD23 LEU A 48 9.192 11.508 6.521 1.00 0.00 H new ATOM 709 N GLU A 49 13.873 13.480 9.173 1.00 0.00 N ATOM 710 CA GLU A 49 14.235 14.096 10.430 1.00 0.00 C ATOM 711 C GLU A 49 15.431 15.013 10.216 1.00 0.00 C ATOM 712 O GLU A 49 15.546 16.059 10.848 1.00 0.00 O ATOM 713 CB GLU A 49 14.528 13.086 11.524 1.00 0.00 C ATOM 714 CG GLU A 49 14.453 13.733 12.892 1.00 0.00 C ATOM 715 CD GLU A 49 15.219 12.969 13.954 1.00 0.00 C ATOM 716 OE1 GLU A 49 16.427 13.238 14.124 1.00 0.00 O ATOM 717 OE2 GLU A 49 14.611 12.102 14.617 1.00 0.00 O ATOM 0 H GLU A 49 14.166 12.509 9.062 1.00 0.00 H new ATOM 0 HA GLU A 49 13.376 14.673 10.771 1.00 0.00 H new ATOM 0 HB2 GLU A 49 13.814 12.264 11.466 1.00 0.00 H new ATOM 0 HB3 GLU A 49 15.519 12.658 11.374 1.00 0.00 H new ATOM 0 HG2 GLU A 49 14.845 14.748 12.829 1.00 0.00 H new ATOM 0 HG3 GLU A 49 13.408 13.813 13.193 1.00 0.00 H new ATOM 724 N HIS A 50 16.306 14.623 9.290 1.00 0.00 N ATOM 725 CA HIS A 50 17.478 15.424 8.956 1.00 0.00 C ATOM 726 C HIS A 50 17.125 16.511 7.926 1.00 0.00 C ATOM 727 O HIS A 50 17.989 17.280 7.505 1.00 0.00 O ATOM 728 CB HIS A 50 18.592 14.531 8.410 1.00 0.00 C ATOM 729 CG HIS A 50 19.248 13.684 9.457 1.00 0.00 C ATOM 730 ND1 HIS A 50 20.012 14.207 10.478 1.00 0.00 N ATOM 731 CD2 HIS A 50 19.248 12.341 9.639 1.00 0.00 C ATOM 732 CE1 HIS A 50 20.456 13.225 11.242 1.00 0.00 C ATOM 733 NE2 HIS A 50 20.006 12.083 10.755 1.00 0.00 N ATOM 0 H HIS A 50 16.223 13.756 8.759 1.00 0.00 H new ATOM 0 HA HIS A 50 17.826 15.912 9.867 1.00 0.00 H new ATOM 0 HB2 HIS A 50 18.181 13.883 7.636 1.00 0.00 H new ATOM 0 HB3 HIS A 50 19.348 15.156 7.934 1.00 0.00 H new ATOM 0 HD2 HIS A 50 18.746 11.610 9.022 1.00 0.00 H new ATOM 0 HE1 HIS A 50 21.081 13.337 12.116 1.00 0.00 H new ATOM 0 HE2 HIS A 50 20.191 11.159 11.145 1.00 0.00 H new ATOM 742 N CYS A 51 15.844 16.582 7.545 1.00 0.00 N ATOM 743 CA CYS A 51 15.363 17.577 6.599 1.00 0.00 C ATOM 744 C CYS A 51 14.541 18.586 7.378 1.00 0.00 C ATOM 745 O CYS A 51 14.679 19.801 7.220 1.00 0.00 O ATOM 746 CB CYS A 51 14.504 16.917 5.499 1.00 0.00 C ATOM 747 SG CYS A 51 14.294 17.941 4.024 1.00 0.00 S ATOM 0 H CYS A 51 15.120 15.950 7.887 1.00 0.00 H new ATOM 0 HA CYS A 51 16.203 18.065 6.105 1.00 0.00 H new ATOM 0 HB2 CYS A 51 14.963 15.971 5.211 1.00 0.00 H new ATOM 0 HB3 CYS A 51 13.522 16.682 5.910 1.00 0.00 H new ATOM 0 HG CYS A 51 13.063 18.351 3.952 1.00 0.00 H new ATOM 753 N ILE A 52 13.705 18.045 8.256 1.00 0.00 N ATOM 754 CA ILE A 52 12.861 18.834 9.118 1.00 0.00 C ATOM 755 C ILE A 52 13.720 19.611 10.123 1.00 0.00 C ATOM 756 O ILE A 52 13.523 20.806 10.313 1.00 0.00 O ATOM 757 CB ILE A 52 11.845 17.906 9.836 1.00 0.00 C ATOM 758 CG1 ILE A 52 10.742 18.680 10.527 1.00 0.00 C ATOM 759 CG2 ILE A 52 12.527 16.992 10.830 1.00 0.00 C ATOM 760 CD1 ILE A 52 11.222 19.555 11.645 1.00 0.00 C ATOM 0 H ILE A 52 13.600 17.039 8.384 1.00 0.00 H new ATOM 0 HA ILE A 52 12.303 19.560 8.527 1.00 0.00 H new ATOM 0 HB ILE A 52 11.391 17.299 9.053 1.00 0.00 H new ATOM 0 HG12 ILE A 52 10.229 19.298 9.790 1.00 0.00 H new ATOM 0 HG13 ILE A 52 10.008 17.976 10.919 1.00 0.00 H new ATOM 0 HG21 ILE A 52 11.782 16.358 11.312 1.00 0.00 H new ATOM 0 HG22 ILE A 52 13.254 16.367 10.311 1.00 0.00 H new ATOM 0 HG23 ILE A 52 13.037 17.591 11.585 1.00 0.00 H new ATOM 0 HD11 ILE A 52 10.374 20.076 12.089 1.00 0.00 H new ATOM 0 HD12 ILE A 52 11.709 18.942 12.403 1.00 0.00 H new ATOM 0 HD13 ILE A 52 11.933 20.284 11.257 1.00 0.00 H new ATOM 772 N LYS A 53 14.681 18.926 10.750 1.00 0.00 N ATOM 773 CA LYS A 53 15.568 19.559 11.724 1.00 0.00 C ATOM 774 C LYS A 53 16.339 20.708 11.085 1.00 0.00 C ATOM 775 O LYS A 53 16.602 21.726 11.725 1.00 0.00 O ATOM 776 CB LYS A 53 16.558 18.536 12.304 1.00 0.00 C ATOM 777 CG LYS A 53 16.097 17.866 13.595 1.00 0.00 C ATOM 778 CD LYS A 53 14.697 17.291 13.475 1.00 0.00 C ATOM 779 CE LYS A 53 13.663 18.188 14.143 1.00 0.00 C ATOM 780 NZ LYS A 53 13.470 17.837 15.578 1.00 0.00 N ATOM 0 H LYS A 53 14.863 17.934 10.599 1.00 0.00 H new ATOM 0 HA LYS A 53 14.949 19.952 12.531 1.00 0.00 H new ATOM 0 HB2 LYS A 53 16.743 17.765 11.556 1.00 0.00 H new ATOM 0 HB3 LYS A 53 17.509 19.035 12.489 1.00 0.00 H new ATOM 0 HG2 LYS A 53 16.794 17.070 13.858 1.00 0.00 H new ATOM 0 HG3 LYS A 53 16.121 18.592 14.408 1.00 0.00 H new ATOM 0 HD2 LYS A 53 14.444 17.165 12.422 1.00 0.00 H new ATOM 0 HD3 LYS A 53 14.669 16.301 13.931 1.00 0.00 H new ATOM 0 HE2 LYS A 53 13.978 19.228 14.063 1.00 0.00 H new ATOM 0 HE3 LYS A 53 12.712 18.101 13.617 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 12.759 18.470 15.998 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 13.145 16.852 15.654 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 14.371 17.944 16.086 1.00 0.00 H new ATOM 794 N ARG A 54 16.696 20.536 9.818 1.00 0.00 N ATOM 795 CA ARG A 54 17.434 21.558 9.091 1.00 0.00 C ATOM 796 C ARG A 54 16.547 22.769 8.843 1.00 0.00 C ATOM 797 O ARG A 54 16.948 23.911 9.072 1.00 0.00 O ATOM 798 CB ARG A 54 17.950 20.993 7.764 1.00 0.00 C ATOM 799 CG ARG A 54 19.466 20.904 7.694 1.00 0.00 C ATOM 800 CD ARG A 54 20.120 22.250 7.967 1.00 0.00 C ATOM 801 NE ARG A 54 21.019 22.199 9.118 1.00 0.00 N ATOM 802 CZ ARG A 54 22.252 21.690 9.081 1.00 0.00 C ATOM 803 NH1 ARG A 54 22.743 21.184 7.954 1.00 0.00 N ATOM 804 NH2 ARG A 54 22.997 21.685 10.178 1.00 0.00 N ATOM 0 H ARG A 54 16.486 19.699 9.274 1.00 0.00 H new ATOM 0 HA ARG A 54 18.288 21.870 9.692 1.00 0.00 H new ATOM 0 HB2 ARG A 54 17.528 20.000 7.612 1.00 0.00 H new ATOM 0 HB3 ARG A 54 17.592 21.620 6.947 1.00 0.00 H new ATOM 0 HG2 ARG A 54 19.822 20.172 8.419 1.00 0.00 H new ATOM 0 HG3 ARG A 54 19.765 20.547 6.708 1.00 0.00 H new ATOM 0 HD2 ARG A 54 20.677 22.568 7.086 1.00 0.00 H new ATOM 0 HD3 ARG A 54 19.348 22.999 8.143 1.00 0.00 H new ATOM 0 HE ARG A 54 20.683 22.576 10.004 1.00 0.00 H new ATOM 0 HH11 ARG A 54 22.176 21.182 7.106 1.00 0.00 H new ATOM 0 HH12 ARG A 54 23.687 20.798 7.937 1.00 0.00 H new ATOM 0 HH21 ARG A 54 22.627 22.070 11.047 1.00 0.00 H new ATOM 0 HH22 ARG A 54 23.940 21.297 10.152 1.00 0.00 H new ATOM 818 N LEU A 55 15.336 22.503 8.377 1.00 0.00 N ATOM 819 CA LEU A 55 14.375 23.559 8.097 1.00 0.00 C ATOM 820 C LEU A 55 14.079 24.375 9.350 1.00 0.00 C ATOM 821 O LEU A 55 13.779 25.566 9.271 1.00 0.00 O ATOM 822 CB LEU A 55 13.098 22.950 7.524 1.00 0.00 C ATOM 823 CG LEU A 55 13.258 22.399 6.110 1.00 0.00 C ATOM 824 CD1 LEU A 55 11.964 21.784 5.612 1.00 0.00 C ATOM 825 CD2 LEU A 55 13.721 23.500 5.177 1.00 0.00 C ATOM 0 H LEU A 55 14.995 21.561 8.184 1.00 0.00 H new ATOM 0 HA LEU A 55 14.802 24.239 7.360 1.00 0.00 H new ATOM 0 HB2 LEU A 55 12.763 22.147 8.181 1.00 0.00 H new ATOM 0 HB3 LEU A 55 12.315 23.708 7.522 1.00 0.00 H new ATOM 0 HG LEU A 55 14.011 21.611 6.130 1.00 0.00 H new ATOM 0 HD11 LEU A 55 12.109 21.400 4.602 1.00 0.00 H new ATOM 0 HD12 LEU A 55 11.671 20.968 6.272 1.00 0.00 H new ATOM 0 HD13 LEU A 55 11.181 22.542 5.603 1.00 0.00 H new ATOM 0 HD21 LEU A 55 13.833 23.100 4.169 1.00 0.00 H new ATOM 0 HD22 LEU A 55 12.984 24.303 5.168 1.00 0.00 H new ATOM 0 HD23 LEU A 55 14.679 23.890 5.521 1.00 0.00 H new ATOM 837 N THR A 56 14.186 23.730 10.506 1.00 0.00 N ATOM 838 CA THR A 56 13.950 24.401 11.777 1.00 0.00 C ATOM 839 C THR A 56 15.153 25.262 12.136 1.00 0.00 C ATOM 840 O THR A 56 15.011 26.343 12.708 1.00 0.00 O ATOM 841 CB THR A 56 13.681 23.376 12.880 1.00 0.00 C ATOM 842 OG1 THR A 56 14.888 22.772 13.311 1.00 0.00 O ATOM 843 CG2 THR A 56 12.742 22.270 12.446 1.00 0.00 C ATOM 0 H THR A 56 14.434 22.744 10.588 1.00 0.00 H new ATOM 0 HA THR A 56 13.072 25.040 11.682 1.00 0.00 H new ATOM 0 HB THR A 56 13.212 23.936 13.689 1.00 0.00 H new ATOM 0 HG1 THR A 56 15.456 22.585 12.534 1.00 0.00 H new ATOM 0 HG21 THR A 56 12.591 21.575 13.272 1.00 0.00 H new ATOM 0 HG22 THR A 56 11.784 22.700 12.154 1.00 0.00 H new ATOM 0 HG23 THR A 56 13.174 21.737 11.599 1.00 0.00 H new ATOM 851 N ALA A 57 16.339 24.784 11.772 1.00 0.00 N ATOM 852 CA ALA A 57 17.570 25.515 12.028 1.00 0.00 C ATOM 853 C ALA A 57 17.605 26.782 11.185 1.00 0.00 C ATOM 854 O ALA A 57 18.109 27.820 11.614 1.00 0.00 O ATOM 855 CB ALA A 57 18.780 24.641 11.726 1.00 0.00 C ATOM 0 H ALA A 57 16.471 23.891 11.298 1.00 0.00 H new ATOM 0 HA ALA A 57 17.603 25.792 13.082 1.00 0.00 H new ATOM 0 HB1 ALA A 57 19.693 25.203 11.923 1.00 0.00 H new ATOM 0 HB2 ALA A 57 18.756 23.755 12.360 1.00 0.00 H new ATOM 0 HB3 ALA A 57 18.758 24.339 10.679 1.00 0.00 H new ATOM 861 N LEU A 58 17.054 26.683 9.979 1.00 0.00 N ATOM 862 CA LEU A 58 17.002 27.805 9.057 1.00 0.00 C ATOM 863 C LEU A 58 15.776 28.678 9.331 1.00 0.00 C ATOM 864 O LEU A 58 15.785 29.877 9.054 1.00 0.00 O ATOM 865 CB LEU A 58 16.973 27.280 7.621 1.00 0.00 C ATOM 866 CG LEU A 58 18.320 27.321 6.891 1.00 0.00 C ATOM 867 CD1 LEU A 58 18.520 26.062 6.057 1.00 0.00 C ATOM 868 CD2 LEU A 58 18.415 28.562 6.017 1.00 0.00 C ATOM 0 H LEU A 58 16.634 25.826 9.618 1.00 0.00 H new ATOM 0 HA LEU A 58 17.890 28.421 9.199 1.00 0.00 H new ATOM 0 HB2 LEU A 58 16.614 26.251 7.633 1.00 0.00 H new ATOM 0 HB3 LEU A 58 16.250 27.863 7.051 1.00 0.00 H new ATOM 0 HG LEU A 58 19.113 27.364 7.638 1.00 0.00 H new ATOM 0 HD11 LEU A 58 19.482 26.112 5.547 1.00 0.00 H new ATOM 0 HD12 LEU A 58 18.499 25.188 6.707 1.00 0.00 H new ATOM 0 HD13 LEU A 58 17.722 25.984 5.319 1.00 0.00 H new ATOM 0 HD21 LEU A 58 19.378 28.575 5.506 1.00 0.00 H new ATOM 0 HD22 LEU A 58 17.613 28.550 5.279 1.00 0.00 H new ATOM 0 HD23 LEU A 58 18.322 29.453 6.638 1.00 0.00 H new ATOM 880 N ASN A 59 14.719 28.062 9.872 1.00 0.00 N ATOM 881 CA ASN A 59 13.471 28.764 10.191 1.00 0.00 C ATOM 882 C ASN A 59 13.013 29.673 9.046 1.00 0.00 C ATOM 883 O ASN A 59 12.824 30.876 9.228 1.00 0.00 O ATOM 884 CB ASN A 59 13.625 29.571 11.487 1.00 0.00 C ATOM 885 CG ASN A 59 14.601 30.724 11.355 1.00 0.00 C ATOM 886 OD1 ASN A 59 14.211 31.851 11.050 1.00 0.00 O ATOM 887 ND2 ASN A 59 15.880 30.446 11.584 1.00 0.00 N ATOM 0 H ASN A 59 14.704 27.068 10.100 1.00 0.00 H new ATOM 0 HA ASN A 59 12.700 28.007 10.333 1.00 0.00 H new ATOM 0 HB2 ASN A 59 12.651 29.959 11.785 1.00 0.00 H new ATOM 0 HB3 ASN A 59 13.961 28.907 12.284 1.00 0.00 H new ATOM 0 HD21 ASN A 59 16.583 31.181 11.509 1.00 0.00 H new ATOM 0 HD22 ASN A 59 16.159 29.497 11.834 1.00 0.00 H new ATOM 894 N LYS A 60 12.834 29.083 7.867 1.00 0.00 N ATOM 895 CA LYS A 60 12.394 29.832 6.693 1.00 0.00 C ATOM 896 C LYS A 60 12.261 28.909 5.474 1.00 0.00 C ATOM 897 O LYS A 60 13.267 28.424 4.957 1.00 0.00 O ATOM 898 CB LYS A 60 13.380 30.961 6.380 1.00 0.00 C ATOM 899 CG LYS A 60 12.717 32.211 5.825 1.00 0.00 C ATOM 900 CD LYS A 60 13.740 33.181 5.258 1.00 0.00 C ATOM 901 CE LYS A 60 13.347 34.624 5.525 1.00 0.00 C ATOM 902 NZ LYS A 60 14.538 35.501 5.702 1.00 0.00 N ATOM 0 H LYS A 60 12.987 28.089 7.699 1.00 0.00 H new ATOM 0 HA LYS A 60 11.417 30.261 6.915 1.00 0.00 H new ATOM 0 HB2 LYS A 60 13.923 31.221 7.289 1.00 0.00 H new ATOM 0 HB3 LYS A 60 14.116 30.601 5.661 1.00 0.00 H new ATOM 0 HG2 LYS A 60 12.008 31.932 5.046 1.00 0.00 H new ATOM 0 HG3 LYS A 60 12.147 32.702 6.614 1.00 0.00 H new ATOM 0 HD2 LYS A 60 14.716 32.981 5.700 1.00 0.00 H new ATOM 0 HD3 LYS A 60 13.837 33.022 4.184 1.00 0.00 H new ATOM 0 HE2 LYS A 60 12.743 34.995 4.697 1.00 0.00 H new ATOM 0 HE3 LYS A 60 12.725 34.671 6.419 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 14.227 36.477 5.882 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 15.101 35.163 6.508 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 15.119 35.476 4.839 1.00 0.00 H new ATOM 916 N PRO A 61 11.023 28.646 4.990 1.00 0.00 N ATOM 917 CA PRO A 61 9.778 29.192 5.558 1.00 0.00 C ATOM 918 C PRO A 61 9.508 28.665 6.966 1.00 0.00 C ATOM 919 O PRO A 61 10.414 28.178 7.642 1.00 0.00 O ATOM 920 CB PRO A 61 8.689 28.716 4.591 1.00 0.00 C ATOM 921 CG PRO A 61 9.411 28.271 3.366 1.00 0.00 C ATOM 922 CD PRO A 61 10.751 27.783 3.833 1.00 0.00 C ATOM 0 HA PRO A 61 9.823 30.276 5.658 1.00 0.00 H new ATOM 0 HB2 PRO A 61 8.110 27.900 5.023 1.00 0.00 H new ATOM 0 HB3 PRO A 61 7.988 29.519 4.363 1.00 0.00 H new ATOM 0 HG2 PRO A 61 8.863 27.479 2.856 1.00 0.00 H new ATOM 0 HG3 PRO A 61 9.520 29.092 2.657 1.00 0.00 H new ATOM 0 HD2 PRO A 61 10.724 26.729 4.111 1.00 0.00 H new ATOM 0 HD3 PRO A 61 11.513 27.889 3.060 1.00 0.00 H new ATOM 930 N PHE A 62 8.254 28.763 7.400 1.00 0.00 N ATOM 931 CA PHE A 62 7.865 28.296 8.726 1.00 0.00 C ATOM 932 C PHE A 62 7.197 26.926 8.645 1.00 0.00 C ATOM 933 O PHE A 62 7.713 25.941 9.174 1.00 0.00 O ATOM 934 CB PHE A 62 6.922 29.304 9.386 1.00 0.00 C ATOM 935 CG PHE A 62 7.221 29.541 10.839 1.00 0.00 C ATOM 936 CD1 PHE A 62 8.267 30.368 11.218 1.00 0.00 C ATOM 937 CD2 PHE A 62 6.456 28.939 11.825 1.00 0.00 C ATOM 938 CE1 PHE A 62 8.545 30.588 12.553 1.00 0.00 C ATOM 939 CE2 PHE A 62 6.729 29.155 13.162 1.00 0.00 C ATOM 940 CZ PHE A 62 7.775 29.981 13.527 1.00 0.00 C ATOM 0 H PHE A 62 7.491 29.161 6.853 1.00 0.00 H new ATOM 0 HA PHE A 62 8.766 28.203 9.333 1.00 0.00 H new ATOM 0 HB2 PHE A 62 6.984 30.252 8.851 1.00 0.00 H new ATOM 0 HB3 PHE A 62 5.896 28.949 9.287 1.00 0.00 H new ATOM 0 HD1 PHE A 62 8.871 30.846 10.461 1.00 0.00 H new ATOM 0 HD2 PHE A 62 5.637 28.293 11.545 1.00 0.00 H new ATOM 0 HE1 PHE A 62 9.363 31.234 12.835 1.00 0.00 H new ATOM 0 HE2 PHE A 62 6.126 28.679 13.921 1.00 0.00 H new ATOM 0 HZ PHE A 62 7.990 30.152 14.571 1.00 0.00 H new ATOM 950 N LYS A 63 6.047 26.869 7.980 1.00 0.00 N ATOM 951 CA LYS A 63 5.310 25.620 7.830 1.00 0.00 C ATOM 952 C LYS A 63 5.825 24.827 6.633 1.00 0.00 C ATOM 953 O LYS A 63 5.547 25.164 5.481 1.00 0.00 O ATOM 954 CB LYS A 63 3.816 25.901 7.665 1.00 0.00 C ATOM 955 CG LYS A 63 2.942 24.670 7.842 1.00 0.00 C ATOM 956 CD LYS A 63 1.534 25.045 8.273 1.00 0.00 C ATOM 957 CE LYS A 63 0.733 25.624 7.118 1.00 0.00 C ATOM 958 NZ LYS A 63 -0.454 26.387 7.592 1.00 0.00 N ATOM 0 H LYS A 63 5.606 27.674 7.536 1.00 0.00 H new ATOM 0 HA LYS A 63 5.463 25.026 8.731 1.00 0.00 H new ATOM 0 HB2 LYS A 63 3.515 26.657 8.390 1.00 0.00 H new ATOM 0 HB3 LYS A 63 3.641 26.321 6.675 1.00 0.00 H new ATOM 0 HG2 LYS A 63 2.901 24.114 6.906 1.00 0.00 H new ATOM 0 HG3 LYS A 63 3.388 24.010 8.586 1.00 0.00 H new ATOM 0 HD2 LYS A 63 1.025 24.164 8.664 1.00 0.00 H new ATOM 0 HD3 LYS A 63 1.582 25.772 9.084 1.00 0.00 H new ATOM 0 HE2 LYS A 63 1.372 26.279 6.525 1.00 0.00 H new ATOM 0 HE3 LYS A 63 0.407 24.817 6.462 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -1.054 26.635 6.780 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -0.998 25.804 8.259 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -0.140 27.257 8.068 1.00 0.00 H new ATOM 972 N TYR A 64 6.583 23.772 6.904 1.00 0.00 N ATOM 973 CA TYR A 64 7.134 22.949 5.833 1.00 0.00 C ATOM 974 C TYR A 64 6.876 21.466 6.077 1.00 0.00 C ATOM 975 O TYR A 64 6.966 20.985 7.206 1.00 0.00 O ATOM 976 CB TYR A 64 8.640 23.197 5.675 1.00 0.00 C ATOM 977 CG TYR A 64 9.363 23.468 6.976 1.00 0.00 C ATOM 978 CD1 TYR A 64 9.824 22.425 7.769 1.00 0.00 C ATOM 979 CD2 TYR A 64 9.579 24.770 7.412 1.00 0.00 C ATOM 980 CE1 TYR A 64 10.480 22.672 8.959 1.00 0.00 C ATOM 981 CE2 TYR A 64 10.233 25.024 8.601 1.00 0.00 C ATOM 982 CZ TYR A 64 10.682 23.971 9.371 1.00 0.00 C ATOM 983 OH TYR A 64 11.332 24.221 10.556 1.00 0.00 O ATOM 0 H TYR A 64 6.829 23.468 7.846 1.00 0.00 H new ATOM 0 HA TYR A 64 6.628 23.236 4.911 1.00 0.00 H new ATOM 0 HB2 TYR A 64 9.092 22.329 5.195 1.00 0.00 H new ATOM 0 HB3 TYR A 64 8.789 24.044 5.006 1.00 0.00 H new ATOM 0 HD1 TYR A 64 9.667 21.405 7.450 1.00 0.00 H new ATOM 0 HD2 TYR A 64 9.230 25.596 6.811 1.00 0.00 H new ATOM 0 HE1 TYR A 64 10.833 21.850 9.564 1.00 0.00 H new ATOM 0 HE2 TYR A 64 10.392 26.041 8.927 1.00 0.00 H new ATOM 0 HH TYR A 64 10.769 23.934 11.305 1.00 0.00 H new ATOM 993 N VAL A 65 6.575 20.743 5.003 1.00 0.00 N ATOM 994 CA VAL A 65 6.326 19.308 5.086 1.00 0.00 C ATOM 995 C VAL A 65 7.471 18.556 4.429 1.00 0.00 C ATOM 996 O VAL A 65 8.089 19.054 3.488 1.00 0.00 O ATOM 997 CB VAL A 65 4.997 18.849 4.413 1.00 0.00 C ATOM 998 CG1 VAL A 65 4.262 17.862 5.303 1.00 0.00 C ATOM 999 CG2 VAL A 65 4.088 20.008 4.052 1.00 0.00 C ATOM 0 H VAL A 65 6.497 21.129 4.062 1.00 0.00 H new ATOM 0 HA VAL A 65 6.243 19.084 6.149 1.00 0.00 H new ATOM 0 HB VAL A 65 5.273 18.359 3.479 1.00 0.00 H new ATOM 0 HG11 VAL A 65 3.337 17.553 4.817 1.00 0.00 H new ATOM 0 HG12 VAL A 65 4.891 16.989 5.475 1.00 0.00 H new ATOM 0 HG13 VAL A 65 4.030 18.335 6.257 1.00 0.00 H new ATOM 0 HG21 VAL A 65 3.179 19.626 3.587 1.00 0.00 H new ATOM 0 HG22 VAL A 65 3.829 20.562 4.954 1.00 0.00 H new ATOM 0 HG23 VAL A 65 4.602 20.670 3.355 1.00 0.00 H new ATOM 1009 N VAL A 66 7.756 17.361 4.919 1.00 0.00 N ATOM 1010 CA VAL A 66 8.833 16.562 4.355 1.00 0.00 C ATOM 1011 C VAL A 66 8.398 15.122 4.117 1.00 0.00 C ATOM 1012 O VAL A 66 8.288 14.341 5.055 1.00 0.00 O ATOM 1013 CB VAL A 66 10.089 16.565 5.257 1.00 0.00 C ATOM 1014 CG1 VAL A 66 11.316 16.201 4.442 1.00 0.00 C ATOM 1015 CG2 VAL A 66 10.285 17.916 5.936 1.00 0.00 C ATOM 0 H VAL A 66 7.263 16.925 5.698 1.00 0.00 H new ATOM 0 HA VAL A 66 9.083 17.024 3.400 1.00 0.00 H new ATOM 0 HB VAL A 66 9.944 15.819 6.039 1.00 0.00 H new ATOM 0 HG11 VAL A 66 12.195 16.206 5.086 1.00 0.00 H new ATOM 0 HG12 VAL A 66 11.186 15.208 4.013 1.00 0.00 H new ATOM 0 HG13 VAL A 66 11.449 16.928 3.641 1.00 0.00 H new ATOM 0 HG21 VAL A 66 11.177 17.883 6.562 1.00 0.00 H new ATOM 0 HG22 VAL A 66 10.403 18.690 5.178 1.00 0.00 H new ATOM 0 HG23 VAL A 66 9.416 18.142 6.554 1.00 0.00 H new ATOM 1025 N THR A 67 8.153 14.767 2.861 1.00 0.00 N ATOM 1026 CA THR A 67 7.746 13.394 2.536 1.00 0.00 C ATOM 1027 C THR A 67 8.602 12.801 1.423 1.00 0.00 C ATOM 1028 O THR A 67 9.216 13.524 0.644 1.00 0.00 O ATOM 1029 CB THR A 67 6.275 13.330 2.139 1.00 0.00 C ATOM 1030 OG1 THR A 67 5.939 12.034 1.676 1.00 0.00 O ATOM 1031 CG2 THR A 67 5.915 14.309 1.053 1.00 0.00 C ATOM 0 H THR A 67 8.226 15.394 2.060 1.00 0.00 H new ATOM 0 HA THR A 67 7.894 12.802 3.439 1.00 0.00 H new ATOM 0 HB THR A 67 5.717 13.585 3.040 1.00 0.00 H new ATOM 0 HG1 THR A 67 6.279 11.364 2.305 1.00 0.00 H new ATOM 0 HG21 THR A 67 4.856 14.215 0.815 1.00 0.00 H new ATOM 0 HG22 THR A 67 6.121 15.323 1.394 1.00 0.00 H new ATOM 0 HG23 THR A 67 6.507 14.098 0.162 1.00 0.00 H new ATOM 1039 N CYS A 68 8.632 11.472 1.365 1.00 0.00 N ATOM 1040 CA CYS A 68 9.404 10.756 0.356 1.00 0.00 C ATOM 1041 C CYS A 68 8.761 9.406 0.050 1.00 0.00 C ATOM 1042 O CYS A 68 8.052 8.838 0.876 1.00 0.00 O ATOM 1043 CB CYS A 68 10.852 10.549 0.823 1.00 0.00 C ATOM 1044 SG CYS A 68 11.864 9.531 -0.290 1.00 0.00 S ATOM 0 H CYS A 68 8.126 10.866 2.011 1.00 0.00 H new ATOM 0 HA CYS A 68 9.413 11.359 -0.552 1.00 0.00 H new ATOM 0 HB2 CYS A 68 11.327 11.524 0.936 1.00 0.00 H new ATOM 0 HB3 CYS A 68 10.840 10.084 1.809 1.00 0.00 H new ATOM 0 HG CYS A 68 12.934 10.188 -0.627 1.00 0.00 H new ATOM 1050 N ILE A 69 9.031 8.901 -1.142 1.00 0.00 N ATOM 1051 CA ILE A 69 8.508 7.618 -1.578 1.00 0.00 C ATOM 1052 C ILE A 69 9.650 6.774 -2.152 1.00 0.00 C ATOM 1053 O ILE A 69 10.327 7.187 -3.097 1.00 0.00 O ATOM 1054 CB ILE A 69 7.384 7.819 -2.624 1.00 0.00 C ATOM 1055 CG1 ILE A 69 6.165 8.468 -1.967 1.00 0.00 C ATOM 1056 CG2 ILE A 69 6.986 6.511 -3.296 1.00 0.00 C ATOM 1057 CD1 ILE A 69 6.356 9.937 -1.656 1.00 0.00 C ATOM 0 H ILE A 69 9.618 9.368 -1.833 1.00 0.00 H new ATOM 0 HA ILE A 69 8.076 7.093 -0.726 1.00 0.00 H new ATOM 0 HB ILE A 69 7.773 8.478 -3.400 1.00 0.00 H new ATOM 0 HG12 ILE A 69 5.304 8.353 -2.625 1.00 0.00 H new ATOM 0 HG13 ILE A 69 5.934 7.937 -1.044 1.00 0.00 H new ATOM 0 HG21 ILE A 69 6.195 6.701 -4.022 1.00 0.00 H new ATOM 0 HG22 ILE A 69 7.851 6.086 -3.805 1.00 0.00 H new ATOM 0 HG23 ILE A 69 6.627 5.810 -2.543 1.00 0.00 H new ATOM 0 HD11 ILE A 69 5.452 10.331 -1.192 1.00 0.00 H new ATOM 0 HD12 ILE A 69 7.197 10.058 -0.973 1.00 0.00 H new ATOM 0 HD13 ILE A 69 6.557 10.481 -2.579 1.00 0.00 H new ATOM 1069 N ILE A 70 9.874 5.606 -1.559 1.00 0.00 N ATOM 1070 CA ILE A 70 10.947 4.720 -1.995 1.00 0.00 C ATOM 1071 C ILE A 70 10.564 3.924 -3.237 1.00 0.00 C ATOM 1072 O ILE A 70 9.410 3.533 -3.410 1.00 0.00 O ATOM 1073 CB ILE A 70 11.350 3.736 -0.878 1.00 0.00 C ATOM 1074 CG1 ILE A 70 10.147 2.885 -0.451 1.00 0.00 C ATOM 1075 CG2 ILE A 70 11.927 4.493 0.310 1.00 0.00 C ATOM 1076 CD1 ILE A 70 10.429 1.399 -0.462 1.00 0.00 C ATOM 0 H ILE A 70 9.327 5.251 -0.775 1.00 0.00 H new ATOM 0 HA ILE A 70 11.792 5.364 -2.238 1.00 0.00 H new ATOM 0 HB ILE A 70 12.119 3.066 -1.264 1.00 0.00 H new ATOM 0 HG12 ILE A 70 9.839 3.182 0.552 1.00 0.00 H new ATOM 0 HG13 ILE A 70 9.309 3.093 -1.116 1.00 0.00 H new ATOM 0 HG21 ILE A 70 12.207 3.786 1.091 1.00 0.00 H new ATOM 0 HG22 ILE A 70 12.808 5.051 -0.007 1.00 0.00 H new ATOM 0 HG23 ILE A 70 11.180 5.185 0.698 1.00 0.00 H new ATOM 0 HD11 ILE A 70 9.536 0.857 -0.150 1.00 0.00 H new ATOM 0 HD12 ILE A 70 10.708 1.089 -1.469 1.00 0.00 H new ATOM 0 HD13 ILE A 70 11.246 1.179 0.225 1.00 0.00 H new ATOM 1088 N MET A 71 11.553 3.681 -4.091 1.00 0.00 N ATOM 1089 CA MET A 71 11.346 2.922 -5.318 1.00 0.00 C ATOM 1090 C MET A 71 12.286 1.720 -5.360 1.00 0.00 C ATOM 1091 O MET A 71 13.422 1.821 -5.827 1.00 0.00 O ATOM 1092 CB MET A 71 11.568 3.819 -6.542 1.00 0.00 C ATOM 1093 CG MET A 71 10.287 4.161 -7.285 1.00 0.00 C ATOM 1094 SD MET A 71 10.590 4.703 -8.977 1.00 0.00 S ATOM 1095 CE MET A 71 10.895 3.135 -9.786 1.00 0.00 C ATOM 0 H MET A 71 12.512 4.001 -3.954 1.00 0.00 H new ATOM 0 HA MET A 71 10.318 2.560 -5.336 1.00 0.00 H new ATOM 0 HB2 MET A 71 12.051 4.743 -6.223 1.00 0.00 H new ATOM 0 HB3 MET A 71 12.254 3.321 -7.227 1.00 0.00 H new ATOM 0 HG2 MET A 71 9.635 3.288 -7.299 1.00 0.00 H new ATOM 0 HG3 MET A 71 9.757 4.946 -6.745 1.00 0.00 H new ATOM 0 HE1 MET A 71 11.082 3.303 -10.847 1.00 0.00 H new ATOM 0 HE2 MET A 71 11.765 2.656 -9.336 1.00 0.00 H new ATOM 0 HE3 MET A 71 10.024 2.490 -9.669 1.00 0.00 H new ATOM 1105 N GLN A 72 11.808 0.583 -4.859 1.00 0.00 N ATOM 1106 CA GLN A 72 12.602 -0.644 -4.827 1.00 0.00 C ATOM 1107 C GLN A 72 13.121 -1.012 -6.214 1.00 0.00 C ATOM 1108 O GLN A 72 12.512 -0.671 -7.228 1.00 0.00 O ATOM 1109 CB GLN A 72 11.772 -1.796 -4.257 1.00 0.00 C ATOM 1110 CG GLN A 72 12.559 -2.721 -3.345 1.00 0.00 C ATOM 1111 CD GLN A 72 11.667 -3.554 -2.448 1.00 0.00 C ATOM 1112 OE1 GLN A 72 10.819 -4.308 -2.924 1.00 0.00 O ATOM 1113 NE2 GLN A 72 11.853 -3.423 -1.139 1.00 0.00 N ATOM 0 H GLN A 72 10.871 0.486 -4.468 1.00 0.00 H new ATOM 0 HA GLN A 72 13.463 -0.465 -4.182 1.00 0.00 H new ATOM 0 HB2 GLN A 72 10.928 -1.385 -3.703 1.00 0.00 H new ATOM 0 HB3 GLN A 72 11.359 -2.378 -5.081 1.00 0.00 H new ATOM 0 HG2 GLN A 72 13.177 -3.383 -3.951 1.00 0.00 H new ATOM 0 HG3 GLN A 72 13.235 -2.128 -2.729 1.00 0.00 H new ATOM 0 HE21 GLN A 72 12.568 -2.786 -0.787 1.00 0.00 H new ATOM 0 HE22 GLN A 72 11.281 -3.959 -0.486 1.00 0.00 H new ATOM 1122 N LYS A 73 14.252 -1.709 -6.248 1.00 0.00 N ATOM 1123 CA LYS A 73 14.860 -2.128 -7.506 1.00 0.00 C ATOM 1124 C LYS A 73 13.910 -3.016 -8.303 1.00 0.00 C ATOM 1125 O LYS A 73 13.961 -4.243 -8.206 1.00 0.00 O ATOM 1126 CB LYS A 73 16.167 -2.875 -7.237 1.00 0.00 C ATOM 1127 CG LYS A 73 16.970 -3.174 -8.496 1.00 0.00 C ATOM 1128 CD LYS A 73 16.802 -4.621 -8.943 1.00 0.00 C ATOM 1129 CE LYS A 73 15.978 -4.725 -10.218 1.00 0.00 C ATOM 1130 NZ LYS A 73 15.317 -6.053 -10.346 1.00 0.00 N ATOM 0 H LYS A 73 14.767 -1.996 -5.416 1.00 0.00 H new ATOM 0 HA LYS A 73 15.071 -1.235 -8.094 1.00 0.00 H new ATOM 0 HB2 LYS A 73 16.780 -2.283 -6.557 1.00 0.00 H new ATOM 0 HB3 LYS A 73 15.942 -3.813 -6.729 1.00 0.00 H new ATOM 0 HG2 LYS A 73 16.652 -2.507 -9.297 1.00 0.00 H new ATOM 0 HG3 LYS A 73 18.025 -2.971 -8.311 1.00 0.00 H new ATOM 0 HD2 LYS A 73 17.783 -5.067 -9.106 1.00 0.00 H new ATOM 0 HD3 LYS A 73 16.320 -5.193 -8.150 1.00 0.00 H new ATOM 0 HE2 LYS A 73 15.221 -3.941 -10.226 1.00 0.00 H new ATOM 0 HE3 LYS A 73 16.622 -4.555 -11.081 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 14.766 -6.083 -11.227 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 16.040 -6.800 -10.364 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 14.683 -6.205 -9.536 1.00 0.00 H new ATOM 1144 N ASN A 74 13.047 -2.388 -9.094 1.00 0.00 N ATOM 1145 CA ASN A 74 12.089 -3.119 -9.914 1.00 0.00 C ATOM 1146 C ASN A 74 11.385 -2.180 -10.888 1.00 0.00 C ATOM 1147 O ASN A 74 10.638 -1.290 -10.480 1.00 0.00 O ATOM 1148 CB ASN A 74 11.061 -3.833 -9.031 1.00 0.00 C ATOM 1149 CG ASN A 74 10.221 -2.869 -8.216 1.00 0.00 C ATOM 1150 OD1 ASN A 74 10.672 -2.336 -7.204 1.00 0.00 O ATOM 1151 ND2 ASN A 74 8.987 -2.644 -8.652 1.00 0.00 N ATOM 0 H ASN A 74 12.992 -1.374 -9.184 1.00 0.00 H new ATOM 0 HA ASN A 74 12.635 -3.867 -10.489 1.00 0.00 H new ATOM 0 HB2 ASN A 74 10.407 -4.438 -9.659 1.00 0.00 H new ATOM 0 HB3 ASN A 74 11.578 -4.517 -8.358 1.00 0.00 H new ATOM 0 HD21 ASN A 74 8.374 -2.008 -8.142 1.00 0.00 H new ATOM 0 HD22 ASN A 74 8.652 -3.107 -9.497 1.00 0.00 H new ATOM 1158 N GLY A 75 11.635 -2.381 -12.177 1.00 0.00 N ATOM 1159 CA GLY A 75 11.025 -1.541 -13.192 1.00 0.00 C ATOM 1160 C GLY A 75 9.516 -1.683 -13.237 1.00 0.00 C ATOM 1161 O GLY A 75 8.988 -2.576 -13.899 1.00 0.00 O ATOM 0 H GLY A 75 12.249 -3.111 -12.538 1.00 0.00 H new ATOM 0 HA2 GLY A 75 11.283 -0.500 -12.999 1.00 0.00 H new ATOM 0 HA3 GLY A 75 11.440 -1.797 -14.167 1.00 0.00 H new ATOM 1165 N ALA A 76 8.823 -0.798 -12.530 1.00 0.00 N ATOM 1166 CA ALA A 76 7.366 -0.820 -12.488 1.00 0.00 C ATOM 1167 C ALA A 76 6.797 0.589 -12.603 1.00 0.00 C ATOM 1168 O ALA A 76 7.338 1.535 -12.030 1.00 0.00 O ATOM 1169 CB ALA A 76 6.885 -1.484 -11.208 1.00 0.00 C ATOM 0 H ALA A 76 9.248 -0.054 -11.977 1.00 0.00 H new ATOM 0 HA ALA A 76 7.009 -1.400 -13.339 1.00 0.00 H new ATOM 0 HB1 ALA A 76 5.795 -1.493 -11.190 1.00 0.00 H new ATOM 0 HB2 ALA A 76 7.257 -2.508 -11.167 1.00 0.00 H new ATOM 0 HB3 ALA A 76 7.257 -0.928 -10.348 1.00 0.00 H new ATOM 1175 N GLY A 77 5.705 0.724 -13.349 1.00 0.00 N ATOM 1176 CA GLY A 77 5.088 2.026 -13.523 1.00 0.00 C ATOM 1177 C GLY A 77 4.534 2.583 -12.226 1.00 0.00 C ATOM 1178 O GLY A 77 3.525 2.097 -11.714 1.00 0.00 O ATOM 0 H GLY A 77 5.238 -0.042 -13.834 1.00 0.00 H new ATOM 0 HA2 GLY A 77 5.823 2.721 -13.929 1.00 0.00 H new ATOM 0 HA3 GLY A 77 4.284 1.949 -14.255 1.00 0.00 H new ATOM 1182 N LEU A 78 5.197 3.605 -11.695 1.00 0.00 N ATOM 1183 CA LEU A 78 4.770 4.232 -10.449 1.00 0.00 C ATOM 1184 C LEU A 78 4.299 5.661 -10.696 1.00 0.00 C ATOM 1185 O LEU A 78 5.109 6.566 -10.896 1.00 0.00 O ATOM 1186 CB LEU A 78 5.916 4.229 -9.433 1.00 0.00 C ATOM 1187 CG LEU A 78 5.608 4.921 -8.105 1.00 0.00 C ATOM 1188 CD1 LEU A 78 4.784 4.010 -7.206 1.00 0.00 C ATOM 1189 CD2 LEU A 78 6.896 5.333 -7.409 1.00 0.00 C ATOM 0 H LEU A 78 6.033 4.017 -12.109 1.00 0.00 H new ATOM 0 HA LEU A 78 3.936 3.656 -10.047 1.00 0.00 H new ATOM 0 HB2 LEU A 78 6.198 3.196 -9.230 1.00 0.00 H new ATOM 0 HB3 LEU A 78 6.782 4.713 -9.884 1.00 0.00 H new ATOM 0 HG LEU A 78 5.025 5.818 -8.312 1.00 0.00 H new ATOM 0 HD11 LEU A 78 4.575 4.520 -6.265 1.00 0.00 H new ATOM 0 HD12 LEU A 78 3.845 3.762 -7.701 1.00 0.00 H new ATOM 0 HD13 LEU A 78 5.341 3.095 -7.006 1.00 0.00 H new ATOM 0 HD21 LEU A 78 6.659 5.824 -6.465 1.00 0.00 H new ATOM 0 HD22 LEU A 78 7.504 4.449 -7.215 1.00 0.00 H new ATOM 0 HD23 LEU A 78 7.450 6.021 -8.047 1.00 0.00 H new ATOM 1201 N HIS A 79 2.984 5.858 -10.681 1.00 0.00 N ATOM 1202 CA HIS A 79 2.407 7.178 -10.905 1.00 0.00 C ATOM 1203 C HIS A 79 1.572 7.620 -9.707 1.00 0.00 C ATOM 1204 O HIS A 79 0.831 6.828 -9.125 1.00 0.00 O ATOM 1205 CB HIS A 79 1.543 7.173 -12.168 1.00 0.00 C ATOM 1206 CG HIS A 79 2.316 7.447 -13.420 1.00 0.00 C ATOM 1207 ND1 HIS A 79 3.013 6.471 -14.102 1.00 0.00 N ATOM 1208 CD2 HIS A 79 2.503 8.595 -14.114 1.00 0.00 C ATOM 1209 CE1 HIS A 79 3.594 7.008 -15.161 1.00 0.00 C ATOM 1210 NE2 HIS A 79 3.299 8.294 -15.191 1.00 0.00 N ATOM 0 H HIS A 79 2.299 5.120 -10.516 1.00 0.00 H new ATOM 0 HA HIS A 79 3.226 7.886 -11.035 1.00 0.00 H new ATOM 0 HB2 HIS A 79 1.051 6.205 -12.259 1.00 0.00 H new ATOM 0 HB3 HIS A 79 0.757 7.921 -12.064 1.00 0.00 H new ATOM 0 HD2 HIS A 79 2.101 9.566 -13.866 1.00 0.00 H new ATOM 0 HE1 HIS A 79 4.206 6.483 -15.880 1.00 0.00 H new ATOM 0 HE2 HIS A 79 3.612 8.957 -15.900 1.00 0.00 H new ATOM 1219 N THR A 80 1.701 8.892 -9.346 1.00 0.00 N ATOM 1220 CA THR A 80 0.961 9.450 -8.220 1.00 0.00 C ATOM 1221 C THR A 80 -0.092 10.440 -8.703 1.00 0.00 C ATOM 1222 O THR A 80 0.056 11.046 -9.764 1.00 0.00 O ATOM 1223 CB THR A 80 1.919 10.141 -7.246 1.00 0.00 C ATOM 1224 OG1 THR A 80 3.022 9.302 -6.949 1.00 0.00 O ATOM 1225 CG2 THR A 80 1.266 10.524 -5.936 1.00 0.00 C ATOM 0 H THR A 80 2.313 9.558 -9.818 1.00 0.00 H new ATOM 0 HA THR A 80 0.458 8.632 -7.704 1.00 0.00 H new ATOM 0 HB THR A 80 2.241 11.051 -7.752 1.00 0.00 H new ATOM 0 HG1 THR A 80 3.624 9.761 -6.327 1.00 0.00 H new ATOM 0 HG21 THR A 80 2.000 11.009 -5.292 1.00 0.00 H new ATOM 0 HG22 THR A 80 0.441 11.210 -6.128 1.00 0.00 H new ATOM 0 HG23 THR A 80 0.886 9.629 -5.443 1.00 0.00 H new ATOM 1233 N ALA A 81 -1.153 10.606 -7.920 1.00 0.00 N ATOM 1234 CA ALA A 81 -2.223 11.531 -8.275 1.00 0.00 C ATOM 1235 C ALA A 81 -2.533 12.444 -7.103 1.00 0.00 C ATOM 1236 O ALA A 81 -2.531 12.004 -5.955 1.00 0.00 O ATOM 1237 CB ALA A 81 -3.473 10.773 -8.700 1.00 0.00 C ATOM 0 H ALA A 81 -1.295 10.114 -7.038 1.00 0.00 H new ATOM 0 HA ALA A 81 -1.890 12.138 -9.117 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -4.258 11.483 -8.960 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -3.245 10.151 -9.565 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -3.812 10.142 -7.879 1.00 0.00 H new ATOM 1243 N ALA A 82 -2.784 13.717 -7.382 1.00 0.00 N ATOM 1244 CA ALA A 82 -3.075 14.655 -6.311 1.00 0.00 C ATOM 1245 C ALA A 82 -3.815 15.896 -6.784 1.00 0.00 C ATOM 1246 O ALA A 82 -3.306 16.683 -7.583 1.00 0.00 O ATOM 1247 CB ALA A 82 -1.795 15.041 -5.600 1.00 0.00 C ATOM 0 H ALA A 82 -2.792 14.116 -8.321 1.00 0.00 H new ATOM 0 HA ALA A 82 -3.744 14.145 -5.618 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -2.022 15.744 -4.799 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -1.329 14.150 -5.180 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -1.111 15.507 -6.309 1.00 0.00 H new ATOM 1253 N SER A 83 -5.008 16.075 -6.235 1.00 0.00 N ATOM 1254 CA SER A 83 -5.835 17.229 -6.529 1.00 0.00 C ATOM 1255 C SER A 83 -6.114 17.957 -5.223 1.00 0.00 C ATOM 1256 O SER A 83 -6.721 17.397 -4.311 1.00 0.00 O ATOM 1257 CB SER A 83 -7.145 16.793 -7.189 1.00 0.00 C ATOM 1258 OG SER A 83 -7.777 17.882 -7.839 1.00 0.00 O ATOM 0 H SER A 83 -5.427 15.422 -5.573 1.00 0.00 H new ATOM 0 HA SER A 83 -5.318 17.892 -7.223 1.00 0.00 H new ATOM 0 HB2 SER A 83 -6.946 16.001 -7.911 1.00 0.00 H new ATOM 0 HB3 SER A 83 -7.814 16.377 -6.436 1.00 0.00 H new ATOM 0 HG SER A 83 -8.611 17.576 -8.254 1.00 0.00 H new ATOM 1264 N CYS A 84 -5.641 19.190 -5.119 1.00 0.00 N ATOM 1265 CA CYS A 84 -5.816 19.962 -3.896 1.00 0.00 C ATOM 1266 C CYS A 84 -6.840 21.072 -4.065 1.00 0.00 C ATOM 1267 O CYS A 84 -7.080 21.556 -5.170 1.00 0.00 O ATOM 1268 CB CYS A 84 -4.484 20.560 -3.450 1.00 0.00 C ATOM 1269 SG CYS A 84 -3.080 19.422 -3.548 1.00 0.00 S ATOM 0 H CYS A 84 -5.136 19.676 -5.861 1.00 0.00 H new ATOM 0 HA CYS A 84 -6.185 19.276 -3.133 1.00 0.00 H new ATOM 0 HB2 CYS A 84 -4.270 21.435 -4.063 1.00 0.00 H new ATOM 0 HB3 CYS A 84 -4.582 20.908 -2.422 1.00 0.00 H new ATOM 0 HG CYS A 84 -2.001 20.028 -3.150 1.00 0.00 H new ATOM 1275 N TRP A 85 -7.430 21.475 -2.947 1.00 0.00 N ATOM 1276 CA TRP A 85 -8.424 22.539 -2.946 1.00 0.00 C ATOM 1277 C TRP A 85 -7.728 23.895 -3.098 1.00 0.00 C ATOM 1278 O TRP A 85 -6.608 23.961 -3.604 1.00 0.00 O ATOM 1279 CB TRP A 85 -9.230 22.490 -1.644 1.00 0.00 C ATOM 1280 CG TRP A 85 -10.692 22.727 -1.843 1.00 0.00 C ATOM 1281 CD1 TRP A 85 -11.537 21.995 -2.623 1.00 0.00 C ATOM 1282 CD2 TRP A 85 -11.484 23.764 -1.253 1.00 0.00 C ATOM 1283 NE1 TRP A 85 -12.807 22.507 -2.552 1.00 0.00 N ATOM 1284 CE2 TRP A 85 -12.802 23.595 -1.719 1.00 0.00 C ATOM 1285 CE3 TRP A 85 -11.209 24.817 -0.376 1.00 0.00 C ATOM 1286 CZ2 TRP A 85 -13.841 24.441 -1.338 1.00 0.00 C ATOM 1287 CZ3 TRP A 85 -12.241 25.656 0.001 1.00 0.00 C ATOM 1288 CH2 TRP A 85 -13.543 25.463 -0.479 1.00 0.00 C ATOM 0 H TRP A 85 -7.236 21.079 -2.027 1.00 0.00 H new ATOM 0 HA TRP A 85 -9.107 22.402 -3.784 1.00 0.00 H new ATOM 0 HB2 TRP A 85 -9.088 21.517 -1.173 1.00 0.00 H new ATOM 0 HB3 TRP A 85 -8.839 23.238 -0.954 1.00 0.00 H new ATOM 0 HD1 TRP A 85 -11.248 21.137 -3.211 1.00 0.00 H new ATOM 0 HE1 TRP A 85 -13.623 22.138 -3.040 1.00 0.00 H new ATOM 0 HE3 TRP A 85 -10.209 24.972 0.000 1.00 0.00 H new ATOM 0 HZ2 TRP A 85 -14.845 24.295 -1.707 1.00 0.00 H new ATOM 0 HZ3 TRP A 85 -12.040 26.474 0.677 1.00 0.00 H new ATOM 0 HH2 TRP A 85 -14.328 26.135 -0.164 1.00 0.00 H new ATOM 1299 N TRP A 86 -8.378 24.975 -2.665 1.00 0.00 N ATOM 1300 CA TRP A 86 -7.782 26.300 -2.773 1.00 0.00 C ATOM 1301 C TRP A 86 -6.901 26.595 -1.564 1.00 0.00 C ATOM 1302 O TRP A 86 -7.278 26.313 -0.427 1.00 0.00 O ATOM 1303 CB TRP A 86 -8.875 27.366 -2.894 1.00 0.00 C ATOM 1304 CG TRP A 86 -9.335 27.594 -4.302 1.00 0.00 C ATOM 1305 CD1 TRP A 86 -9.256 26.717 -5.346 1.00 0.00 C ATOM 1306 CD2 TRP A 86 -9.948 28.780 -4.820 1.00 0.00 C ATOM 1307 NE1 TRP A 86 -9.781 27.285 -6.481 1.00 0.00 N ATOM 1308 CE2 TRP A 86 -10.213 28.551 -6.184 1.00 0.00 C ATOM 1309 CE3 TRP A 86 -10.300 30.014 -4.264 1.00 0.00 C ATOM 1310 CZ2 TRP A 86 -10.813 29.510 -6.998 1.00 0.00 C ATOM 1311 CZ3 TRP A 86 -10.895 30.964 -5.073 1.00 0.00 C ATOM 1312 CH2 TRP A 86 -11.147 30.708 -6.426 1.00 0.00 C ATOM 0 H TRP A 86 -9.306 24.957 -2.242 1.00 0.00 H new ATOM 0 HA TRP A 86 -7.162 26.323 -3.669 1.00 0.00 H new ATOM 0 HB2 TRP A 86 -9.729 27.070 -2.285 1.00 0.00 H new ATOM 0 HB3 TRP A 86 -8.502 28.305 -2.485 1.00 0.00 H new ATOM 0 HD1 TRP A 86 -8.841 25.722 -5.288 1.00 0.00 H new ATOM 0 HE1 TRP A 86 -9.840 26.837 -7.396 1.00 0.00 H new ATOM 0 HE3 TRP A 86 -10.110 30.221 -3.221 1.00 0.00 H new ATOM 0 HZ2 TRP A 86 -11.007 29.315 -8.042 1.00 0.00 H new ATOM 0 HZ3 TRP A 86 -11.170 31.921 -4.654 1.00 0.00 H new ATOM 0 HH2 TRP A 86 -11.614 31.471 -7.031 1.00 0.00 H new ATOM 1323 N ASP A 87 -5.725 27.164 -1.821 1.00 0.00 N ATOM 1324 CA ASP A 87 -4.777 27.500 -0.760 1.00 0.00 C ATOM 1325 C ASP A 87 -3.497 28.091 -1.344 1.00 0.00 C ATOM 1326 O ASP A 87 -2.638 27.363 -1.842 1.00 0.00 O ATOM 1327 CB ASP A 87 -4.437 26.261 0.075 1.00 0.00 C ATOM 1328 CG ASP A 87 -4.263 26.584 1.545 1.00 0.00 C ATOM 1329 OD1 ASP A 87 -4.820 27.606 1.997 1.00 0.00 O ATOM 1330 OD2 ASP A 87 -3.573 25.813 2.246 1.00 0.00 O ATOM 0 H ASP A 87 -5.405 27.403 -2.759 1.00 0.00 H new ATOM 0 HA ASP A 87 -5.248 28.243 -0.117 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -5.229 25.520 -0.040 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -3.521 25.810 -0.306 1.00 0.00 H new ATOM 1335 N SER A 88 -3.375 29.411 -1.280 1.00 0.00 N ATOM 1336 CA SER A 88 -2.198 30.098 -1.804 1.00 0.00 C ATOM 1337 C SER A 88 -1.042 30.062 -0.805 1.00 0.00 C ATOM 1338 O SER A 88 0.124 30.157 -1.191 1.00 0.00 O ATOM 1339 CB SER A 88 -2.542 31.547 -2.149 1.00 0.00 C ATOM 1340 OG SER A 88 -1.369 32.312 -2.369 1.00 0.00 O ATOM 0 H SER A 88 -4.076 30.029 -0.871 1.00 0.00 H new ATOM 0 HA SER A 88 -1.882 29.577 -2.708 1.00 0.00 H new ATOM 0 HB2 SER A 88 -3.169 31.573 -3.040 1.00 0.00 H new ATOM 0 HB3 SER A 88 -3.122 31.989 -1.339 1.00 0.00 H new ATOM 0 HG SER A 88 -1.616 33.234 -2.589 1.00 0.00 H new ATOM 1346 N THR A 89 -1.368 29.936 0.479 1.00 0.00 N ATOM 1347 CA THR A 89 -0.353 29.900 1.527 1.00 0.00 C ATOM 1348 C THR A 89 0.485 28.626 1.449 1.00 0.00 C ATOM 1349 O THR A 89 1.710 28.676 1.538 1.00 0.00 O ATOM 1350 CB THR A 89 -1.012 30.005 2.903 1.00 0.00 C ATOM 1351 OG1 THR A 89 -0.035 29.992 3.929 1.00 0.00 O ATOM 1352 CG2 THR A 89 -1.989 28.885 3.187 1.00 0.00 C ATOM 0 H THR A 89 -2.327 29.857 0.818 1.00 0.00 H new ATOM 0 HA THR A 89 0.311 30.752 1.377 1.00 0.00 H new ATOM 0 HB THR A 89 -1.559 30.948 2.889 1.00 0.00 H new ATOM 0 HG1 THR A 89 0.618 30.704 3.768 1.00 0.00 H new ATOM 0 HG21 THR A 89 -2.420 29.021 4.179 1.00 0.00 H new ATOM 0 HG22 THR A 89 -2.784 28.898 2.441 1.00 0.00 H new ATOM 0 HG23 THR A 89 -1.468 27.928 3.146 1.00 0.00 H new ATOM 1360 N THR A 90 -0.181 27.488 1.289 1.00 0.00 N ATOM 1361 CA THR A 90 0.507 26.207 1.208 1.00 0.00 C ATOM 1362 C THR A 90 1.129 26.007 -0.172 1.00 0.00 C ATOM 1363 O THR A 90 0.747 25.102 -0.916 1.00 0.00 O ATOM 1364 CB THR A 90 -0.467 25.067 1.522 1.00 0.00 C ATOM 1365 OG1 THR A 90 -1.638 25.178 0.734 1.00 0.00 O ATOM 1366 CG2 THR A 90 -0.892 25.026 2.974 1.00 0.00 C ATOM 0 H THR A 90 -1.196 27.427 1.213 1.00 0.00 H new ATOM 0 HA THR A 90 1.310 26.202 1.945 1.00 0.00 H new ATOM 0 HB THR A 90 0.077 24.150 1.294 1.00 0.00 H new ATOM 0 HG1 THR A 90 -2.428 25.071 1.305 1.00 0.00 H new ATOM 0 HG21 THR A 90 -1.581 24.196 3.128 1.00 0.00 H new ATOM 0 HG22 THR A 90 -0.014 24.891 3.606 1.00 0.00 H new ATOM 0 HG23 THR A 90 -1.387 25.961 3.235 1.00 0.00 H new ATOM 1374 N ASP A 91 2.091 26.861 -0.508 1.00 0.00 N ATOM 1375 CA ASP A 91 2.768 26.781 -1.797 1.00 0.00 C ATOM 1376 C ASP A 91 4.243 26.435 -1.621 1.00 0.00 C ATOM 1377 O ASP A 91 5.058 27.295 -1.287 1.00 0.00 O ATOM 1378 CB ASP A 91 2.628 28.102 -2.556 1.00 0.00 C ATOM 1379 CG ASP A 91 3.197 28.026 -3.959 1.00 0.00 C ATOM 1380 OD1 ASP A 91 4.415 28.254 -4.118 1.00 0.00 O ATOM 1381 OD2 ASP A 91 2.426 27.739 -4.899 1.00 0.00 O ATOM 0 H ASP A 91 2.419 27.616 0.094 1.00 0.00 H new ATOM 0 HA ASP A 91 2.296 25.987 -2.375 1.00 0.00 H new ATOM 0 HB2 ASP A 91 1.575 28.378 -2.609 1.00 0.00 H new ATOM 0 HB3 ASP A 91 3.137 28.891 -2.003 1.00 0.00 H new ATOM 1386 N GLY A 92 4.577 25.166 -1.843 1.00 0.00 N ATOM 1387 CA GLY A 92 5.958 24.729 -1.697 1.00 0.00 C ATOM 1388 C GLY A 92 6.262 23.393 -2.367 1.00 0.00 C ATOM 1389 O GLY A 92 7.398 23.164 -2.783 1.00 0.00 O ATOM 0 H GLY A 92 3.921 24.435 -2.120 1.00 0.00 H new ATOM 0 HA2 GLY A 92 6.615 25.491 -2.116 1.00 0.00 H new ATOM 0 HA3 GLY A 92 6.194 24.653 -0.635 1.00 0.00 H new ATOM 1393 N SER A 93 5.254 22.511 -2.447 1.00 0.00 N ATOM 1394 CA SER A 93 5.382 21.166 -3.043 1.00 0.00 C ATOM 1395 C SER A 93 6.462 21.060 -4.125 1.00 0.00 C ATOM 1396 O SER A 93 6.216 21.342 -5.298 1.00 0.00 O ATOM 1397 CB SER A 93 4.038 20.738 -3.632 1.00 0.00 C ATOM 1398 OG SER A 93 3.768 21.427 -4.841 1.00 0.00 O ATOM 0 H SER A 93 4.317 22.710 -2.097 1.00 0.00 H new ATOM 0 HA SER A 93 5.690 20.505 -2.233 1.00 0.00 H new ATOM 0 HB2 SER A 93 4.044 19.664 -3.816 1.00 0.00 H new ATOM 0 HB3 SER A 93 3.243 20.934 -2.913 1.00 0.00 H new ATOM 0 HG SER A 93 4.450 21.199 -5.507 1.00 0.00 H new ATOM 1404 N ARG A 94 7.654 20.631 -3.714 1.00 0.00 N ATOM 1405 CA ARG A 94 8.774 20.459 -4.633 1.00 0.00 C ATOM 1406 C ARG A 94 9.389 19.075 -4.446 1.00 0.00 C ATOM 1407 O ARG A 94 10.020 18.804 -3.424 1.00 0.00 O ATOM 1408 CB ARG A 94 9.830 21.542 -4.398 1.00 0.00 C ATOM 1409 CG ARG A 94 9.618 22.788 -5.246 1.00 0.00 C ATOM 1410 CD ARG A 94 9.784 24.063 -4.429 1.00 0.00 C ATOM 1411 NE ARG A 94 8.780 25.067 -4.774 1.00 0.00 N ATOM 1412 CZ ARG A 94 8.507 26.138 -4.027 1.00 0.00 C ATOM 1413 NH1 ARG A 94 9.161 26.355 -2.890 1.00 0.00 N ATOM 1414 NH2 ARG A 94 7.574 26.995 -4.419 1.00 0.00 N ATOM 0 H ARG A 94 7.868 20.395 -2.745 1.00 0.00 H new ATOM 0 HA ARG A 94 8.407 20.551 -5.655 1.00 0.00 H new ATOM 0 HB2 ARG A 94 9.823 21.823 -3.345 1.00 0.00 H new ATOM 0 HB3 ARG A 94 10.816 21.130 -4.612 1.00 0.00 H new ATOM 0 HG2 ARG A 94 10.329 22.791 -6.072 1.00 0.00 H new ATOM 0 HG3 ARG A 94 8.620 22.764 -5.684 1.00 0.00 H new ATOM 0 HD2 ARG A 94 9.710 23.826 -3.368 1.00 0.00 H new ATOM 0 HD3 ARG A 94 10.780 24.474 -4.596 1.00 0.00 H new ATOM 0 HE ARG A 94 8.255 24.941 -5.640 1.00 0.00 H new ATOM 0 HH11 ARG A 94 9.879 25.700 -2.582 1.00 0.00 H new ATOM 0 HH12 ARG A 94 8.945 27.177 -2.326 1.00 0.00 H new ATOM 0 HH21 ARG A 94 7.067 26.834 -5.290 1.00 0.00 H new ATOM 0 HH22 ARG A 94 7.363 27.815 -3.850 1.00 0.00 H new ATOM 1428 N THR A 95 9.183 18.193 -5.419 1.00 0.00 N ATOM 1429 CA THR A 95 9.703 16.833 -5.326 1.00 0.00 C ATOM 1430 C THR A 95 11.071 16.684 -5.997 1.00 0.00 C ATOM 1431 O THR A 95 11.378 17.366 -6.973 1.00 0.00 O ATOM 1432 CB THR A 95 8.685 15.828 -5.897 1.00 0.00 C ATOM 1433 OG1 THR A 95 8.833 14.563 -5.275 1.00 0.00 O ATOM 1434 CG2 THR A 95 8.784 15.607 -7.392 1.00 0.00 C ATOM 0 H THR A 95 8.664 18.393 -6.274 1.00 0.00 H new ATOM 0 HA THR A 95 9.853 16.612 -4.269 1.00 0.00 H new ATOM 0 HB THR A 95 7.715 16.279 -5.690 1.00 0.00 H new ATOM 0 HG1 THR A 95 7.967 14.106 -5.254 1.00 0.00 H new ATOM 0 HG21 THR A 95 8.029 14.885 -7.704 1.00 0.00 H new ATOM 0 HG22 THR A 95 8.619 16.551 -7.911 1.00 0.00 H new ATOM 0 HG23 THR A 95 9.775 15.226 -7.639 1.00 0.00 H new ATOM 1442 N VAL A 96 11.873 15.766 -5.466 1.00 0.00 N ATOM 1443 CA VAL A 96 13.200 15.491 -6.001 1.00 0.00 C ATOM 1444 C VAL A 96 13.424 13.979 -6.050 1.00 0.00 C ATOM 1445 O VAL A 96 13.168 13.273 -5.075 1.00 0.00 O ATOM 1446 CB VAL A 96 14.306 16.181 -5.151 1.00 0.00 C ATOM 1447 CG1 VAL A 96 15.707 15.654 -5.467 1.00 0.00 C ATOM 1448 CG2 VAL A 96 14.267 17.682 -5.355 1.00 0.00 C ATOM 0 H VAL A 96 11.623 15.196 -4.658 1.00 0.00 H new ATOM 0 HA VAL A 96 13.261 15.899 -7.010 1.00 0.00 H new ATOM 0 HB VAL A 96 14.095 15.943 -4.108 1.00 0.00 H new ATOM 0 HG11 VAL A 96 16.439 16.170 -4.845 1.00 0.00 H new ATOM 0 HG12 VAL A 96 15.748 14.584 -5.263 1.00 0.00 H new ATOM 0 HG13 VAL A 96 15.934 15.832 -6.518 1.00 0.00 H new ATOM 0 HG21 VAL A 96 15.046 18.151 -4.754 1.00 0.00 H new ATOM 0 HG22 VAL A 96 14.433 17.911 -6.408 1.00 0.00 H new ATOM 0 HG23 VAL A 96 13.293 18.065 -5.050 1.00 0.00 H new ATOM 1458 N ARG A 97 13.893 13.489 -7.189 1.00 0.00 N ATOM 1459 CA ARG A 97 14.139 12.064 -7.355 1.00 0.00 C ATOM 1460 C ARG A 97 15.623 11.743 -7.222 1.00 0.00 C ATOM 1461 O ARG A 97 16.444 12.209 -8.012 1.00 0.00 O ATOM 1462 CB ARG A 97 13.623 11.591 -8.716 1.00 0.00 C ATOM 1463 CG ARG A 97 13.807 10.100 -8.952 1.00 0.00 C ATOM 1464 CD ARG A 97 12.493 9.343 -8.831 1.00 0.00 C ATOM 1465 NE ARG A 97 11.521 9.770 -9.836 1.00 0.00 N ATOM 1466 CZ ARG A 97 10.368 9.142 -10.075 1.00 0.00 C ATOM 1467 NH1 ARG A 97 10.031 8.059 -9.384 1.00 0.00 N ATOM 1468 NH2 ARG A 97 9.548 9.603 -11.010 1.00 0.00 N ATOM 0 H ARG A 97 14.110 14.055 -8.009 1.00 0.00 H new ATOM 0 HA ARG A 97 13.603 11.537 -6.566 1.00 0.00 H new ATOM 0 HB2 ARG A 97 12.564 11.836 -8.799 1.00 0.00 H new ATOM 0 HB3 ARG A 97 14.140 12.141 -9.502 1.00 0.00 H new ATOM 0 HG2 ARG A 97 14.230 9.938 -9.944 1.00 0.00 H new ATOM 0 HG3 ARG A 97 14.523 9.703 -8.232 1.00 0.00 H new ATOM 0 HD2 ARG A 97 12.679 8.274 -8.938 1.00 0.00 H new ATOM 0 HD3 ARG A 97 12.076 9.496 -7.835 1.00 0.00 H new ATOM 0 HE ARG A 97 11.738 10.599 -10.389 1.00 0.00 H new ATOM 0 HH11 ARG A 97 10.656 7.700 -8.662 1.00 0.00 H new ATOM 0 HH12 ARG A 97 9.147 7.587 -9.575 1.00 0.00 H new ATOM 0 HH21 ARG A 97 9.799 10.435 -11.544 1.00 0.00 H new ATOM 0 HH22 ARG A 97 8.666 9.125 -11.195 1.00 0.00 H new ATOM 1482 N TRP A 98 15.957 10.934 -6.224 1.00 0.00 N ATOM 1483 CA TRP A 98 17.342 10.538 -5.993 1.00 0.00 C ATOM 1484 C TRP A 98 17.609 9.177 -6.625 1.00 0.00 C ATOM 1485 O TRP A 98 16.720 8.326 -6.686 1.00 0.00 O ATOM 1486 CB TRP A 98 17.645 10.459 -4.494 1.00 0.00 C ATOM 1487 CG TRP A 98 17.941 11.775 -3.845 1.00 0.00 C ATOM 1488 CD1 TRP A 98 19.170 12.257 -3.487 1.00 0.00 C ATOM 1489 CD2 TRP A 98 16.990 12.762 -3.451 1.00 0.00 C ATOM 1490 NE1 TRP A 98 19.039 13.490 -2.892 1.00 0.00 N ATOM 1491 CE2 TRP A 98 17.704 13.825 -2.865 1.00 0.00 C ATOM 1492 CE3 TRP A 98 15.600 12.851 -3.543 1.00 0.00 C ATOM 1493 CZ2 TRP A 98 17.063 14.961 -2.374 1.00 0.00 C ATOM 1494 CZ3 TRP A 98 14.974 13.979 -3.055 1.00 0.00 C ATOM 1495 CH2 TRP A 98 15.704 15.019 -2.478 1.00 0.00 C ATOM 0 H TRP A 98 15.289 10.539 -5.562 1.00 0.00 H new ATOM 0 HA TRP A 98 17.987 11.291 -6.447 1.00 0.00 H new ATOM 0 HB2 TRP A 98 16.793 10.004 -3.989 1.00 0.00 H new ATOM 0 HB3 TRP A 98 18.497 9.796 -4.344 1.00 0.00 H new ATOM 0 HD1 TRP A 98 20.107 11.744 -3.648 1.00 0.00 H new ATOM 0 HE1 TRP A 98 19.803 14.061 -2.531 1.00 0.00 H new ATOM 0 HE3 TRP A 98 15.026 12.052 -3.988 1.00 0.00 H new ATOM 0 HZ2 TRP A 98 17.623 15.768 -1.926 1.00 0.00 H new ATOM 0 HZ3 TRP A 98 13.899 14.059 -3.121 1.00 0.00 H new ATOM 0 HH2 TRP A 98 15.182 15.888 -2.106 1.00 0.00 H new ATOM 1506 N GLU A 99 18.835 8.975 -7.091 1.00 0.00 N ATOM 1507 CA GLU A 99 19.210 7.714 -7.717 1.00 0.00 C ATOM 1508 C GLU A 99 20.671 7.379 -7.436 1.00 0.00 C ATOM 1509 O GLU A 99 21.539 8.251 -7.479 1.00 0.00 O ATOM 1510 CB GLU A 99 18.967 7.784 -9.225 1.00 0.00 C ATOM 1511 CG GLU A 99 17.595 7.272 -9.643 1.00 0.00 C ATOM 1512 CD GLU A 99 16.753 8.335 -10.323 1.00 0.00 C ATOM 1513 OE1 GLU A 99 16.974 9.533 -10.048 1.00 0.00 O ATOM 1514 OE2 GLU A 99 15.873 7.969 -11.131 1.00 0.00 O ATOM 0 H GLU A 99 19.584 9.666 -7.048 1.00 0.00 H new ATOM 0 HA GLU A 99 18.591 6.924 -7.292 1.00 0.00 H new ATOM 0 HB2 GLU A 99 19.077 8.817 -9.555 1.00 0.00 H new ATOM 0 HB3 GLU A 99 19.734 7.203 -9.736 1.00 0.00 H new ATOM 0 HG2 GLU A 99 17.718 6.426 -10.319 1.00 0.00 H new ATOM 0 HG3 GLU A 99 17.066 6.904 -8.764 1.00 0.00 H new ATOM 1521 N ASN A 100 20.935 6.107 -7.149 1.00 0.00 N ATOM 1522 CA ASN A 100 22.291 5.650 -6.862 1.00 0.00 C ATOM 1523 C ASN A 100 22.805 4.737 -7.972 1.00 0.00 C ATOM 1524 O ASN A 100 23.817 5.031 -8.610 1.00 0.00 O ATOM 1525 CB ASN A 100 22.351 4.924 -5.511 1.00 0.00 C ATOM 1526 CG ASN A 100 21.150 4.028 -5.262 1.00 0.00 C ATOM 1527 OD1 ASN A 100 21.161 2.845 -5.604 1.00 0.00 O ATOM 1528 ND2 ASN A 100 20.106 4.591 -4.663 1.00 0.00 N ATOM 0 H ASN A 100 20.227 5.374 -7.109 1.00 0.00 H new ATOM 0 HA ASN A 100 22.933 6.529 -6.811 1.00 0.00 H new ATOM 0 HB2 ASN A 100 23.260 4.324 -5.468 1.00 0.00 H new ATOM 0 HB3 ASN A 100 22.418 5.662 -4.712 1.00 0.00 H new ATOM 0 HD21 ASN A 100 19.270 4.039 -4.469 1.00 0.00 H new ATOM 0 HD22 ASN A 100 20.140 5.575 -4.397 1.00 0.00 H new ATOM 1535 N LYS A 101 22.102 3.633 -8.205 1.00 0.00 N ATOM 1536 CA LYS A 101 22.498 2.690 -9.246 1.00 0.00 C ATOM 1537 C LYS A 101 21.323 1.828 -9.706 1.00 0.00 C ATOM 1538 O LYS A 101 21.158 1.585 -10.900 1.00 0.00 O ATOM 1539 CB LYS A 101 23.648 1.799 -8.763 1.00 0.00 C ATOM 1540 CG LYS A 101 23.485 1.285 -7.342 1.00 0.00 C ATOM 1541 CD LYS A 101 22.745 -0.041 -7.310 1.00 0.00 C ATOM 1542 CE LYS A 101 21.817 -0.127 -6.110 1.00 0.00 C ATOM 1543 NZ LYS A 101 21.723 -1.515 -5.579 1.00 0.00 N ATOM 0 H LYS A 101 21.261 3.370 -7.691 1.00 0.00 H new ATOM 0 HA LYS A 101 22.838 3.276 -10.100 1.00 0.00 H new ATOM 0 HB2 LYS A 101 23.740 0.947 -9.437 1.00 0.00 H new ATOM 0 HB3 LYS A 101 24.580 2.360 -8.829 1.00 0.00 H new ATOM 0 HG2 LYS A 101 24.466 1.166 -6.882 1.00 0.00 H new ATOM 0 HG3 LYS A 101 22.942 2.020 -6.748 1.00 0.00 H new ATOM 0 HD2 LYS A 101 22.169 -0.160 -8.227 1.00 0.00 H new ATOM 0 HD3 LYS A 101 23.463 -0.860 -7.276 1.00 0.00 H new ATOM 0 HE2 LYS A 101 22.176 0.538 -5.325 1.00 0.00 H new ATOM 0 HE3 LYS A 101 20.824 0.221 -6.393 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 20.729 -1.820 -5.579 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 22.281 -2.155 -6.179 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 22.093 -1.541 -4.608 1.00 0.00 H new ATOM 1557 N SER A 102 20.511 1.365 -8.759 1.00 0.00 N ATOM 1558 CA SER A 102 19.360 0.530 -9.092 1.00 0.00 C ATOM 1559 C SER A 102 18.101 1.027 -8.392 1.00 0.00 C ATOM 1560 O SER A 102 17.048 1.173 -9.013 1.00 0.00 O ATOM 1561 CB SER A 102 19.623 -0.931 -8.715 1.00 0.00 C ATOM 1562 OG SER A 102 19.354 -1.169 -7.344 1.00 0.00 O ATOM 0 H SER A 102 20.627 1.552 -7.763 1.00 0.00 H new ATOM 0 HA SER A 102 19.206 0.595 -10.169 1.00 0.00 H new ATOM 0 HB2 SER A 102 19.001 -1.584 -9.328 1.00 0.00 H new ATOM 0 HB3 SER A 102 20.661 -1.183 -8.933 1.00 0.00 H new ATOM 0 HG SER A 102 19.530 -2.110 -7.135 1.00 0.00 H new ATOM 1568 N MET A 103 18.215 1.280 -7.093 1.00 0.00 N ATOM 1569 CA MET A 103 17.084 1.756 -6.305 1.00 0.00 C ATOM 1570 C MET A 103 16.916 3.266 -6.442 1.00 0.00 C ATOM 1571 O MET A 103 17.893 3.998 -6.600 1.00 0.00 O ATOM 1572 CB MET A 103 17.272 1.386 -4.832 1.00 0.00 C ATOM 1573 CG MET A 103 15.992 1.464 -4.017 1.00 0.00 C ATOM 1574 SD MET A 103 16.237 0.996 -2.292 1.00 0.00 S ATOM 1575 CE MET A 103 15.814 -0.744 -2.352 1.00 0.00 C ATOM 0 H MET A 103 19.079 1.163 -6.563 1.00 0.00 H new ATOM 0 HA MET A 103 16.183 1.274 -6.685 1.00 0.00 H new ATOM 0 HB2 MET A 103 17.672 0.374 -4.768 1.00 0.00 H new ATOM 0 HB3 MET A 103 18.015 2.051 -4.391 1.00 0.00 H new ATOM 0 HG2 MET A 103 15.599 2.480 -4.062 1.00 0.00 H new ATOM 0 HG3 MET A 103 15.241 0.812 -4.463 1.00 0.00 H new ATOM 0 HE1 MET A 103 14.940 -0.928 -1.727 1.00 0.00 H new ATOM 0 HE2 MET A 103 15.591 -1.029 -3.380 1.00 0.00 H new ATOM 0 HE3 MET A 103 16.653 -1.335 -1.985 1.00 0.00 H new ATOM 1585 N TYR A 104 15.670 3.724 -6.377 1.00 0.00 N ATOM 1586 CA TYR A 104 15.371 5.147 -6.490 1.00 0.00 C ATOM 1587 C TYR A 104 14.601 5.634 -5.267 1.00 0.00 C ATOM 1588 O TYR A 104 13.915 4.854 -4.604 1.00 0.00 O ATOM 1589 CB TYR A 104 14.562 5.425 -7.760 1.00 0.00 C ATOM 1590 CG TYR A 104 15.070 4.693 -8.986 1.00 0.00 C ATOM 1591 CD1 TYR A 104 16.433 4.537 -9.214 1.00 0.00 C ATOM 1592 CD2 TYR A 104 14.185 4.159 -9.914 1.00 0.00 C ATOM 1593 CE1 TYR A 104 16.898 3.871 -10.332 1.00 0.00 C ATOM 1594 CE2 TYR A 104 14.643 3.491 -11.035 1.00 0.00 C ATOM 1595 CZ TYR A 104 15.999 3.351 -11.239 1.00 0.00 C ATOM 1596 OH TYR A 104 16.457 2.688 -12.354 1.00 0.00 O ATOM 0 H TYR A 104 14.851 3.130 -6.247 1.00 0.00 H new ATOM 0 HA TYR A 104 16.315 5.688 -6.547 1.00 0.00 H new ATOM 0 HB2 TYR A 104 13.523 5.144 -7.586 1.00 0.00 H new ATOM 0 HB3 TYR A 104 14.573 6.497 -7.959 1.00 0.00 H new ATOM 0 HD1 TYR A 104 17.140 4.943 -8.506 1.00 0.00 H new ATOM 0 HD2 TYR A 104 13.122 4.267 -9.758 1.00 0.00 H new ATOM 0 HE1 TYR A 104 17.960 3.758 -10.494 1.00 0.00 H new ATOM 0 HE2 TYR A 104 13.942 3.081 -11.747 1.00 0.00 H new ATOM 0 HH TYR A 104 15.695 2.383 -12.889 1.00 0.00 H new ATOM 1606 N CYS A 105 14.720 6.923 -4.967 1.00 0.00 N ATOM 1607 CA CYS A 105 14.034 7.503 -3.818 1.00 0.00 C ATOM 1608 C CYS A 105 13.588 8.932 -4.111 1.00 0.00 C ATOM 1609 O CYS A 105 14.415 9.832 -4.257 1.00 0.00 O ATOM 1610 CB CYS A 105 14.946 7.484 -2.591 1.00 0.00 C ATOM 1611 SG CYS A 105 15.376 5.825 -2.016 1.00 0.00 S ATOM 0 H CYS A 105 15.283 7.584 -5.502 1.00 0.00 H new ATOM 0 HA CYS A 105 13.148 6.901 -3.615 1.00 0.00 H new ATOM 0 HB2 CYS A 105 15.863 8.025 -2.825 1.00 0.00 H new ATOM 0 HB3 CYS A 105 14.457 8.023 -1.780 1.00 0.00 H new ATOM 0 HG CYS A 105 14.892 4.942 -2.838 1.00 0.00 H new ATOM 1617 N ILE A 106 12.278 9.134 -4.192 1.00 0.00 N ATOM 1618 CA ILE A 106 11.728 10.458 -4.464 1.00 0.00 C ATOM 1619 C ILE A 106 11.349 11.164 -3.163 1.00 0.00 C ATOM 1620 O ILE A 106 10.413 10.767 -2.478 1.00 0.00 O ATOM 1621 CB ILE A 106 10.494 10.370 -5.402 1.00 0.00 C ATOM 1622 CG1 ILE A 106 9.784 11.724 -5.528 1.00 0.00 C ATOM 1623 CG2 ILE A 106 9.524 9.312 -4.908 1.00 0.00 C ATOM 1624 CD1 ILE A 106 9.174 11.957 -6.888 1.00 0.00 C ATOM 0 H ILE A 106 11.578 8.401 -4.074 1.00 0.00 H new ATOM 0 HA ILE A 106 12.500 11.040 -4.967 1.00 0.00 H new ATOM 0 HB ILE A 106 10.853 10.087 -6.392 1.00 0.00 H new ATOM 0 HG12 ILE A 106 9.002 11.787 -4.772 1.00 0.00 H new ATOM 0 HG13 ILE A 106 10.497 12.521 -5.317 1.00 0.00 H new ATOM 0 HG21 ILE A 106 8.665 9.264 -5.578 1.00 0.00 H new ATOM 0 HG22 ILE A 106 10.022 8.343 -4.887 1.00 0.00 H new ATOM 0 HG23 ILE A 106 9.187 9.568 -3.904 1.00 0.00 H new ATOM 0 HD11 ILE A 106 8.689 12.933 -6.907 1.00 0.00 H new ATOM 0 HD12 ILE A 106 9.955 11.926 -7.647 1.00 0.00 H new ATOM 0 HD13 ILE A 106 8.437 11.181 -7.094 1.00 0.00 H new ATOM 1636 N CYS A 107 12.071 12.229 -2.847 1.00 0.00 N ATOM 1637 CA CYS A 107 11.801 13.002 -1.636 1.00 0.00 C ATOM 1638 C CYS A 107 11.296 14.391 -2.002 1.00 0.00 C ATOM 1639 O CYS A 107 11.975 15.148 -2.697 1.00 0.00 O ATOM 1640 CB CYS A 107 13.051 13.132 -0.745 1.00 0.00 C ATOM 1641 SG CYS A 107 14.255 11.783 -0.878 1.00 0.00 S ATOM 0 H CYS A 107 12.847 12.580 -3.408 1.00 0.00 H new ATOM 0 HA CYS A 107 11.038 12.465 -1.073 1.00 0.00 H new ATOM 0 HB2 CYS A 107 13.553 14.068 -0.990 1.00 0.00 H new ATOM 0 HB3 CYS A 107 12.728 13.205 0.294 1.00 0.00 H new ATOM 0 HG CYS A 107 15.016 11.981 -1.913 1.00 0.00 H new ATOM 1647 N THR A 108 10.096 14.721 -1.537 1.00 0.00 N ATOM 1648 CA THR A 108 9.502 16.018 -1.821 1.00 0.00 C ATOM 1649 C THR A 108 9.402 16.880 -0.568 1.00 0.00 C ATOM 1650 O THR A 108 8.918 16.433 0.476 1.00 0.00 O ATOM 1651 CB THR A 108 8.113 15.849 -2.465 1.00 0.00 C ATOM 1652 OG1 THR A 108 7.728 17.035 -3.136 1.00 0.00 O ATOM 1653 CG2 THR A 108 7.006 15.503 -1.481 1.00 0.00 C ATOM 0 H THR A 108 9.518 14.108 -0.963 1.00 0.00 H new ATOM 0 HA THR A 108 10.158 16.530 -2.525 1.00 0.00 H new ATOM 0 HB THR A 108 8.227 15.011 -3.153 1.00 0.00 H new ATOM 0 HG1 THR A 108 6.844 16.910 -3.541 1.00 0.00 H new ATOM 0 HG21 THR A 108 6.062 15.402 -2.016 1.00 0.00 H new ATOM 0 HG22 THR A 108 7.243 14.563 -0.983 1.00 0.00 H new ATOM 0 HG23 THR A 108 6.919 16.296 -0.738 1.00 0.00 H new ATOM 1661 N VAL A 109 9.832 18.128 -0.695 1.00 0.00 N ATOM 1662 CA VAL A 109 9.760 19.074 0.408 1.00 0.00 C ATOM 1663 C VAL A 109 8.651 20.069 0.123 1.00 0.00 C ATOM 1664 O VAL A 109 8.639 20.717 -0.926 1.00 0.00 O ATOM 1665 CB VAL A 109 11.084 19.852 0.655 1.00 0.00 C ATOM 1666 CG1 VAL A 109 11.350 19.989 2.153 1.00 0.00 C ATOM 1667 CG2 VAL A 109 12.269 19.196 -0.042 1.00 0.00 C ATOM 0 H VAL A 109 10.234 18.508 -1.552 1.00 0.00 H new ATOM 0 HA VAL A 109 9.566 18.494 1.310 1.00 0.00 H new ATOM 0 HB VAL A 109 10.965 20.846 0.224 1.00 0.00 H new ATOM 0 HG11 VAL A 109 12.280 20.536 2.309 1.00 0.00 H new ATOM 0 HG12 VAL A 109 10.528 20.531 2.620 1.00 0.00 H new ATOM 0 HG13 VAL A 109 11.432 18.998 2.600 1.00 0.00 H new ATOM 0 HG21 VAL A 109 13.173 19.772 0.157 1.00 0.00 H new ATOM 0 HG22 VAL A 109 12.396 18.181 0.334 1.00 0.00 H new ATOM 0 HG23 VAL A 109 12.088 19.165 -1.116 1.00 0.00 H new ATOM 1677 N PHE A 110 7.715 20.183 1.047 1.00 0.00 N ATOM 1678 CA PHE A 110 6.604 21.096 0.876 1.00 0.00 C ATOM 1679 C PHE A 110 6.824 22.365 1.690 1.00 0.00 C ATOM 1680 O PHE A 110 6.577 22.397 2.889 1.00 0.00 O ATOM 1681 CB PHE A 110 5.307 20.409 1.300 1.00 0.00 C ATOM 1682 CG PHE A 110 4.604 19.687 0.186 1.00 0.00 C ATOM 1683 CD1 PHE A 110 5.257 18.708 -0.544 1.00 0.00 C ATOM 1684 CD2 PHE A 110 3.287 19.984 -0.126 1.00 0.00 C ATOM 1685 CE1 PHE A 110 4.610 18.038 -1.566 1.00 0.00 C ATOM 1686 CE2 PHE A 110 2.635 19.319 -1.147 1.00 0.00 C ATOM 1687 CZ PHE A 110 3.298 18.345 -1.867 1.00 0.00 C ATOM 0 H PHE A 110 7.703 19.656 1.920 1.00 0.00 H new ATOM 0 HA PHE A 110 6.533 21.376 -0.175 1.00 0.00 H new ATOM 0 HB2 PHE A 110 5.528 19.699 2.097 1.00 0.00 H new ATOM 0 HB3 PHE A 110 4.632 21.156 1.717 1.00 0.00 H new ATOM 0 HD1 PHE A 110 6.283 18.465 -0.312 1.00 0.00 H new ATOM 0 HD2 PHE A 110 2.764 20.744 0.435 1.00 0.00 H new ATOM 0 HE1 PHE A 110 5.130 17.276 -2.128 1.00 0.00 H new ATOM 0 HE2 PHE A 110 1.609 19.561 -1.381 1.00 0.00 H new ATOM 0 HZ PHE A 110 2.791 17.824 -2.665 1.00 0.00 H new ATOM 1697 N GLY A 111 7.280 23.413 1.019 1.00 0.00 N ATOM 1698 CA GLY A 111 7.517 24.684 1.684 1.00 0.00 C ATOM 1699 C GLY A 111 6.268 25.539 1.706 1.00 0.00 C ATOM 1700 O GLY A 111 6.024 26.321 0.787 1.00 0.00 O ATOM 0 H GLY A 111 7.492 23.408 0.021 1.00 0.00 H new ATOM 0 HA2 GLY A 111 7.855 24.505 2.705 1.00 0.00 H new ATOM 0 HA3 GLY A 111 8.317 25.220 1.173 1.00 0.00 H new ATOM 1704 N LEU A 112 5.459 25.374 2.744 1.00 0.00 N ATOM 1705 CA LEU A 112 4.211 26.114 2.860 1.00 0.00 C ATOM 1706 C LEU A 112 4.412 27.419 3.627 1.00 0.00 C ATOM 1707 O LEU A 112 5.038 27.442 4.685 1.00 0.00 O ATOM 1708 CB LEU A 112 3.156 25.238 3.557 1.00 0.00 C ATOM 1709 CG LEU A 112 2.642 24.006 2.770 1.00 0.00 C ATOM 1710 CD1 LEU A 112 3.690 23.426 1.831 1.00 0.00 C ATOM 1711 CD2 LEU A 112 2.190 22.925 3.729 1.00 0.00 C ATOM 0 H LEU A 112 5.645 24.735 3.517 1.00 0.00 H new ATOM 0 HA LEU A 112 3.864 26.369 1.859 1.00 0.00 H new ATOM 0 HB2 LEU A 112 3.574 24.888 4.501 1.00 0.00 H new ATOM 0 HB3 LEU A 112 2.300 25.867 3.801 1.00 0.00 H new ATOM 0 HG LEU A 112 1.806 24.353 2.163 1.00 0.00 H new ATOM 0 HD11 LEU A 112 3.273 22.566 1.307 1.00 0.00 H new ATOM 0 HD12 LEU A 112 3.988 24.183 1.106 1.00 0.00 H new ATOM 0 HD13 LEU A 112 4.561 23.113 2.407 1.00 0.00 H new ATOM 0 HD21 LEU A 112 1.831 22.065 3.164 1.00 0.00 H new ATOM 0 HD22 LEU A 112 3.028 22.623 4.358 1.00 0.00 H new ATOM 0 HD23 LEU A 112 1.385 23.308 4.357 1.00 0.00 H new ATOM 1723 N ALA A 113 3.881 28.507 3.081 1.00 0.00 N ATOM 1724 CA ALA A 113 4.004 29.817 3.708 1.00 0.00 C ATOM 1725 C ALA A 113 3.277 29.857 5.049 1.00 0.00 C ATOM 1726 O ALA A 113 2.160 30.367 5.145 1.00 0.00 O ATOM 1727 CB ALA A 113 3.467 30.898 2.783 1.00 0.00 C ATOM 0 H ALA A 113 3.360 28.507 2.204 1.00 0.00 H new ATOM 0 HA ALA A 113 5.062 30.004 3.893 1.00 0.00 H new ATOM 0 HB1 ALA A 113 3.565 31.871 3.265 1.00 0.00 H new ATOM 0 HB2 ALA A 113 4.034 30.895 1.852 1.00 0.00 H new ATOM 0 HB3 ALA A 113 2.416 30.704 2.568 1.00 0.00 H new ATOM 1733 N ILE A 114 3.917 29.317 6.080 1.00 0.00 N ATOM 1734 CA ILE A 114 3.332 29.291 7.416 1.00 0.00 C ATOM 1735 C ILE A 114 2.006 28.539 7.423 1.00 0.00 C ATOM 1736 O ILE A 114 1.437 28.361 8.520 1.00 0.00 O ATOM 1737 CB ILE A 114 3.104 30.715 7.958 1.00 0.00 C ATOM 1738 CG1 ILE A 114 4.359 31.567 7.765 1.00 0.00 C ATOM 1739 CG2 ILE A 114 2.710 30.666 9.426 1.00 0.00 C ATOM 1740 CD1 ILE A 114 4.148 33.033 8.074 1.00 0.00 C ATOM 0 H ILE A 114 4.842 28.891 6.017 1.00 0.00 H new ATOM 0 HA ILE A 114 4.043 28.774 8.061 1.00 0.00 H new ATOM 0 HB ILE A 114 2.289 31.174 7.398 1.00 0.00 H new ATOM 0 HG12 ILE A 114 5.153 31.180 8.404 1.00 0.00 H new ATOM 0 HG13 ILE A 114 4.701 31.467 6.735 1.00 0.00 H new ATOM 0 HG21 ILE A 114 2.552 31.680 9.794 1.00 0.00 H new ATOM 0 HG22 ILE A 114 1.790 30.092 9.537 1.00 0.00 H new ATOM 0 HG23 ILE A 114 3.505 30.191 10.000 1.00 0.00 H new ATOM 0 HD11 ILE A 114 5.080 33.576 7.915 1.00 0.00 H new ATOM 0 HD12 ILE A 114 3.377 33.436 7.417 1.00 0.00 H new ATOM 0 HD13 ILE A 114 3.835 33.145 9.112 1.00 0.00 H new TER 1752 ILE A 114 ATOM 1753 N MET B 1 -12.127 -17.756 -7.100 1.00 0.00 N ATOM 1754 CA MET B 1 -12.378 -16.541 -7.919 1.00 0.00 C ATOM 1755 C MET B 1 -11.087 -15.769 -8.174 1.00 0.00 C ATOM 1756 O MET B 1 -11.103 -14.548 -8.320 1.00 0.00 O ATOM 1757 CB MET B 1 -13.383 -15.655 -7.179 1.00 0.00 C ATOM 1758 CG MET B 1 -14.803 -16.198 -7.197 1.00 0.00 C ATOM 1759 SD MET B 1 -15.003 -17.652 -6.150 1.00 0.00 S ATOM 1760 CE MET B 1 -16.010 -16.982 -4.829 1.00 0.00 C ATOM 0 H1 MET B 1 -13.035 -18.186 -6.829 1.00 0.00 H new ATOM 0 H2 MET B 1 -11.572 -18.439 -7.654 1.00 0.00 H new ATOM 0 H3 MET B 1 -11.599 -17.494 -6.243 1.00 0.00 H new ATOM 0 HA MET B 1 -12.778 -16.840 -8.888 1.00 0.00 H new ATOM 0 HB2 MET B 1 -13.060 -15.540 -6.144 1.00 0.00 H new ATOM 0 HB3 MET B 1 -13.377 -14.661 -7.627 1.00 0.00 H new ATOM 0 HG2 MET B 1 -15.490 -15.419 -6.866 1.00 0.00 H new ATOM 0 HG3 MET B 1 -15.078 -16.452 -8.221 1.00 0.00 H new ATOM 0 HE1 MET B 1 -16.219 -17.764 -4.099 1.00 0.00 H new ATOM 0 HE2 MET B 1 -15.476 -16.165 -4.343 1.00 0.00 H new ATOM 0 HE3 MET B 1 -16.948 -16.609 -5.240 1.00 0.00 H new ATOM 1770 N GLU B 2 -9.970 -16.494 -8.225 1.00 0.00 N ATOM 1771 CA GLU B 2 -8.661 -15.885 -8.461 1.00 0.00 C ATOM 1772 C GLU B 2 -8.246 -15.011 -7.280 1.00 0.00 C ATOM 1773 O GLU B 2 -7.334 -15.359 -6.531 1.00 0.00 O ATOM 1774 CB GLU B 2 -8.670 -15.060 -9.754 1.00 0.00 C ATOM 1775 CG GLU B 2 -7.398 -15.201 -10.573 1.00 0.00 C ATOM 1776 CD GLU B 2 -7.155 -14.013 -11.482 1.00 0.00 C ATOM 1777 OE1 GLU B 2 -6.909 -12.906 -10.959 1.00 0.00 O ATOM 1778 OE2 GLU B 2 -7.209 -14.189 -12.718 1.00 0.00 O ATOM 0 H GLU B 2 -9.945 -17.507 -8.106 1.00 0.00 H new ATOM 0 HA GLU B 2 -7.933 -16.689 -8.567 1.00 0.00 H new ATOM 0 HB2 GLU B 2 -9.521 -15.364 -10.364 1.00 0.00 H new ATOM 0 HB3 GLU B 2 -8.817 -14.009 -9.504 1.00 0.00 H new ATOM 0 HG2 GLU B 2 -6.548 -15.319 -9.900 1.00 0.00 H new ATOM 0 HG3 GLU B 2 -7.456 -16.108 -11.175 1.00 0.00 H new ATOM 1785 N GLY B 3 -8.922 -13.879 -7.118 1.00 0.00 N ATOM 1786 CA GLY B 3 -8.606 -12.979 -6.024 1.00 0.00 C ATOM 1787 C GLY B 3 -9.294 -11.633 -6.153 1.00 0.00 C ATOM 1788 O GLY B 3 -8.704 -10.598 -5.843 1.00 0.00 O ATOM 0 H GLY B 3 -9.682 -13.569 -7.723 1.00 0.00 H new ATOM 0 HA2 GLY B 3 -8.899 -13.443 -5.082 1.00 0.00 H new ATOM 0 HA3 GLY B 3 -7.527 -12.828 -5.984 1.00 0.00 H new ATOM 1792 N VAL B 4 -10.544 -11.643 -6.609 1.00 0.00 N ATOM 1793 CA VAL B 4 -11.309 -10.411 -6.773 1.00 0.00 C ATOM 1794 C VAL B 4 -12.025 -10.042 -5.479 1.00 0.00 C ATOM 1795 O VAL B 4 -12.976 -10.710 -5.074 1.00 0.00 O ATOM 1796 CB VAL B 4 -12.345 -10.538 -7.905 1.00 0.00 C ATOM 1797 CG1 VAL B 4 -12.977 -9.187 -8.207 1.00 0.00 C ATOM 1798 CG2 VAL B 4 -11.703 -11.126 -9.155 1.00 0.00 C ATOM 0 H VAL B 4 -11.048 -12.490 -6.871 1.00 0.00 H new ATOM 0 HA VAL B 4 -10.599 -9.625 -7.033 1.00 0.00 H new ATOM 0 HB VAL B 4 -13.133 -11.216 -7.576 1.00 0.00 H new ATOM 0 HG11 VAL B 4 -13.706 -9.298 -9.010 1.00 0.00 H new ATOM 0 HG12 VAL B 4 -13.475 -8.810 -7.314 1.00 0.00 H new ATOM 0 HG13 VAL B 4 -12.203 -8.484 -8.514 1.00 0.00 H new ATOM 0 HG21 VAL B 4 -12.451 -11.208 -9.944 1.00 0.00 H new ATOM 0 HG22 VAL B 4 -10.894 -10.476 -9.488 1.00 0.00 H new ATOM 0 HG23 VAL B 4 -11.305 -12.115 -8.929 1.00 0.00 H new ATOM 1808 N ASP B 5 -11.560 -8.978 -4.831 1.00 0.00 N ATOM 1809 CA ASP B 5 -12.157 -8.531 -3.577 1.00 0.00 C ATOM 1810 C ASP B 5 -12.242 -7.004 -3.510 1.00 0.00 C ATOM 1811 O ASP B 5 -11.245 -6.339 -3.228 1.00 0.00 O ATOM 1812 CB ASP B 5 -11.345 -9.057 -2.392 1.00 0.00 C ATOM 1813 CG ASP B 5 -12.222 -9.470 -1.227 1.00 0.00 C ATOM 1814 OD1 ASP B 5 -12.644 -10.645 -1.188 1.00 0.00 O ATOM 1815 OD2 ASP B 5 -12.487 -8.617 -0.352 1.00 0.00 O ATOM 0 H ASP B 5 -10.775 -8.411 -5.152 1.00 0.00 H new ATOM 0 HA ASP B 5 -13.171 -8.929 -3.530 1.00 0.00 H new ATOM 0 HB2 ASP B 5 -10.749 -9.910 -2.714 1.00 0.00 H new ATOM 0 HB3 ASP B 5 -10.648 -8.287 -2.063 1.00 0.00 H new ATOM 1820 N PRO B 6 -13.431 -6.415 -3.759 1.00 0.00 N ATOM 1821 CA PRO B 6 -13.612 -4.960 -3.710 1.00 0.00 C ATOM 1822 C PRO B 6 -13.410 -4.415 -2.300 1.00 0.00 C ATOM 1823 O PRO B 6 -14.161 -4.747 -1.383 1.00 0.00 O ATOM 1824 CB PRO B 6 -15.065 -4.748 -4.162 1.00 0.00 C ATOM 1825 CG PRO B 6 -15.470 -6.034 -4.800 1.00 0.00 C ATOM 1826 CD PRO B 6 -14.687 -7.104 -4.101 1.00 0.00 C ATOM 0 HA PRO B 6 -12.888 -4.439 -4.336 1.00 0.00 H new ATOM 0 HB2 PRO B 6 -15.709 -4.509 -3.316 1.00 0.00 H new ATOM 0 HB3 PRO B 6 -15.141 -3.919 -4.865 1.00 0.00 H new ATOM 0 HG2 PRO B 6 -16.542 -6.202 -4.694 1.00 0.00 H new ATOM 0 HG3 PRO B 6 -15.253 -6.026 -5.868 1.00 0.00 H new ATOM 0 HD2 PRO B 6 -15.203 -7.469 -3.213 1.00 0.00 H new ATOM 0 HD3 PRO B 6 -14.514 -7.966 -4.746 1.00 0.00 H new ATOM 1834 N ALA B 7 -12.384 -3.586 -2.127 1.00 0.00 N ATOM 1835 CA ALA B 7 -12.082 -3.011 -0.821 1.00 0.00 C ATOM 1836 C ALA B 7 -11.773 -4.106 0.188 1.00 0.00 C ATOM 1837 O ALA B 7 -12.667 -4.606 0.869 1.00 0.00 O ATOM 1838 CB ALA B 7 -13.240 -2.164 -0.324 1.00 0.00 C ATOM 0 H ALA B 7 -11.750 -3.299 -2.873 1.00 0.00 H new ATOM 0 HA ALA B 7 -11.204 -2.374 -0.930 1.00 0.00 H new ATOM 0 HB1 ALA B 7 -12.992 -1.745 0.651 1.00 0.00 H new ATOM 0 HB2 ALA B 7 -13.428 -1.354 -1.029 1.00 0.00 H new ATOM 0 HB3 ALA B 7 -14.133 -2.783 -0.237 1.00 0.00 H new ATOM 1844 N VAL B 8 -10.506 -4.480 0.272 1.00 0.00 N ATOM 1845 CA VAL B 8 -10.085 -5.527 1.195 1.00 0.00 C ATOM 1846 C VAL B 8 -9.347 -4.938 2.379 1.00 0.00 C ATOM 1847 O VAL B 8 -9.773 -5.052 3.528 1.00 0.00 O ATOM 1848 CB VAL B 8 -9.133 -6.573 0.543 1.00 0.00 C ATOM 1849 CG1 VAL B 8 -9.478 -7.968 1.020 1.00 0.00 C ATOM 1850 CG2 VAL B 8 -9.146 -6.505 -0.976 1.00 0.00 C ATOM 0 H VAL B 8 -9.752 -4.077 -0.285 1.00 0.00 H new ATOM 0 HA VAL B 8 -11.006 -6.022 1.502 1.00 0.00 H new ATOM 0 HB VAL B 8 -8.119 -6.328 0.860 1.00 0.00 H new ATOM 0 HG11 VAL B 8 -8.804 -8.688 0.556 1.00 0.00 H new ATOM 0 HG12 VAL B 8 -9.372 -8.018 2.104 1.00 0.00 H new ATOM 0 HG13 VAL B 8 -10.506 -8.203 0.744 1.00 0.00 H new ATOM 0 HG21 VAL B 8 -8.466 -7.255 -1.380 1.00 0.00 H new ATOM 0 HG22 VAL B 8 -10.155 -6.697 -1.340 1.00 0.00 H new ATOM 0 HG23 VAL B 8 -8.827 -5.514 -1.299 1.00 0.00 H new ATOM 1860 N GLU B 9 -8.209 -4.345 2.070 1.00 0.00 N ATOM 1861 CA GLU B 9 -7.345 -3.765 3.074 1.00 0.00 C ATOM 1862 C GLU B 9 -7.700 -2.303 3.328 1.00 0.00 C ATOM 1863 O GLU B 9 -6.899 -1.403 3.080 1.00 0.00 O ATOM 1864 CB GLU B 9 -5.884 -3.903 2.632 1.00 0.00 C ATOM 1865 CG GLU B 9 -5.572 -5.185 1.869 1.00 0.00 C ATOM 1866 CD GLU B 9 -4.084 -5.461 1.776 1.00 0.00 C ATOM 1867 OE1 GLU B 9 -3.308 -4.491 1.643 1.00 0.00 O ATOM 1868 OE2 GLU B 9 -3.694 -6.646 1.836 1.00 0.00 O ATOM 0 H GLU B 9 -7.860 -4.253 1.116 1.00 0.00 H new ATOM 0 HA GLU B 9 -7.486 -4.302 4.012 1.00 0.00 H new ATOM 0 HB2 GLU B 9 -5.625 -3.050 2.005 1.00 0.00 H new ATOM 0 HB3 GLU B 9 -5.245 -3.855 3.514 1.00 0.00 H new ATOM 0 HG2 GLU B 9 -6.063 -6.025 2.361 1.00 0.00 H new ATOM 0 HG3 GLU B 9 -5.988 -5.116 0.864 1.00 0.00 H new ATOM 1875 N GLU B 10 -8.909 -2.078 3.833 1.00 0.00 N ATOM 1876 CA GLU B 10 -9.378 -0.729 4.130 1.00 0.00 C ATOM 1877 C GLU B 10 -8.462 -0.050 5.143 1.00 0.00 C ATOM 1878 O GLU B 10 -8.289 -0.537 6.262 1.00 0.00 O ATOM 1879 CB GLU B 10 -10.811 -0.774 4.664 1.00 0.00 C ATOM 1880 CG GLU B 10 -11.455 0.594 4.798 1.00 0.00 C ATOM 1881 CD GLU B 10 -11.083 1.289 6.093 1.00 0.00 C ATOM 1882 OE1 GLU B 10 -11.623 0.900 7.150 1.00 0.00 O ATOM 1883 OE2 GLU B 10 -10.252 2.220 6.051 1.00 0.00 O ATOM 0 H GLU B 10 -9.583 -2.814 4.045 1.00 0.00 H new ATOM 0 HA GLU B 10 -9.361 -0.149 3.207 1.00 0.00 H new ATOM 0 HB2 GLU B 10 -11.418 -1.388 3.999 1.00 0.00 H new ATOM 0 HB3 GLU B 10 -10.811 -1.263 5.638 1.00 0.00 H new ATOM 0 HG2 GLU B 10 -11.154 1.217 3.956 1.00 0.00 H new ATOM 0 HG3 GLU B 10 -12.539 0.488 4.745 1.00 0.00 H new ATOM 1890 N ALA B 11 -7.870 1.071 4.743 1.00 0.00 N ATOM 1891 CA ALA B 11 -6.965 1.809 5.616 1.00 0.00 C ATOM 1892 C ALA B 11 -7.609 3.090 6.135 1.00 0.00 C ATOM 1893 O ALA B 11 -8.382 3.739 5.431 1.00 0.00 O ATOM 1894 CB ALA B 11 -5.672 2.127 4.880 1.00 0.00 C ATOM 0 H ALA B 11 -8.001 1.487 3.821 1.00 0.00 H new ATOM 0 HA ALA B 11 -6.741 1.179 6.477 1.00 0.00 H new ATOM 0 HB1 ALA B 11 -5.003 2.678 5.541 1.00 0.00 H new ATOM 0 HB2 ALA B 11 -5.192 1.199 4.570 1.00 0.00 H new ATOM 0 HB3 ALA B 11 -5.893 2.732 4.001 1.00 0.00 H new ATOM 1900 N ALA B 12 -7.275 3.449 7.371 1.00 0.00 N ATOM 1901 CA ALA B 12 -7.808 4.654 7.997 1.00 0.00 C ATOM 1902 C ALA B 12 -9.330 4.622 8.075 1.00 0.00 C ATOM 1903 O ALA B 12 -10.017 4.665 7.055 1.00 0.00 O ATOM 1904 CB ALA B 12 -7.344 5.890 7.242 1.00 0.00 C ATOM 0 H ALA B 12 -6.634 2.919 7.961 1.00 0.00 H new ATOM 0 HA ALA B 12 -7.425 4.694 9.017 1.00 0.00 H new ATOM 0 HB1 ALA B 12 -7.749 6.782 7.720 1.00 0.00 H new ATOM 0 HB2 ALA B 12 -6.255 5.935 7.253 1.00 0.00 H new ATOM 0 HB3 ALA B 12 -7.695 5.840 6.211 1.00 0.00 H new ATOM 1910 N PHE B 13 -9.851 4.557 9.296 1.00 0.00 N ATOM 1911 CA PHE B 13 -11.292 4.530 9.516 1.00 0.00 C ATOM 1912 C PHE B 13 -11.741 5.778 10.271 1.00 0.00 C ATOM 1913 O PHE B 13 -12.687 5.734 11.057 1.00 0.00 O ATOM 1914 CB PHE B 13 -11.690 3.274 10.293 1.00 0.00 C ATOM 1915 CG PHE B 13 -12.976 2.658 9.821 1.00 0.00 C ATOM 1916 CD1 PHE B 13 -14.090 3.447 9.580 1.00 0.00 C ATOM 1917 CD2 PHE B 13 -13.072 1.290 9.619 1.00 0.00 C ATOM 1918 CE1 PHE B 13 -15.274 2.883 9.146 1.00 0.00 C ATOM 1919 CE2 PHE B 13 -14.253 0.721 9.186 1.00 0.00 C ATOM 1920 CZ PHE B 13 -15.356 1.518 8.948 1.00 0.00 C ATOM 0 H PHE B 13 -9.295 4.522 10.150 1.00 0.00 H new ATOM 0 HA PHE B 13 -11.787 4.513 8.545 1.00 0.00 H new ATOM 0 HB2 PHE B 13 -10.891 2.537 10.209 1.00 0.00 H new ATOM 0 HB3 PHE B 13 -11.783 3.525 11.350 1.00 0.00 H new ATOM 0 HD1 PHE B 13 -14.032 4.514 9.733 1.00 0.00 H new ATOM 0 HD2 PHE B 13 -12.213 0.662 9.803 1.00 0.00 H new ATOM 0 HE1 PHE B 13 -16.135 3.509 8.962 1.00 0.00 H new ATOM 0 HE2 PHE B 13 -14.315 -0.346 9.033 1.00 0.00 H new ATOM 0 HZ PHE B 13 -16.280 1.075 8.608 1.00 0.00 H new ATOM 1930 N VAL B 14 -11.052 6.888 10.026 1.00 0.00 N ATOM 1931 CA VAL B 14 -11.372 8.151 10.681 1.00 0.00 C ATOM 1932 C VAL B 14 -12.109 9.087 9.728 1.00 0.00 C ATOM 1933 O VAL B 14 -11.803 9.141 8.537 1.00 0.00 O ATOM 1934 CB VAL B 14 -10.098 8.853 11.196 1.00 0.00 C ATOM 1935 CG1 VAL B 14 -10.454 10.072 12.039 1.00 0.00 C ATOM 1936 CG2 VAL B 14 -9.225 7.883 11.986 1.00 0.00 C ATOM 0 H VAL B 14 -10.267 6.938 9.377 1.00 0.00 H new ATOM 0 HA VAL B 14 -12.016 7.919 11.529 1.00 0.00 H new ATOM 0 HB VAL B 14 -9.527 9.194 10.332 1.00 0.00 H new ATOM 0 HG11 VAL B 14 -9.540 10.550 12.391 1.00 0.00 H new ATOM 0 HG12 VAL B 14 -11.024 10.778 11.435 1.00 0.00 H new ATOM 0 HG13 VAL B 14 -11.053 9.760 12.895 1.00 0.00 H new ATOM 0 HG21 VAL B 14 -8.333 8.401 12.339 1.00 0.00 H new ATOM 0 HG22 VAL B 14 -9.785 7.502 12.840 1.00 0.00 H new ATOM 0 HG23 VAL B 14 -8.932 7.052 11.344 1.00 0.00 H new ATOM 1946 N ALA B 15 -13.081 9.822 10.261 1.00 0.00 N ATOM 1947 CA ALA B 15 -13.864 10.757 9.457 1.00 0.00 C ATOM 1948 C ALA B 15 -14.662 10.024 8.386 1.00 0.00 C ATOM 1949 O ALA B 15 -14.299 10.034 7.209 1.00 0.00 O ATOM 1950 CB ALA B 15 -12.957 11.803 8.822 1.00 0.00 C ATOM 0 H ALA B 15 -13.346 9.789 11.246 1.00 0.00 H new ATOM 0 HA ALA B 15 -14.569 11.261 10.118 1.00 0.00 H new ATOM 0 HB1 ALA B 15 -13.557 12.491 8.227 1.00 0.00 H new ATOM 0 HB2 ALA B 15 -12.438 12.357 9.604 1.00 0.00 H new ATOM 0 HB3 ALA B 15 -12.227 11.310 8.180 1.00 0.00 H new ATOM 1956 N ASP B 16 -15.752 9.387 8.803 1.00 0.00 N ATOM 1957 CA ASP B 16 -16.605 8.646 7.882 1.00 0.00 C ATOM 1958 C ASP B 16 -17.157 9.559 6.790 1.00 0.00 C ATOM 1959 O ASP B 16 -17.419 9.116 5.670 1.00 0.00 O ATOM 1960 CB ASP B 16 -17.758 7.986 8.639 1.00 0.00 C ATOM 1961 CG ASP B 16 -18.452 8.943 9.589 1.00 0.00 C ATOM 1962 OD1 ASP B 16 -19.364 9.668 9.141 1.00 0.00 O ATOM 1963 OD2 ASP B 16 -18.083 8.966 10.782 1.00 0.00 O ATOM 0 H ASP B 16 -16.065 9.370 9.774 1.00 0.00 H new ATOM 0 HA ASP B 16 -15.998 7.873 7.411 1.00 0.00 H new ATOM 0 HB2 ASP B 16 -18.484 7.599 7.924 1.00 0.00 H new ATOM 0 HB3 ASP B 16 -17.378 7.133 9.201 1.00 0.00 H new ATOM 1968 N ASP B 17 -17.332 10.837 7.123 1.00 0.00 N ATOM 1969 CA ASP B 17 -17.856 11.815 6.173 1.00 0.00 C ATOM 1970 C ASP B 17 -17.009 11.862 4.904 1.00 0.00 C ATOM 1971 O ASP B 17 -17.532 11.788 3.793 1.00 0.00 O ATOM 1972 CB ASP B 17 -17.904 13.203 6.816 1.00 0.00 C ATOM 1973 CG ASP B 17 -18.876 14.131 6.116 1.00 0.00 C ATOM 1974 OD1 ASP B 17 -19.884 13.634 5.573 1.00 0.00 O ATOM 1975 OD2 ASP B 17 -18.630 15.356 6.113 1.00 0.00 O ATOM 0 H ASP B 17 -17.118 11.219 8.044 1.00 0.00 H new ATOM 0 HA ASP B 17 -18.865 11.508 5.899 1.00 0.00 H new ATOM 0 HB2 ASP B 17 -18.189 13.105 7.863 1.00 0.00 H new ATOM 0 HB3 ASP B 17 -16.907 13.644 6.797 1.00 0.00 H new ATOM 1980 N VAL B 18 -15.699 11.982 5.078 1.00 0.00 N ATOM 1981 CA VAL B 18 -14.779 12.032 3.948 1.00 0.00 C ATOM 1982 C VAL B 18 -14.480 10.634 3.420 1.00 0.00 C ATOM 1983 O VAL B 18 -14.229 10.448 2.229 1.00 0.00 O ATOM 1984 CB VAL B 18 -13.455 12.716 4.339 1.00 0.00 C ATOM 1985 CG1 VAL B 18 -12.581 12.930 3.113 1.00 0.00 C ATOM 1986 CG2 VAL B 18 -13.723 14.033 5.049 1.00 0.00 C ATOM 0 H VAL B 18 -15.249 12.047 5.991 1.00 0.00 H new ATOM 0 HA VAL B 18 -15.266 12.614 3.166 1.00 0.00 H new ATOM 0 HB VAL B 18 -12.920 12.062 5.027 1.00 0.00 H new ATOM 0 HG11 VAL B 18 -11.651 13.414 3.410 1.00 0.00 H new ATOM 0 HG12 VAL B 18 -12.358 11.968 2.652 1.00 0.00 H new ATOM 0 HG13 VAL B 18 -13.107 13.562 2.397 1.00 0.00 H new ATOM 0 HG21 VAL B 18 -12.776 14.501 5.317 1.00 0.00 H new ATOM 0 HG22 VAL B 18 -14.281 14.696 4.388 1.00 0.00 H new ATOM 0 HG23 VAL B 18 -14.305 13.848 5.952 1.00 0.00 H new ATOM 1996 N SER B 19 -14.500 9.653 4.316 1.00 0.00 N ATOM 1997 CA SER B 19 -14.221 8.271 3.944 1.00 0.00 C ATOM 1998 C SER B 19 -15.200 7.767 2.888 1.00 0.00 C ATOM 1999 O SER B 19 -14.812 7.060 1.958 1.00 0.00 O ATOM 2000 CB SER B 19 -14.269 7.367 5.180 1.00 0.00 C ATOM 2001 OG SER B 19 -15.589 6.924 5.446 1.00 0.00 O ATOM 0 H SER B 19 -14.707 9.790 5.305 1.00 0.00 H new ATOM 0 HA SER B 19 -13.219 8.239 3.516 1.00 0.00 H new ATOM 0 HB2 SER B 19 -13.618 6.506 5.028 1.00 0.00 H new ATOM 0 HB3 SER B 19 -13.884 7.909 6.044 1.00 0.00 H new ATOM 0 HG SER B 19 -16.206 7.683 5.391 1.00 0.00 H new ATOM 2007 N ASN B 20 -16.472 8.121 3.039 1.00 0.00 N ATOM 2008 CA ASN B 20 -17.493 7.687 2.093 1.00 0.00 C ATOM 2009 C ASN B 20 -17.332 8.380 0.741 1.00 0.00 C ATOM 2010 O ASN B 20 -17.458 7.747 -0.303 1.00 0.00 O ATOM 2011 CB ASN B 20 -18.894 7.944 2.657 1.00 0.00 C ATOM 2012 CG ASN B 20 -19.210 9.419 2.799 1.00 0.00 C ATOM 2013 OD1 ASN B 20 -19.397 10.126 1.808 1.00 0.00 O ATOM 2014 ND2 ASN B 20 -19.272 9.893 4.037 1.00 0.00 N ATOM 0 H ASN B 20 -16.819 8.703 3.802 1.00 0.00 H new ATOM 0 HA ASN B 20 -17.366 6.615 1.939 1.00 0.00 H new ATOM 0 HB2 ASN B 20 -19.634 7.480 2.005 1.00 0.00 H new ATOM 0 HB3 ASN B 20 -18.982 7.463 3.631 1.00 0.00 H new ATOM 0 HD21 ASN B 20 -19.481 10.879 4.196 1.00 0.00 H new ATOM 0 HD22 ASN B 20 -19.110 9.272 4.830 1.00 0.00 H new ATOM 2021 N ILE B 21 -17.054 9.683 0.768 1.00 0.00 N ATOM 2022 CA ILE B 21 -16.886 10.464 -0.459 1.00 0.00 C ATOM 2023 C ILE B 21 -15.813 9.856 -1.364 1.00 0.00 C ATOM 2024 O ILE B 21 -16.058 9.602 -2.544 1.00 0.00 O ATOM 2025 CB ILE B 21 -16.500 11.932 -0.126 1.00 0.00 C ATOM 2026 CG1 ILE B 21 -17.614 12.606 0.673 1.00 0.00 C ATOM 2027 CG2 ILE B 21 -16.196 12.738 -1.389 1.00 0.00 C ATOM 2028 CD1 ILE B 21 -17.309 14.040 1.046 1.00 0.00 C ATOM 0 H ILE B 21 -16.940 10.221 1.627 1.00 0.00 H new ATOM 0 HA ILE B 21 -17.840 10.448 -0.985 1.00 0.00 H new ATOM 0 HB ILE B 21 -15.592 11.904 0.477 1.00 0.00 H new ATOM 0 HG12 ILE B 21 -18.535 12.579 0.091 1.00 0.00 H new ATOM 0 HG13 ILE B 21 -17.795 12.033 1.583 1.00 0.00 H new ATOM 0 HG21 ILE B 21 -15.930 13.759 -1.114 1.00 0.00 H new ATOM 0 HG22 ILE B 21 -15.364 12.278 -1.923 1.00 0.00 H new ATOM 0 HG23 ILE B 21 -17.076 12.753 -2.032 1.00 0.00 H new ATOM 0 HD11 ILE B 21 -18.144 14.454 1.611 1.00 0.00 H new ATOM 0 HD12 ILE B 21 -16.406 14.073 1.655 1.00 0.00 H new ATOM 0 HD13 ILE B 21 -17.157 14.627 0.140 1.00 0.00 H new ATOM 2040 N ILE B 22 -14.628 9.644 -0.815 1.00 0.00 N ATOM 2041 CA ILE B 22 -13.528 9.090 -1.590 1.00 0.00 C ATOM 2042 C ILE B 22 -13.876 7.715 -2.162 1.00 0.00 C ATOM 2043 O ILE B 22 -13.688 7.472 -3.352 1.00 0.00 O ATOM 2044 CB ILE B 22 -12.232 9.004 -0.754 1.00 0.00 C ATOM 2045 CG1 ILE B 22 -11.061 8.544 -1.625 1.00 0.00 C ATOM 2046 CG2 ILE B 22 -12.414 8.078 0.439 1.00 0.00 C ATOM 2047 CD1 ILE B 22 -10.722 9.509 -2.740 1.00 0.00 C ATOM 0 H ILE B 22 -14.403 9.846 0.159 1.00 0.00 H new ATOM 0 HA ILE B 22 -13.356 9.773 -2.422 1.00 0.00 H new ATOM 0 HB ILE B 22 -12.006 10.000 -0.373 1.00 0.00 H new ATOM 0 HG12 ILE B 22 -10.182 8.406 -0.995 1.00 0.00 H new ATOM 0 HG13 ILE B 22 -11.300 7.572 -2.057 1.00 0.00 H new ATOM 0 HG21 ILE B 22 -11.487 8.035 1.011 1.00 0.00 H new ATOM 0 HG22 ILE B 22 -13.215 8.456 1.074 1.00 0.00 H new ATOM 0 HG23 ILE B 22 -12.670 7.078 0.088 1.00 0.00 H new ATOM 0 HD11 ILE B 22 -9.883 9.119 -3.316 1.00 0.00 H new ATOM 0 HD12 ILE B 22 -11.586 9.629 -3.393 1.00 0.00 H new ATOM 0 HD13 ILE B 22 -10.452 10.476 -2.315 1.00 0.00 H new ATOM 2059 N LYS B 23 -14.385 6.816 -1.323 1.00 0.00 N ATOM 2060 CA LYS B 23 -14.743 5.476 -1.779 1.00 0.00 C ATOM 2061 C LYS B 23 -15.846 5.520 -2.817 1.00 0.00 C ATOM 2062 O LYS B 23 -15.699 4.979 -3.912 1.00 0.00 O ATOM 2063 CB LYS B 23 -15.158 4.606 -0.603 1.00 0.00 C ATOM 2064 CG LYS B 23 -13.975 4.010 0.131 1.00 0.00 C ATOM 2065 CD LYS B 23 -14.422 3.189 1.331 1.00 0.00 C ATOM 2066 CE LYS B 23 -13.770 1.816 1.346 1.00 0.00 C ATOM 2067 NZ LYS B 23 -13.222 1.472 2.687 1.00 0.00 N ATOM 0 H LYS B 23 -14.558 6.989 -0.333 1.00 0.00 H new ATOM 0 HA LYS B 23 -13.861 5.039 -2.247 1.00 0.00 H new ATOM 0 HB2 LYS B 23 -15.749 5.201 0.093 1.00 0.00 H new ATOM 0 HB3 LYS B 23 -15.801 3.802 -0.961 1.00 0.00 H new ATOM 0 HG2 LYS B 23 -13.402 3.380 -0.550 1.00 0.00 H new ATOM 0 HG3 LYS B 23 -13.310 4.808 0.462 1.00 0.00 H new ATOM 0 HD2 LYS B 23 -14.172 3.721 2.249 1.00 0.00 H new ATOM 0 HD3 LYS B 23 -15.506 3.077 1.312 1.00 0.00 H new ATOM 0 HE2 LYS B 23 -14.502 1.064 1.050 1.00 0.00 H new ATOM 0 HE3 LYS B 23 -12.968 1.788 0.609 1.00 0.00 H new ATOM 0 HZ1 LYS B 23 -12.562 0.673 2.598 1.00 0.00 H new ATOM 0 HZ2 LYS B 23 -12.720 2.294 3.078 1.00 0.00 H new ATOM 0 HZ3 LYS B 23 -14.001 1.208 3.323 1.00 0.00 H new ATOM 2081 N GLU B 24 -16.947 6.186 -2.485 1.00 0.00 N ATOM 2082 CA GLU B 24 -18.067 6.316 -3.417 1.00 0.00 C ATOM 2083 C GLU B 24 -17.566 6.832 -4.762 1.00 0.00 C ATOM 2084 O GLU B 24 -18.061 6.440 -5.819 1.00 0.00 O ATOM 2085 CB GLU B 24 -19.137 7.258 -2.851 1.00 0.00 C ATOM 2086 CG GLU B 24 -20.326 6.534 -2.238 1.00 0.00 C ATOM 2087 CD GLU B 24 -19.919 5.577 -1.135 1.00 0.00 C ATOM 2088 OE1 GLU B 24 -19.138 4.644 -1.416 1.00 0.00 O ATOM 2089 OE2 GLU B 24 -20.384 5.760 0.010 1.00 0.00 O ATOM 0 H GLU B 24 -17.090 6.642 -1.584 1.00 0.00 H new ATOM 0 HA GLU B 24 -18.518 5.334 -3.558 1.00 0.00 H new ATOM 0 HB2 GLU B 24 -18.682 7.897 -2.094 1.00 0.00 H new ATOM 0 HB3 GLU B 24 -19.492 7.911 -3.648 1.00 0.00 H new ATOM 0 HG2 GLU B 24 -21.027 7.267 -1.838 1.00 0.00 H new ATOM 0 HG3 GLU B 24 -20.852 5.982 -3.017 1.00 0.00 H new ATOM 2096 N SER B 25 -16.565 7.705 -4.704 1.00 0.00 N ATOM 2097 CA SER B 25 -15.979 8.262 -5.908 1.00 0.00 C ATOM 2098 C SER B 25 -15.173 7.201 -6.647 1.00 0.00 C ATOM 2099 O SER B 25 -15.348 7.034 -7.842 1.00 0.00 O ATOM 2100 CB SER B 25 -15.088 9.459 -5.569 1.00 0.00 C ATOM 2101 OG SER B 25 -15.856 10.642 -5.425 1.00 0.00 O ATOM 0 H SER B 25 -16.147 8.039 -3.836 1.00 0.00 H new ATOM 0 HA SER B 25 -16.787 8.603 -6.555 1.00 0.00 H new ATOM 0 HB2 SER B 25 -14.543 9.261 -4.646 1.00 0.00 H new ATOM 0 HB3 SER B 25 -14.345 9.597 -6.354 1.00 0.00 H new ATOM 0 HG SER B 25 -15.257 11.410 -5.316 1.00 0.00 H new ATOM 2107 N ILE B 26 -14.316 6.461 -5.934 1.00 0.00 N ATOM 2108 CA ILE B 26 -13.521 5.399 -6.565 1.00 0.00 C ATOM 2109 C ILE B 26 -14.451 4.377 -7.199 1.00 0.00 C ATOM 2110 O ILE B 26 -14.258 3.949 -8.332 1.00 0.00 O ATOM 2111 CB ILE B 26 -12.558 4.709 -5.545 1.00 0.00 C ATOM 2112 CG1 ILE B 26 -11.269 5.505 -5.447 1.00 0.00 C ATOM 2113 CG2 ILE B 26 -12.227 3.258 -5.915 1.00 0.00 C ATOM 2114 CD1 ILE B 26 -11.369 6.683 -4.518 1.00 0.00 C ATOM 0 H ILE B 26 -14.156 6.575 -4.933 1.00 0.00 H new ATOM 0 HA ILE B 26 -12.898 5.852 -7.336 1.00 0.00 H new ATOM 0 HB ILE B 26 -13.077 4.686 -4.587 1.00 0.00 H new ATOM 0 HG12 ILE B 26 -10.469 4.848 -5.105 1.00 0.00 H new ATOM 0 HG13 ILE B 26 -10.990 5.857 -6.440 1.00 0.00 H new ATOM 0 HG21 ILE B 26 -11.555 2.836 -5.168 1.00 0.00 H new ATOM 0 HG22 ILE B 26 -13.146 2.672 -5.949 1.00 0.00 H new ATOM 0 HG23 ILE B 26 -11.745 3.233 -6.892 1.00 0.00 H new ATOM 0 HD11 ILE B 26 -10.415 7.209 -4.493 1.00 0.00 H new ATOM 0 HD12 ILE B 26 -12.147 7.360 -4.871 1.00 0.00 H new ATOM 0 HD13 ILE B 26 -11.618 6.336 -3.515 1.00 0.00 H new ATOM 2126 N ASP B 27 -15.476 4.001 -6.457 1.00 0.00 N ATOM 2127 CA ASP B 27 -16.452 3.040 -6.941 1.00 0.00 C ATOM 2128 C ASP B 27 -16.950 3.453 -8.332 1.00 0.00 C ATOM 2129 O ASP B 27 -17.148 2.622 -9.216 1.00 0.00 O ATOM 2130 CB ASP B 27 -17.609 2.972 -5.932 1.00 0.00 C ATOM 2131 CG ASP B 27 -18.789 2.149 -6.422 1.00 0.00 C ATOM 2132 OD1 ASP B 27 -18.805 0.926 -6.167 1.00 0.00 O ATOM 2133 OD2 ASP B 27 -19.693 2.727 -7.059 1.00 0.00 O ATOM 0 H ASP B 27 -15.655 4.347 -5.514 1.00 0.00 H new ATOM 0 HA ASP B 27 -16.000 2.052 -7.034 1.00 0.00 H new ATOM 0 HB2 ASP B 27 -17.242 2.547 -4.998 1.00 0.00 H new ATOM 0 HB3 ASP B 27 -17.948 3.984 -5.710 1.00 0.00 H new ATOM 2138 N ALA B 28 -17.117 4.755 -8.515 1.00 0.00 N ATOM 2139 CA ALA B 28 -17.577 5.304 -9.785 1.00 0.00 C ATOM 2140 C ALA B 28 -16.420 5.614 -10.738 1.00 0.00 C ATOM 2141 O ALA B 28 -16.496 5.334 -11.932 1.00 0.00 O ATOM 2142 CB ALA B 28 -18.389 6.565 -9.527 1.00 0.00 C ATOM 0 H ALA B 28 -16.940 5.456 -7.795 1.00 0.00 H new ATOM 0 HA ALA B 28 -18.198 4.549 -10.267 1.00 0.00 H new ATOM 0 HB1 ALA B 28 -18.733 6.976 -10.476 1.00 0.00 H new ATOM 0 HB2 ALA B 28 -19.249 6.323 -8.903 1.00 0.00 H new ATOM 0 HB3 ALA B 28 -17.767 7.301 -9.017 1.00 0.00 H new ATOM 2148 N VAL B 29 -15.360 6.198 -10.195 1.00 0.00 N ATOM 2149 CA VAL B 29 -14.187 6.575 -10.964 1.00 0.00 C ATOM 2150 C VAL B 29 -13.375 5.347 -11.393 1.00 0.00 C ATOM 2151 O VAL B 29 -12.455 5.453 -12.205 1.00 0.00 O ATOM 2152 CB VAL B 29 -13.377 7.643 -10.145 1.00 0.00 C ATOM 2153 CG1 VAL B 29 -11.866 7.495 -10.154 1.00 0.00 C ATOM 2154 CG2 VAL B 29 -13.731 9.022 -10.639 1.00 0.00 C ATOM 0 H VAL B 29 -15.292 6.424 -9.203 1.00 0.00 H new ATOM 0 HA VAL B 29 -14.477 7.040 -11.906 1.00 0.00 H new ATOM 0 HB VAL B 29 -13.673 7.476 -9.109 1.00 0.00 H new ATOM 0 HG11 VAL B 29 -11.419 8.289 -9.555 1.00 0.00 H new ATOM 0 HG12 VAL B 29 -11.593 6.527 -9.735 1.00 0.00 H new ATOM 0 HG13 VAL B 29 -11.500 7.563 -11.178 1.00 0.00 H new ATOM 0 HG21 VAL B 29 -13.171 9.766 -10.073 1.00 0.00 H new ATOM 0 HG22 VAL B 29 -13.480 9.105 -11.696 1.00 0.00 H new ATOM 0 HG23 VAL B 29 -14.799 9.193 -10.506 1.00 0.00 H new ATOM 2164 N LEU B 30 -13.744 4.169 -10.884 1.00 0.00 N ATOM 2165 CA LEU B 30 -13.064 2.942 -11.257 1.00 0.00 C ATOM 2166 C LEU B 30 -14.030 1.941 -11.902 1.00 0.00 C ATOM 2167 O LEU B 30 -13.620 1.151 -12.753 1.00 0.00 O ATOM 2168 CB LEU B 30 -12.364 2.330 -10.044 1.00 0.00 C ATOM 2169 CG LEU B 30 -11.083 3.058 -9.623 1.00 0.00 C ATOM 2170 CD1 LEU B 30 -10.040 2.946 -10.700 1.00 0.00 C ATOM 2171 CD2 LEU B 30 -11.341 4.523 -9.364 1.00 0.00 C ATOM 0 H LEU B 30 -14.506 4.047 -10.217 1.00 0.00 H new ATOM 0 HA LEU B 30 -12.307 3.188 -12.002 1.00 0.00 H new ATOM 0 HB2 LEU B 30 -13.058 2.324 -9.203 1.00 0.00 H new ATOM 0 HB3 LEU B 30 -12.122 1.290 -10.265 1.00 0.00 H new ATOM 0 HG LEU B 30 -10.732 2.587 -8.705 1.00 0.00 H new ATOM 0 HD11 LEU B 30 -9.136 3.468 -10.387 1.00 0.00 H new ATOM 0 HD12 LEU B 30 -9.810 1.895 -10.876 1.00 0.00 H new ATOM 0 HD13 LEU B 30 -10.417 3.394 -11.620 1.00 0.00 H new ATOM 0 HD21 LEU B 30 -10.412 5.009 -9.067 1.00 0.00 H new ATOM 0 HD22 LEU B 30 -11.722 4.991 -10.271 1.00 0.00 H new ATOM 0 HD23 LEU B 30 -12.076 4.627 -8.566 1.00 0.00 H new ATOM 2183 N GLN B 31 -15.312 1.972 -11.516 1.00 0.00 N ATOM 2184 CA GLN B 31 -16.287 1.053 -12.101 1.00 0.00 C ATOM 2185 C GLN B 31 -16.925 1.625 -13.371 1.00 0.00 C ATOM 2186 O GLN B 31 -17.504 0.880 -14.161 1.00 0.00 O ATOM 2187 CB GLN B 31 -17.378 0.708 -11.091 1.00 0.00 C ATOM 2188 CG GLN B 31 -18.139 -0.547 -11.438 1.00 0.00 C ATOM 2189 CD GLN B 31 -19.109 -0.965 -10.351 1.00 0.00 C ATOM 2190 OE1 GLN B 31 -18.795 -0.899 -9.162 1.00 0.00 O ATOM 2191 NE2 GLN B 31 -20.298 -1.398 -10.753 1.00 0.00 N ATOM 0 H GLN B 31 -15.689 2.610 -10.816 1.00 0.00 H new ATOM 0 HA GLN B 31 -15.745 0.147 -12.373 1.00 0.00 H new ATOM 0 HB2 GLN B 31 -16.927 0.590 -10.106 1.00 0.00 H new ATOM 0 HB3 GLN B 31 -18.077 1.541 -11.024 1.00 0.00 H new ATOM 0 HG2 GLN B 31 -18.687 -0.389 -12.367 1.00 0.00 H new ATOM 0 HG3 GLN B 31 -17.432 -1.357 -11.619 1.00 0.00 H new ATOM 0 HE21 GLN B 31 -20.517 -1.437 -11.748 1.00 0.00 H new ATOM 0 HE22 GLN B 31 -20.993 -1.692 -10.066 1.00 0.00 H new ATOM 2200 N ASN B 32 -16.832 2.945 -13.571 1.00 0.00 N ATOM 2201 CA ASN B 32 -17.423 3.580 -14.757 1.00 0.00 C ATOM 2202 C ASN B 32 -16.986 2.893 -16.051 1.00 0.00 C ATOM 2203 O ASN B 32 -17.810 2.599 -16.916 1.00 0.00 O ATOM 2204 CB ASN B 32 -17.060 5.069 -14.824 1.00 0.00 C ATOM 2205 CG ASN B 32 -15.569 5.305 -15.005 1.00 0.00 C ATOM 2206 OD1 ASN B 32 -15.092 5.484 -16.126 1.00 0.00 O ATOM 2207 ND2 ASN B 32 -14.827 5.306 -13.905 1.00 0.00 N ATOM 0 H ASN B 32 -16.359 3.588 -12.936 1.00 0.00 H new ATOM 0 HA ASN B 32 -18.504 3.476 -14.660 1.00 0.00 H new ATOM 0 HB2 ASN B 32 -17.599 5.533 -15.650 1.00 0.00 H new ATOM 0 HB3 ASN B 32 -17.393 5.561 -13.910 1.00 0.00 H new ATOM 0 HD21 ASN B 32 -13.821 5.459 -13.969 1.00 0.00 H new ATOM 0 HD22 ASN B 32 -15.263 5.154 -12.996 1.00 0.00 H new ATOM 2214 N GLN B 33 -15.685 2.647 -16.182 1.00 0.00 N ATOM 2215 CA GLN B 33 -15.147 2.006 -17.376 1.00 0.00 C ATOM 2216 C GLN B 33 -14.412 0.717 -17.026 1.00 0.00 C ATOM 2217 O GLN B 33 -14.441 0.262 -15.883 1.00 0.00 O ATOM 2218 CB GLN B 33 -14.204 2.962 -18.110 1.00 0.00 C ATOM 2219 CG GLN B 33 -14.311 2.879 -19.625 1.00 0.00 C ATOM 2220 CD GLN B 33 -15.016 4.079 -20.229 1.00 0.00 C ATOM 2221 OE1 GLN B 33 -14.400 5.117 -20.473 1.00 0.00 O ATOM 2222 NE2 GLN B 33 -16.314 3.942 -20.472 1.00 0.00 N ATOM 0 H GLN B 33 -14.986 2.882 -15.477 1.00 0.00 H new ATOM 0 HA GLN B 33 -15.983 1.755 -18.028 1.00 0.00 H new ATOM 0 HB2 GLN B 33 -14.418 3.983 -17.794 1.00 0.00 H new ATOM 0 HB3 GLN B 33 -13.178 2.745 -17.814 1.00 0.00 H new ATOM 0 HG2 GLN B 33 -13.311 2.797 -20.052 1.00 0.00 H new ATOM 0 HG3 GLN B 33 -14.849 1.971 -19.898 1.00 0.00 H new ATOM 0 HE21 GLN B 33 -16.784 3.063 -20.254 1.00 0.00 H new ATOM 0 HE22 GLN B 33 -16.841 4.715 -20.877 1.00 0.00 H new ATOM 2231 N GLN B 34 -13.752 0.133 -18.022 1.00 0.00 N ATOM 2232 CA GLN B 34 -13.007 -1.103 -17.827 1.00 0.00 C ATOM 2233 C GLN B 34 -11.560 -0.814 -17.445 1.00 0.00 C ATOM 2234 O GLN B 34 -11.119 0.336 -17.461 1.00 0.00 O ATOM 2235 CB GLN B 34 -13.051 -1.953 -19.099 1.00 0.00 C ATOM 2236 CG GLN B 34 -12.894 -3.443 -18.841 1.00 0.00 C ATOM 2237 CD GLN B 34 -13.853 -4.281 -19.662 1.00 0.00 C ATOM 2238 OE1 GLN B 34 -13.952 -4.120 -20.879 1.00 0.00 O ATOM 2239 NE2 GLN B 34 -14.565 -5.184 -18.999 1.00 0.00 N ATOM 0 H GLN B 34 -13.719 0.498 -18.974 1.00 0.00 H new ATOM 0 HA GLN B 34 -13.474 -1.655 -17.011 1.00 0.00 H new ATOM 0 HB2 GLN B 34 -13.998 -1.779 -19.610 1.00 0.00 H new ATOM 0 HB3 GLN B 34 -12.260 -1.624 -19.773 1.00 0.00 H new ATOM 0 HG2 GLN B 34 -11.871 -3.741 -19.068 1.00 0.00 H new ATOM 0 HG3 GLN B 34 -13.057 -3.644 -17.782 1.00 0.00 H new ATOM 0 HE21 GLN B 34 -14.451 -5.283 -17.990 1.00 0.00 H new ATOM 0 HE22 GLN B 34 -15.226 -5.779 -19.498 1.00 0.00 H new ATOM 2248 N TYR B 35 -10.824 -1.865 -17.103 1.00 0.00 N ATOM 2249 CA TYR B 35 -9.426 -1.731 -16.717 1.00 0.00 C ATOM 2250 C TYR B 35 -8.597 -1.178 -17.878 1.00 0.00 C ATOM 2251 O TYR B 35 -8.379 -1.873 -18.870 1.00 0.00 O ATOM 2252 CB TYR B 35 -8.898 -3.109 -16.278 1.00 0.00 C ATOM 2253 CG TYR B 35 -7.393 -3.210 -16.108 1.00 0.00 C ATOM 2254 CD1 TYR B 35 -6.630 -2.111 -15.736 1.00 0.00 C ATOM 2255 CD2 TYR B 35 -6.739 -4.419 -16.318 1.00 0.00 C ATOM 2256 CE1 TYR B 35 -5.260 -2.215 -15.578 1.00 0.00 C ATOM 2257 CE2 TYR B 35 -5.372 -4.529 -16.163 1.00 0.00 C ATOM 2258 CZ TYR B 35 -4.637 -3.424 -15.793 1.00 0.00 C ATOM 2259 OH TYR B 35 -3.274 -3.529 -15.637 1.00 0.00 O ATOM 0 H TYR B 35 -11.175 -2.823 -17.085 1.00 0.00 H new ATOM 0 HA TYR B 35 -9.342 -1.029 -15.888 1.00 0.00 H new ATOM 0 HB2 TYR B 35 -9.371 -3.375 -15.333 1.00 0.00 H new ATOM 0 HB3 TYR B 35 -9.213 -3.850 -17.012 1.00 0.00 H new ATOM 0 HD1 TYR B 35 -7.114 -1.160 -15.567 1.00 0.00 H new ATOM 0 HD2 TYR B 35 -7.311 -5.288 -16.608 1.00 0.00 H new ATOM 0 HE1 TYR B 35 -4.681 -1.351 -15.287 1.00 0.00 H new ATOM 0 HE2 TYR B 35 -4.881 -5.476 -16.331 1.00 0.00 H new ATOM 0 HH TYR B 35 -2.993 -4.449 -15.825 1.00 0.00 H new ATOM 2269 N SER B 36 -8.130 0.071 -17.758 1.00 0.00 N ATOM 2270 CA SER B 36 -7.326 0.667 -18.826 1.00 0.00 C ATOM 2271 C SER B 36 -6.024 1.250 -18.282 1.00 0.00 C ATOM 2272 O SER B 36 -6.047 2.125 -17.422 1.00 0.00 O ATOM 2273 CB SER B 36 -8.126 1.757 -19.542 1.00 0.00 C ATOM 2274 OG SER B 36 -8.792 1.236 -20.680 1.00 0.00 O ATOM 0 H SER B 36 -8.291 0.674 -16.952 1.00 0.00 H new ATOM 0 HA SER B 36 -7.074 -0.121 -19.535 1.00 0.00 H new ATOM 0 HB2 SER B 36 -8.855 2.188 -18.856 1.00 0.00 H new ATOM 0 HB3 SER B 36 -7.458 2.563 -19.845 1.00 0.00 H new ATOM 0 HG SER B 36 -9.298 1.951 -21.119 1.00 0.00 H new ATOM 2280 N GLU B 37 -4.888 0.775 -18.803 1.00 0.00 N ATOM 2281 CA GLU B 37 -3.575 1.270 -18.372 1.00 0.00 C ATOM 2282 C GLU B 37 -3.481 2.779 -18.572 1.00 0.00 C ATOM 2283 O GLU B 37 -2.828 3.478 -17.802 1.00 0.00 O ATOM 2284 CB GLU B 37 -2.458 0.567 -19.146 1.00 0.00 C ATOM 2285 CG GLU B 37 -1.062 0.988 -18.716 1.00 0.00 C ATOM 2286 CD GLU B 37 -0.358 -0.072 -17.892 1.00 0.00 C ATOM 2287 OE1 GLU B 37 -0.902 -0.464 -16.838 1.00 0.00 O ATOM 2288 OE2 GLU B 37 0.737 -0.511 -18.300 1.00 0.00 O ATOM 0 H GLU B 37 -4.850 0.051 -19.521 1.00 0.00 H new ATOM 0 HA GLU B 37 -3.458 1.050 -17.311 1.00 0.00 H new ATOM 0 HB2 GLU B 37 -2.560 -0.510 -19.016 1.00 0.00 H new ATOM 0 HB3 GLU B 37 -2.579 0.773 -20.210 1.00 0.00 H new ATOM 0 HG2 GLU B 37 -0.465 1.210 -19.601 1.00 0.00 H new ATOM 0 HG3 GLU B 37 -1.127 1.909 -18.136 1.00 0.00 H new ATOM 2295 N ALA B 38 -4.174 3.283 -19.585 1.00 0.00 N ATOM 2296 CA ALA B 38 -4.199 4.719 -19.838 1.00 0.00 C ATOM 2297 C ALA B 38 -5.119 5.427 -18.841 1.00 0.00 C ATOM 2298 O ALA B 38 -5.195 6.652 -18.819 1.00 0.00 O ATOM 2299 CB ALA B 38 -4.655 5.001 -21.259 1.00 0.00 C ATOM 0 H ALA B 38 -4.722 2.725 -20.240 1.00 0.00 H new ATOM 0 HA ALA B 38 -3.187 5.104 -19.711 1.00 0.00 H new ATOM 0 HB1 ALA B 38 -4.668 6.077 -21.430 1.00 0.00 H new ATOM 0 HB2 ALA B 38 -3.968 4.530 -21.962 1.00 0.00 H new ATOM 0 HB3 ALA B 38 -5.657 4.598 -21.406 1.00 0.00 H new ATOM 2305 N LYS B 39 -5.823 4.639 -18.028 1.00 0.00 N ATOM 2306 CA LYS B 39 -6.738 5.155 -17.035 1.00 0.00 C ATOM 2307 C LYS B 39 -6.303 4.755 -15.618 1.00 0.00 C ATOM 2308 O LYS B 39 -6.810 5.286 -14.641 1.00 0.00 O ATOM 2309 CB LYS B 39 -8.132 4.604 -17.321 1.00 0.00 C ATOM 2310 CG LYS B 39 -9.064 5.600 -17.976 1.00 0.00 C ATOM 2311 CD LYS B 39 -8.548 6.039 -19.330 1.00 0.00 C ATOM 2312 CE LYS B 39 -8.923 5.047 -20.419 1.00 0.00 C ATOM 2313 NZ LYS B 39 -9.106 5.713 -21.738 1.00 0.00 N ATOM 0 H LYS B 39 -5.767 3.621 -18.048 1.00 0.00 H new ATOM 0 HA LYS B 39 -6.741 6.244 -17.089 1.00 0.00 H new ATOM 0 HB2 LYS B 39 -8.041 3.729 -17.965 1.00 0.00 H new ATOM 0 HB3 LYS B 39 -8.577 4.266 -16.385 1.00 0.00 H new ATOM 0 HG2 LYS B 39 -10.052 5.154 -18.090 1.00 0.00 H new ATOM 0 HG3 LYS B 39 -9.179 6.470 -17.330 1.00 0.00 H new ATOM 0 HD2 LYS B 39 -8.955 7.020 -19.575 1.00 0.00 H new ATOM 0 HD3 LYS B 39 -7.464 6.144 -19.290 1.00 0.00 H new ATOM 0 HE2 LYS B 39 -8.146 4.287 -20.501 1.00 0.00 H new ATOM 0 HE3 LYS B 39 -9.843 4.533 -20.141 1.00 0.00 H new ATOM 0 HZ1 LYS B 39 -9.361 5.002 -22.453 1.00 0.00 H new ATOM 0 HZ2 LYS B 39 -9.865 6.421 -21.667 1.00 0.00 H new ATOM 0 HZ3 LYS B 39 -8.220 6.182 -22.016 1.00 0.00 H new ATOM 2327 N VAL B 40 -5.376 3.802 -15.506 1.00 0.00 N ATOM 2328 CA VAL B 40 -4.907 3.337 -14.200 1.00 0.00 C ATOM 2329 C VAL B 40 -4.500 4.500 -13.295 1.00 0.00 C ATOM 2330 O VAL B 40 -4.651 4.430 -12.075 1.00 0.00 O ATOM 2331 CB VAL B 40 -3.720 2.362 -14.341 1.00 0.00 C ATOM 2332 CG1 VAL B 40 -4.176 1.052 -14.958 1.00 0.00 C ATOM 2333 CG2 VAL B 40 -2.591 2.992 -15.147 1.00 0.00 C ATOM 0 H VAL B 40 -4.937 3.339 -16.301 1.00 0.00 H new ATOM 0 HA VAL B 40 -5.746 2.814 -13.741 1.00 0.00 H new ATOM 0 HB VAL B 40 -3.332 2.147 -13.345 1.00 0.00 H new ATOM 0 HG11 VAL B 40 -3.325 0.377 -15.049 1.00 0.00 H new ATOM 0 HG12 VAL B 40 -4.935 0.595 -14.323 1.00 0.00 H new ATOM 0 HG13 VAL B 40 -4.596 1.242 -15.946 1.00 0.00 H new ATOM 0 HG21 VAL B 40 -1.766 2.285 -15.232 1.00 0.00 H new ATOM 0 HG22 VAL B 40 -2.954 3.248 -16.143 1.00 0.00 H new ATOM 0 HG23 VAL B 40 -2.244 3.895 -14.644 1.00 0.00 H new ATOM 2343 N SER B 41 -3.996 5.573 -13.899 1.00 0.00 N ATOM 2344 CA SER B 41 -3.585 6.753 -13.138 1.00 0.00 C ATOM 2345 C SER B 41 -4.582 7.883 -13.331 1.00 0.00 C ATOM 2346 O SER B 41 -4.811 8.683 -12.424 1.00 0.00 O ATOM 2347 CB SER B 41 -2.185 7.204 -13.556 1.00 0.00 C ATOM 2348 OG SER B 41 -1.608 8.049 -12.576 1.00 0.00 O ATOM 0 H SER B 41 -3.862 5.651 -14.907 1.00 0.00 H new ATOM 0 HA SER B 41 -3.560 6.486 -12.081 1.00 0.00 H new ATOM 0 HB2 SER B 41 -1.549 6.332 -13.709 1.00 0.00 H new ATOM 0 HB3 SER B 41 -2.238 7.731 -14.509 1.00 0.00 H new ATOM 0 HG SER B 41 -1.124 8.778 -13.017 1.00 0.00 H new ATOM 2354 N GLN B 42 -5.194 7.934 -14.503 1.00 0.00 N ATOM 2355 CA GLN B 42 -6.189 8.954 -14.783 1.00 0.00 C ATOM 2356 C GLN B 42 -7.427 8.702 -13.941 1.00 0.00 C ATOM 2357 O GLN B 42 -8.098 9.633 -13.500 1.00 0.00 O ATOM 2358 CB GLN B 42 -6.532 8.979 -16.270 1.00 0.00 C ATOM 2359 CG GLN B 42 -5.311 9.056 -17.182 1.00 0.00 C ATOM 2360 CD GLN B 42 -4.268 10.074 -16.740 1.00 0.00 C ATOM 2361 OE1 GLN B 42 -3.072 9.882 -16.961 1.00 0.00 O ATOM 2362 NE2 GLN B 42 -4.707 11.162 -16.113 1.00 0.00 N ATOM 0 H GLN B 42 -5.020 7.285 -15.271 1.00 0.00 H new ATOM 0 HA GLN B 42 -5.782 9.931 -14.523 1.00 0.00 H new ATOM 0 HB2 GLN B 42 -7.103 8.084 -16.517 1.00 0.00 H new ATOM 0 HB3 GLN B 42 -7.178 9.834 -16.470 1.00 0.00 H new ATOM 0 HG2 GLN B 42 -4.845 8.072 -17.231 1.00 0.00 H new ATOM 0 HG3 GLN B 42 -5.640 9.303 -18.191 1.00 0.00 H new ATOM 0 HE21 GLN B 42 -5.706 11.287 -15.947 1.00 0.00 H new ATOM 0 HE22 GLN B 42 -4.045 11.871 -15.798 1.00 0.00 H new ATOM 2371 N TRP B 43 -7.694 7.424 -13.679 1.00 0.00 N ATOM 2372 CA TRP B 43 -8.806 7.006 -12.843 1.00 0.00 C ATOM 2373 C TRP B 43 -8.824 7.837 -11.566 1.00 0.00 C ATOM 2374 O TRP B 43 -9.725 8.630 -11.330 1.00 0.00 O ATOM 2375 CB TRP B 43 -8.614 5.533 -12.440 1.00 0.00 C ATOM 2376 CG TRP B 43 -9.121 4.507 -13.409 1.00 0.00 C ATOM 2377 CD1 TRP B 43 -10.008 4.681 -14.428 1.00 0.00 C ATOM 2378 CD2 TRP B 43 -8.770 3.117 -13.425 1.00 0.00 C ATOM 2379 NE1 TRP B 43 -10.244 3.493 -15.056 1.00 0.00 N ATOM 2380 CE2 TRP B 43 -9.494 2.519 -14.466 1.00 0.00 C ATOM 2381 CE3 TRP B 43 -7.914 2.321 -12.655 1.00 0.00 C ATOM 2382 CZ2 TRP B 43 -9.397 1.168 -14.761 1.00 0.00 C ATOM 2383 CZ3 TRP B 43 -7.816 0.975 -12.949 1.00 0.00 C ATOM 2384 CH2 TRP B 43 -8.553 0.409 -13.994 1.00 0.00 C ATOM 0 H TRP B 43 -7.140 6.650 -14.045 1.00 0.00 H new ATOM 0 HA TRP B 43 -9.735 7.137 -13.398 1.00 0.00 H new ATOM 0 HB2 TRP B 43 -7.550 5.358 -12.282 1.00 0.00 H new ATOM 0 HB3 TRP B 43 -9.109 5.373 -11.482 1.00 0.00 H new ATOM 0 HD1 TRP B 43 -10.459 5.624 -14.700 1.00 0.00 H new ATOM 0 HE1 TRP B 43 -10.880 3.355 -15.841 1.00 0.00 H new ATOM 0 HE3 TRP B 43 -7.341 2.751 -11.847 1.00 0.00 H new ATOM 0 HZ2 TRP B 43 -9.967 0.729 -15.567 1.00 0.00 H new ATOM 0 HZ3 TRP B 43 -7.160 0.350 -12.362 1.00 0.00 H new ATOM 0 HH2 TRP B 43 -8.455 -0.647 -14.200 1.00 0.00 H new ATOM 2395 N THR B 44 -7.788 7.639 -10.764 1.00 0.00 N ATOM 2396 CA THR B 44 -7.637 8.331 -9.498 1.00 0.00 C ATOM 2397 C THR B 44 -7.644 9.852 -9.652 1.00 0.00 C ATOM 2398 O THR B 44 -7.947 10.577 -8.705 1.00 0.00 O ATOM 2399 CB THR B 44 -6.358 7.862 -8.810 1.00 0.00 C ATOM 2400 OG1 THR B 44 -6.390 8.192 -7.439 1.00 0.00 O ATOM 2401 CG2 THR B 44 -5.087 8.434 -9.388 1.00 0.00 C ATOM 0 H THR B 44 -7.028 6.992 -10.976 1.00 0.00 H new ATOM 0 HA THR B 44 -8.500 8.082 -8.880 1.00 0.00 H new ATOM 0 HB THR B 44 -6.336 6.784 -8.972 1.00 0.00 H new ATOM 0 HG1 THR B 44 -6.085 7.425 -6.911 1.00 0.00 H new ATOM 0 HG21 THR B 44 -4.230 8.046 -8.837 1.00 0.00 H new ATOM 0 HG22 THR B 44 -5.004 8.149 -10.437 1.00 0.00 H new ATOM 0 HG23 THR B 44 -5.108 9.521 -9.308 1.00 0.00 H new ATOM 2409 N SER B 45 -7.315 10.328 -10.843 1.00 0.00 N ATOM 2410 CA SER B 45 -7.296 11.765 -11.098 1.00 0.00 C ATOM 2411 C SER B 45 -8.721 12.272 -11.136 1.00 0.00 C ATOM 2412 O SER B 45 -9.051 13.298 -10.541 1.00 0.00 O ATOM 2413 CB SER B 45 -6.560 12.084 -12.401 1.00 0.00 C ATOM 2414 OG SER B 45 -7.423 12.002 -13.522 1.00 0.00 O ATOM 0 H SER B 45 -7.059 9.749 -11.643 1.00 0.00 H new ATOM 0 HA SER B 45 -6.755 12.268 -10.297 1.00 0.00 H new ATOM 0 HB2 SER B 45 -6.133 13.085 -12.342 1.00 0.00 H new ATOM 0 HB3 SER B 45 -5.729 11.390 -12.529 1.00 0.00 H new ATOM 0 HG SER B 45 -7.566 11.061 -13.757 1.00 0.00 H new ATOM 2420 N SER B 46 -9.577 11.504 -11.793 1.00 0.00 N ATOM 2421 CA SER B 46 -10.988 11.826 -11.861 1.00 0.00 C ATOM 2422 C SER B 46 -11.577 11.709 -10.462 1.00 0.00 C ATOM 2423 O SER B 46 -12.445 12.486 -10.067 1.00 0.00 O ATOM 2424 CB SER B 46 -11.695 10.883 -12.839 1.00 0.00 C ATOM 2425 OG SER B 46 -12.427 11.611 -13.810 1.00 0.00 O ATOM 0 H SER B 46 -9.315 10.651 -12.287 1.00 0.00 H new ATOM 0 HA SER B 46 -11.127 12.844 -12.225 1.00 0.00 H new ATOM 0 HB2 SER B 46 -10.959 10.249 -13.334 1.00 0.00 H new ATOM 0 HB3 SER B 46 -12.368 10.223 -12.291 1.00 0.00 H new ATOM 0 HG SER B 46 -12.868 10.987 -14.423 1.00 0.00 H new ATOM 2431 N CYS B 47 -11.057 10.739 -9.704 1.00 0.00 N ATOM 2432 CA CYS B 47 -11.479 10.510 -8.329 1.00 0.00 C ATOM 2433 C CYS B 47 -11.203 11.764 -7.529 1.00 0.00 C ATOM 2434 O CYS B 47 -12.046 12.243 -6.782 1.00 0.00 O ATOM 2435 CB CYS B 47 -10.687 9.319 -7.749 1.00 0.00 C ATOM 2436 SG CYS B 47 -10.412 9.314 -5.951 1.00 0.00 S ATOM 0 H CYS B 47 -10.335 10.096 -10.029 1.00 0.00 H new ATOM 0 HA CYS B 47 -12.543 10.278 -8.286 1.00 0.00 H new ATOM 0 HB2 CYS B 47 -11.211 8.401 -8.015 1.00 0.00 H new ATOM 0 HB3 CYS B 47 -9.715 9.285 -8.241 1.00 0.00 H new ATOM 0 HG CYS B 47 -9.295 8.704 -5.685 1.00 0.00 H new ATOM 2442 N LEU B 48 -9.996 12.272 -7.700 1.00 0.00 N ATOM 2443 CA LEU B 48 -9.563 13.461 -7.006 1.00 0.00 C ATOM 2444 C LEU B 48 -10.459 14.632 -7.338 1.00 0.00 C ATOM 2445 O LEU B 48 -10.775 15.444 -6.465 1.00 0.00 O ATOM 2446 CB LEU B 48 -8.099 13.743 -7.343 1.00 0.00 C ATOM 2447 CG LEU B 48 -7.090 13.221 -6.313 1.00 0.00 C ATOM 2448 CD1 LEU B 48 -7.560 11.904 -5.693 1.00 0.00 C ATOM 2449 CD2 LEU B 48 -5.712 13.059 -6.949 1.00 0.00 C ATOM 0 H LEU B 48 -9.294 11.871 -8.322 1.00 0.00 H new ATOM 0 HA LEU B 48 -9.639 13.303 -5.930 1.00 0.00 H new ATOM 0 HB2 LEU B 48 -7.871 13.298 -8.312 1.00 0.00 H new ATOM 0 HB3 LEU B 48 -7.966 14.820 -7.448 1.00 0.00 H new ATOM 0 HG LEU B 48 -7.017 13.956 -5.512 1.00 0.00 H new ATOM 0 HD11 LEU B 48 -6.823 11.560 -4.967 1.00 0.00 H new ATOM 0 HD12 LEU B 48 -8.517 12.058 -5.194 1.00 0.00 H new ATOM 0 HD13 LEU B 48 -7.676 11.154 -6.476 1.00 0.00 H new ATOM 0 HD21 LEU B 48 -5.009 12.688 -6.204 1.00 0.00 H new ATOM 0 HD22 LEU B 48 -5.773 12.350 -7.775 1.00 0.00 H new ATOM 0 HD23 LEU B 48 -5.368 14.023 -7.323 1.00 0.00 H new ATOM 2461 N GLU B 49 -10.917 14.694 -8.581 1.00 0.00 N ATOM 2462 CA GLU B 49 -11.829 15.753 -8.956 1.00 0.00 C ATOM 2463 C GLU B 49 -13.220 15.429 -8.429 1.00 0.00 C ATOM 2464 O GLU B 49 -13.971 16.317 -8.040 1.00 0.00 O ATOM 2465 CB GLU B 49 -11.870 15.999 -10.453 1.00 0.00 C ATOM 2466 CG GLU B 49 -12.457 17.362 -10.760 1.00 0.00 C ATOM 2467 CD GLU B 49 -13.007 17.468 -12.170 1.00 0.00 C ATOM 2468 OE1 GLU B 49 -14.196 17.143 -12.368 1.00 0.00 O ATOM 2469 OE2 GLU B 49 -12.248 17.876 -13.074 1.00 0.00 O ATOM 0 H GLU B 49 -10.677 14.040 -9.326 1.00 0.00 H new ATOM 0 HA GLU B 49 -11.463 16.676 -8.507 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -10.863 15.931 -10.865 1.00 0.00 H new ATOM 0 HB3 GLU B 49 -12.465 15.225 -10.937 1.00 0.00 H new ATOM 0 HG2 GLU B 49 -13.254 17.577 -10.048 1.00 0.00 H new ATOM 0 HG3 GLU B 49 -11.689 18.122 -10.618 1.00 0.00 H new ATOM 2476 N HIS B 50 -13.542 14.136 -8.390 1.00 0.00 N ATOM 2477 CA HIS B 50 -14.828 13.682 -7.873 1.00 0.00 C ATOM 2478 C HIS B 50 -14.787 13.547 -6.342 1.00 0.00 C ATOM 2479 O HIS B 50 -15.777 13.156 -5.720 1.00 0.00 O ATOM 2480 CB HIS B 50 -15.208 12.341 -8.505 1.00 0.00 C ATOM 2481 CG HIS B 50 -15.622 12.453 -9.939 1.00 0.00 C ATOM 2482 ND1 HIS B 50 -16.771 13.099 -10.344 1.00 0.00 N ATOM 2483 CD2 HIS B 50 -15.031 11.997 -11.070 1.00 0.00 C ATOM 2484 CE1 HIS B 50 -16.870 13.034 -11.660 1.00 0.00 C ATOM 2485 NE2 HIS B 50 -15.827 12.371 -12.124 1.00 0.00 N ATOM 0 H HIS B 50 -12.929 13.387 -8.711 1.00 0.00 H new ATOM 0 HA HIS B 50 -15.581 14.426 -8.133 1.00 0.00 H new ATOM 0 HB2 HIS B 50 -14.360 11.661 -8.432 1.00 0.00 H new ATOM 0 HB3 HIS B 50 -16.023 11.897 -7.933 1.00 0.00 H new ATOM 0 HD2 HIS B 50 -14.106 11.443 -11.131 1.00 0.00 H new ATOM 0 HE1 HIS B 50 -17.668 13.452 -12.255 1.00 0.00 H new ATOM 0 HE2 HIS B 50 -15.642 12.169 -13.107 1.00 0.00 H new ATOM 2494 N CYS B 51 -13.644 13.896 -5.738 1.00 0.00 N ATOM 2495 CA CYS B 51 -13.474 13.843 -4.296 1.00 0.00 C ATOM 2496 C CYS B 51 -13.453 15.274 -3.788 1.00 0.00 C ATOM 2497 O CYS B 51 -14.106 15.626 -2.803 1.00 0.00 O ATOM 2498 CB CYS B 51 -12.161 13.123 -3.924 1.00 0.00 C ATOM 2499 SG CYS B 51 -12.100 12.554 -2.208 1.00 0.00 S ATOM 0 H CYS B 51 -12.818 14.221 -6.241 1.00 0.00 H new ATOM 0 HA CYS B 51 -14.291 13.283 -3.841 1.00 0.00 H new ATOM 0 HB2 CYS B 51 -12.027 12.267 -4.586 1.00 0.00 H new ATOM 0 HB3 CYS B 51 -11.324 13.798 -4.103 1.00 0.00 H new ATOM 0 HG CYS B 51 -11.238 13.266 -1.545 1.00 0.00 H new ATOM 2505 N ILE B 52 -12.710 16.098 -4.517 1.00 0.00 N ATOM 2506 CA ILE B 52 -12.588 17.503 -4.221 1.00 0.00 C ATOM 2507 C ILE B 52 -13.933 18.205 -4.446 1.00 0.00 C ATOM 2508 O ILE B 52 -14.382 18.973 -3.601 1.00 0.00 O ATOM 2509 CB ILE B 52 -11.470 18.120 -5.104 1.00 0.00 C ATOM 2510 CG1 ILE B 52 -11.078 19.512 -4.652 1.00 0.00 C ATOM 2511 CG2 ILE B 52 -11.859 18.149 -6.564 1.00 0.00 C ATOM 2512 CD1 ILE B 52 -12.178 20.523 -4.776 1.00 0.00 C ATOM 0 H ILE B 52 -12.176 15.799 -5.333 1.00 0.00 H new ATOM 0 HA ILE B 52 -12.314 17.639 -3.175 1.00 0.00 H new ATOM 0 HB ILE B 52 -10.604 17.469 -4.985 1.00 0.00 H new ATOM 0 HG12 ILE B 52 -10.754 19.468 -3.612 1.00 0.00 H new ATOM 0 HG13 ILE B 52 -10.222 19.847 -5.239 1.00 0.00 H new ATOM 0 HG21 ILE B 52 -11.050 18.588 -7.148 1.00 0.00 H new ATOM 0 HG22 ILE B 52 -12.047 17.133 -6.911 1.00 0.00 H new ATOM 0 HG23 ILE B 52 -12.762 18.747 -6.688 1.00 0.00 H new ATOM 0 HD11 ILE B 52 -11.820 21.494 -4.433 1.00 0.00 H new ATOM 0 HD12 ILE B 52 -12.488 20.598 -5.818 1.00 0.00 H new ATOM 0 HD13 ILE B 52 -13.027 20.213 -4.167 1.00 0.00 H new ATOM 2524 N LYS B 53 -14.576 17.923 -5.583 1.00 0.00 N ATOM 2525 CA LYS B 53 -15.869 18.525 -5.907 1.00 0.00 C ATOM 2526 C LYS B 53 -16.903 18.182 -4.842 1.00 0.00 C ATOM 2527 O LYS B 53 -17.769 18.993 -4.517 1.00 0.00 O ATOM 2528 CB LYS B 53 -16.365 18.044 -7.279 1.00 0.00 C ATOM 2529 CG LYS B 53 -15.980 18.947 -8.446 1.00 0.00 C ATOM 2530 CD LYS B 53 -14.496 19.265 -8.462 1.00 0.00 C ATOM 2531 CE LYS B 53 -14.215 20.662 -7.922 1.00 0.00 C ATOM 2532 NZ LYS B 53 -14.245 21.689 -8.999 1.00 0.00 N ATOM 0 H LYS B 53 -14.221 17.282 -6.293 1.00 0.00 H new ATOM 0 HA LYS B 53 -15.735 19.606 -5.938 1.00 0.00 H new ATOM 0 HB2 LYS B 53 -15.970 17.045 -7.464 1.00 0.00 H new ATOM 0 HB3 LYS B 53 -17.451 17.956 -7.248 1.00 0.00 H new ATOM 0 HG2 LYS B 53 -16.256 18.464 -9.383 1.00 0.00 H new ATOM 0 HG3 LYS B 53 -16.548 19.876 -8.387 1.00 0.00 H new ATOM 0 HD2 LYS B 53 -13.959 18.529 -7.864 1.00 0.00 H new ATOM 0 HD3 LYS B 53 -14.117 19.185 -9.481 1.00 0.00 H new ATOM 0 HE2 LYS B 53 -14.954 20.912 -7.161 1.00 0.00 H new ATOM 0 HE3 LYS B 53 -13.240 20.674 -7.436 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 -14.049 22.625 -8.591 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 -13.523 21.464 -9.713 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 -15.184 21.696 -9.446 1.00 0.00 H new ATOM 2546 N ARG B 54 -16.807 16.972 -4.303 1.00 0.00 N ATOM 2547 CA ARG B 54 -17.733 16.522 -3.277 1.00 0.00 C ATOM 2548 C ARG B 54 -17.497 17.288 -1.984 1.00 0.00 C ATOM 2549 O ARG B 54 -18.436 17.779 -1.352 1.00 0.00 O ATOM 2550 CB ARG B 54 -17.570 15.016 -3.040 1.00 0.00 C ATOM 2551 CG ARG B 54 -18.788 14.206 -3.445 1.00 0.00 C ATOM 2552 CD ARG B 54 -20.047 14.699 -2.747 1.00 0.00 C ATOM 2553 NE ARG B 54 -21.070 15.125 -3.700 1.00 0.00 N ATOM 2554 CZ ARG B 54 -21.860 14.288 -4.375 1.00 0.00 C ATOM 2555 NH1 ARG B 54 -21.753 12.974 -4.207 1.00 0.00 N ATOM 2556 NH2 ARG B 54 -22.761 14.768 -5.220 1.00 0.00 N ATOM 0 H ARG B 54 -16.097 16.287 -4.561 1.00 0.00 H new ATOM 0 HA ARG B 54 -18.751 16.714 -3.615 1.00 0.00 H new ATOM 0 HB2 ARG B 54 -16.704 14.660 -3.598 1.00 0.00 H new ATOM 0 HB3 ARG B 54 -17.362 14.842 -1.984 1.00 0.00 H new ATOM 0 HG2 ARG B 54 -18.923 14.266 -4.525 1.00 0.00 H new ATOM 0 HG3 ARG B 54 -18.624 13.156 -3.202 1.00 0.00 H new ATOM 0 HD2 ARG B 54 -20.447 13.905 -2.117 1.00 0.00 H new ATOM 0 HD3 ARG B 54 -19.795 15.531 -2.090 1.00 0.00 H new ATOM 0 HE ARG B 54 -21.187 16.126 -3.859 1.00 0.00 H new ATOM 0 HH11 ARG B 54 -21.062 12.597 -3.558 1.00 0.00 H new ATOM 0 HH12 ARG B 54 -22.361 12.342 -4.727 1.00 0.00 H new ATOM 0 HH21 ARG B 54 -22.849 15.775 -5.353 1.00 0.00 H new ATOM 0 HH22 ARG B 54 -23.366 14.130 -5.737 1.00 0.00 H new ATOM 2570 N LEU B 55 -16.232 17.391 -1.604 1.00 0.00 N ATOM 2571 CA LEU B 55 -15.852 18.101 -0.393 1.00 0.00 C ATOM 2572 C LEU B 55 -16.302 19.557 -0.448 1.00 0.00 C ATOM 2573 O LEU B 55 -16.593 20.167 0.580 1.00 0.00 O ATOM 2574 CB LEU B 55 -14.342 18.001 -0.194 1.00 0.00 C ATOM 2575 CG LEU B 55 -13.862 16.605 0.194 1.00 0.00 C ATOM 2576 CD1 LEU B 55 -12.353 16.569 0.347 1.00 0.00 C ATOM 2577 CD2 LEU B 55 -14.541 16.164 1.474 1.00 0.00 C ATOM 0 H LEU B 55 -15.449 16.990 -2.120 1.00 0.00 H new ATOM 0 HA LEU B 55 -16.351 17.639 0.458 1.00 0.00 H new ATOM 0 HB2 LEU B 55 -13.843 18.304 -1.115 1.00 0.00 H new ATOM 0 HB3 LEU B 55 -14.039 18.707 0.579 1.00 0.00 H new ATOM 0 HG LEU B 55 -14.130 15.913 -0.604 1.00 0.00 H new ATOM 0 HD11 LEU B 55 -12.039 15.562 0.624 1.00 0.00 H new ATOM 0 HD12 LEU B 55 -11.885 16.848 -0.597 1.00 0.00 H new ATOM 0 HD13 LEU B 55 -12.049 17.270 1.124 1.00 0.00 H new ATOM 0 HD21 LEU B 55 -14.194 15.167 1.745 1.00 0.00 H new ATOM 0 HD22 LEU B 55 -14.298 16.863 2.274 1.00 0.00 H new ATOM 0 HD23 LEU B 55 -15.621 16.144 1.325 1.00 0.00 H new ATOM 2589 N THR B 56 -16.375 20.101 -1.657 1.00 0.00 N ATOM 2590 CA THR B 56 -16.812 21.476 -1.850 1.00 0.00 C ATOM 2591 C THR B 56 -18.326 21.562 -1.710 1.00 0.00 C ATOM 2592 O THR B 56 -18.861 22.543 -1.194 1.00 0.00 O ATOM 2593 CB THR B 56 -16.374 21.989 -3.223 1.00 0.00 C ATOM 2594 OG1 THR B 56 -17.215 21.479 -4.242 1.00 0.00 O ATOM 2595 CG2 THR B 56 -14.949 21.615 -3.570 1.00 0.00 C ATOM 0 H THR B 56 -16.137 19.609 -2.518 1.00 0.00 H new ATOM 0 HA THR B 56 -16.350 22.103 -1.087 1.00 0.00 H new ATOM 0 HB THR B 56 -16.445 23.075 -3.164 1.00 0.00 H new ATOM 0 HG1 THR B 56 -17.257 20.502 -4.173 1.00 0.00 H new ATOM 0 HG21 THR B 56 -14.699 22.008 -4.556 1.00 0.00 H new ATOM 0 HG22 THR B 56 -14.271 22.038 -2.828 1.00 0.00 H new ATOM 0 HG23 THR B 56 -14.849 20.530 -3.576 1.00 0.00 H new ATOM 2603 N ALA B 57 -19.009 20.510 -2.153 1.00 0.00 N ATOM 2604 CA ALA B 57 -20.459 20.445 -2.058 1.00 0.00 C ATOM 2605 C ALA B 57 -20.878 20.348 -0.598 1.00 0.00 C ATOM 2606 O ALA B 57 -21.904 20.894 -0.191 1.00 0.00 O ATOM 2607 CB ALA B 57 -20.990 19.254 -2.844 1.00 0.00 C ATOM 0 H ALA B 57 -18.578 19.691 -2.582 1.00 0.00 H new ATOM 0 HA ALA B 57 -20.882 21.354 -2.486 1.00 0.00 H new ATOM 0 HB1 ALA B 57 -22.076 19.220 -2.763 1.00 0.00 H new ATOM 0 HB2 ALA B 57 -20.707 19.355 -3.892 1.00 0.00 H new ATOM 0 HB3 ALA B 57 -20.567 18.334 -2.441 1.00 0.00 H new ATOM 2613 N LEU B 58 -20.064 19.647 0.186 1.00 0.00 N ATOM 2614 CA LEU B 58 -20.322 19.468 1.605 1.00 0.00 C ATOM 2615 C LEU B 58 -19.769 20.644 2.413 1.00 0.00 C ATOM 2616 O LEU B 58 -20.277 20.960 3.489 1.00 0.00 O ATOM 2617 CB LEU B 58 -19.691 18.155 2.074 1.00 0.00 C ATOM 2618 CG LEU B 58 -20.664 16.980 2.205 1.00 0.00 C ATOM 2619 CD1 LEU B 58 -20.027 15.693 1.697 1.00 0.00 C ATOM 2620 CD2 LEU B 58 -21.114 16.819 3.649 1.00 0.00 C ATOM 0 H LEU B 58 -19.214 19.191 -0.145 1.00 0.00 H new ATOM 0 HA LEU B 58 -21.399 19.430 1.766 1.00 0.00 H new ATOM 0 HB2 LEU B 58 -18.903 17.878 1.374 1.00 0.00 H new ATOM 0 HB3 LEU B 58 -19.215 18.323 3.040 1.00 0.00 H new ATOM 0 HG LEU B 58 -21.540 17.192 1.592 1.00 0.00 H new ATOM 0 HD11 LEU B 58 -20.736 14.871 1.799 1.00 0.00 H new ATOM 0 HD12 LEU B 58 -19.757 15.810 0.648 1.00 0.00 H new ATOM 0 HD13 LEU B 58 -19.132 15.475 2.280 1.00 0.00 H new ATOM 0 HD21 LEU B 58 -21.805 15.979 3.723 1.00 0.00 H new ATOM 0 HD22 LEU B 58 -20.246 16.632 4.282 1.00 0.00 H new ATOM 0 HD23 LEU B 58 -21.613 17.730 3.978 1.00 0.00 H new ATOM 2632 N ASN B 59 -18.720 21.284 1.885 1.00 0.00 N ATOM 2633 CA ASN B 59 -18.080 22.429 2.539 1.00 0.00 C ATOM 2634 C ASN B 59 -17.839 22.177 4.031 1.00 0.00 C ATOM 2635 O ASN B 59 -18.295 22.938 4.885 1.00 0.00 O ATOM 2636 CB ASN B 59 -18.917 23.700 2.339 1.00 0.00 C ATOM 2637 CG ASN B 59 -20.254 23.647 3.051 1.00 0.00 C ATOM 2638 OD1 ASN B 59 -20.384 24.099 4.189 1.00 0.00 O ATOM 2639 ND2 ASN B 59 -21.259 23.092 2.383 1.00 0.00 N ATOM 0 H ASN B 59 -18.293 21.024 0.996 1.00 0.00 H new ATOM 0 HA ASN B 59 -17.106 22.568 2.070 1.00 0.00 H new ATOM 0 HB2 ASN B 59 -18.353 24.560 2.700 1.00 0.00 H new ATOM 0 HB3 ASN B 59 -19.085 23.854 1.273 1.00 0.00 H new ATOM 0 HD21 ASN B 59 -22.182 23.028 2.811 1.00 0.00 H new ATOM 0 HD22 ASN B 59 -21.107 22.730 1.442 1.00 0.00 H new ATOM 2646 N LYS B 60 -17.112 21.104 4.334 1.00 0.00 N ATOM 2647 CA LYS B 60 -16.802 20.751 5.717 1.00 0.00 C ATOM 2648 C LYS B 60 -15.949 19.479 5.777 1.00 0.00 C ATOM 2649 O LYS B 60 -16.437 18.393 5.466 1.00 0.00 O ATOM 2650 CB LYS B 60 -18.092 20.545 6.516 1.00 0.00 C ATOM 2651 CG LYS B 60 -17.985 20.991 7.966 1.00 0.00 C ATOM 2652 CD LYS B 60 -19.168 20.503 8.787 1.00 0.00 C ATOM 2653 CE LYS B 60 -19.588 21.532 9.824 1.00 0.00 C ATOM 2654 NZ LYS B 60 -21.053 21.491 10.086 1.00 0.00 N ATOM 0 H LYS B 60 -16.726 20.464 3.640 1.00 0.00 H new ATOM 0 HA LYS B 60 -16.236 21.573 6.156 1.00 0.00 H new ATOM 0 HB2 LYS B 60 -18.900 21.095 6.034 1.00 0.00 H new ATOM 0 HB3 LYS B 60 -18.363 19.490 6.488 1.00 0.00 H new ATOM 0 HG2 LYS B 60 -17.059 20.610 8.398 1.00 0.00 H new ATOM 0 HG3 LYS B 60 -17.934 22.079 8.010 1.00 0.00 H new ATOM 0 HD2 LYS B 60 -20.007 20.288 8.126 1.00 0.00 H new ATOM 0 HD3 LYS B 60 -18.907 19.569 9.285 1.00 0.00 H new ATOM 0 HE2 LYS B 60 -19.048 21.352 10.753 1.00 0.00 H new ATOM 0 HE3 LYS B 60 -19.308 22.528 9.481 1.00 0.00 H new ATOM 0 HZ1 LYS B 60 -21.298 22.208 10.799 1.00 0.00 H new ATOM 0 HZ2 LYS B 60 -21.569 21.688 9.205 1.00 0.00 H new ATOM 0 HZ3 LYS B 60 -21.316 20.548 10.438 1.00 0.00 H new ATOM 2668 N PRO B 61 -14.657 19.580 6.176 1.00 0.00 N ATOM 2669 CA PRO B 61 -14.007 20.843 6.562 1.00 0.00 C ATOM 2670 C PRO B 61 -13.881 21.811 5.386 1.00 0.00 C ATOM 2671 O PRO B 61 -14.585 21.681 4.385 1.00 0.00 O ATOM 2672 CB PRO B 61 -12.620 20.415 7.052 1.00 0.00 C ATOM 2673 CG PRO B 61 -12.713 18.942 7.267 1.00 0.00 C ATOM 2674 CD PRO B 61 -13.729 18.446 6.281 1.00 0.00 C ATOM 0 HA PRO B 61 -14.586 21.377 7.316 1.00 0.00 H new ATOM 0 HB2 PRO B 61 -11.852 20.657 6.318 1.00 0.00 H new ATOM 0 HB3 PRO B 61 -12.353 20.931 7.974 1.00 0.00 H new ATOM 0 HG2 PRO B 61 -11.747 18.462 7.108 1.00 0.00 H new ATOM 0 HG3 PRO B 61 -13.017 18.715 8.289 1.00 0.00 H new ATOM 0 HD2 PRO B 61 -13.276 18.203 5.320 1.00 0.00 H new ATOM 0 HD3 PRO B 61 -14.230 17.544 6.634 1.00 0.00 H new ATOM 2682 N PHE B 62 -12.978 22.778 5.515 1.00 0.00 N ATOM 2683 CA PHE B 62 -12.759 23.765 4.463 1.00 0.00 C ATOM 2684 C PHE B 62 -11.526 23.414 3.635 1.00 0.00 C ATOM 2685 O PHE B 62 -11.626 23.136 2.441 1.00 0.00 O ATOM 2686 CB PHE B 62 -12.605 25.162 5.070 1.00 0.00 C ATOM 2687 CG PHE B 62 -13.334 26.230 4.307 1.00 0.00 C ATOM 2688 CD1 PHE B 62 -14.704 26.389 4.446 1.00 0.00 C ATOM 2689 CD2 PHE B 62 -12.650 27.076 3.449 1.00 0.00 C ATOM 2690 CE1 PHE B 62 -15.377 27.371 3.744 1.00 0.00 C ATOM 2691 CE2 PHE B 62 -13.317 28.060 2.744 1.00 0.00 C ATOM 2692 CZ PHE B 62 -14.683 28.207 2.893 1.00 0.00 C ATOM 0 H PHE B 62 -12.386 22.899 6.337 1.00 0.00 H new ATOM 0 HA PHE B 62 -13.628 23.758 3.805 1.00 0.00 H new ATOM 0 HB2 PHE B 62 -12.971 25.146 6.097 1.00 0.00 H new ATOM 0 HB3 PHE B 62 -11.546 25.416 5.113 1.00 0.00 H new ATOM 0 HD1 PHE B 62 -15.252 25.738 5.111 1.00 0.00 H new ATOM 0 HD2 PHE B 62 -11.582 26.965 3.330 1.00 0.00 H new ATOM 0 HE1 PHE B 62 -16.445 27.484 3.861 1.00 0.00 H new ATOM 0 HE2 PHE B 62 -12.772 28.713 2.078 1.00 0.00 H new ATOM 0 HZ PHE B 62 -15.207 28.975 2.344 1.00 0.00 H new ATOM 2702 N LYS B 63 -10.362 23.428 4.279 1.00 0.00 N ATOM 2703 CA LYS B 63 -9.110 23.109 3.602 1.00 0.00 C ATOM 2704 C LYS B 63 -8.869 21.604 3.587 1.00 0.00 C ATOM 2705 O LYS B 63 -8.507 21.008 4.603 1.00 0.00 O ATOM 2706 CB LYS B 63 -7.940 23.818 4.288 1.00 0.00 C ATOM 2707 CG LYS B 63 -6.664 23.821 3.464 1.00 0.00 C ATOM 2708 CD LYS B 63 -5.759 24.983 3.843 1.00 0.00 C ATOM 2709 CE LYS B 63 -5.069 24.740 5.175 1.00 0.00 C ATOM 2710 NZ LYS B 63 -4.549 26.001 5.770 1.00 0.00 N ATOM 0 H LYS B 63 -10.260 23.657 5.268 1.00 0.00 H new ATOM 0 HA LYS B 63 -9.183 23.458 2.572 1.00 0.00 H new ATOM 0 HB2 LYS B 63 -8.226 24.848 4.504 1.00 0.00 H new ATOM 0 HB3 LYS B 63 -7.744 23.335 5.245 1.00 0.00 H new ATOM 0 HG2 LYS B 63 -6.132 22.881 3.611 1.00 0.00 H new ATOM 0 HG3 LYS B 63 -6.914 23.883 2.405 1.00 0.00 H new ATOM 0 HD2 LYS B 63 -5.010 25.130 3.065 1.00 0.00 H new ATOM 0 HD3 LYS B 63 -6.346 25.900 3.898 1.00 0.00 H new ATOM 0 HE2 LYS B 63 -5.770 24.274 5.867 1.00 0.00 H new ATOM 0 HE3 LYS B 63 -4.246 24.039 5.035 1.00 0.00 H new ATOM 0 HZ1 LYS B 63 -3.984 25.779 6.615 1.00 0.00 H new ATOM 0 HZ2 LYS B 63 -3.953 26.493 5.074 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 -5.346 26.613 6.037 1.00 0.00 H new ATOM 2724 N TYR B 64 -9.077 20.984 2.432 1.00 0.00 N ATOM 2725 CA TYR B 64 -8.883 19.542 2.308 1.00 0.00 C ATOM 2726 C TYR B 64 -8.024 19.194 1.099 1.00 0.00 C ATOM 2727 O TYR B 64 -8.154 19.797 0.034 1.00 0.00 O ATOM 2728 CB TYR B 64 -10.232 18.818 2.216 1.00 0.00 C ATOM 2729 CG TYR B 64 -11.297 19.585 1.462 1.00 0.00 C ATOM 2730 CD1 TYR B 64 -11.390 19.508 0.079 1.00 0.00 C ATOM 2731 CD2 TYR B 64 -12.205 20.390 2.137 1.00 0.00 C ATOM 2732 CE1 TYR B 64 -12.358 20.211 -0.610 1.00 0.00 C ATOM 2733 CE2 TYR B 64 -13.176 21.097 1.455 1.00 0.00 C ATOM 2734 CZ TYR B 64 -13.248 21.005 0.082 1.00 0.00 C ATOM 2735 OH TYR B 64 -14.211 21.709 -0.602 1.00 0.00 O ATOM 0 H TYR B 64 -9.377 21.450 1.575 1.00 0.00 H new ATOM 0 HA TYR B 64 -8.360 19.207 3.204 1.00 0.00 H new ATOM 0 HB2 TYR B 64 -10.082 17.854 1.730 1.00 0.00 H new ATOM 0 HB3 TYR B 64 -10.592 18.614 3.224 1.00 0.00 H new ATOM 0 HD1 TYR B 64 -10.694 18.888 -0.467 1.00 0.00 H new ATOM 0 HD2 TYR B 64 -12.151 20.465 3.213 1.00 0.00 H new ATOM 0 HE1 TYR B 64 -12.418 20.139 -1.686 1.00 0.00 H new ATOM 0 HE2 TYR B 64 -13.875 21.719 1.995 1.00 0.00 H new ATOM 0 HH TYR B 64 -13.818 22.527 -0.971 1.00 0.00 H new ATOM 2745 N VAL B 65 -7.158 18.199 1.268 1.00 0.00 N ATOM 2746 CA VAL B 65 -6.288 17.744 0.188 1.00 0.00 C ATOM 2747 C VAL B 65 -6.733 16.368 -0.277 1.00 0.00 C ATOM 2748 O VAL B 65 -7.255 15.581 0.511 1.00 0.00 O ATOM 2749 CB VAL B 65 -4.781 17.659 0.574 1.00 0.00 C ATOM 2750 CG1 VAL B 65 -3.914 18.248 -0.526 1.00 0.00 C ATOM 2751 CG2 VAL B 65 -4.471 18.329 1.900 1.00 0.00 C ATOM 0 H VAL B 65 -7.040 17.691 2.145 1.00 0.00 H new ATOM 0 HA VAL B 65 -6.378 18.493 -0.599 1.00 0.00 H new ATOM 0 HB VAL B 65 -4.550 16.600 0.691 1.00 0.00 H new ATOM 0 HG11 VAL B 65 -2.865 18.180 -0.238 1.00 0.00 H new ATOM 0 HG12 VAL B 65 -4.073 17.694 -1.451 1.00 0.00 H new ATOM 0 HG13 VAL B 65 -4.181 19.294 -0.679 1.00 0.00 H new ATOM 0 HG21 VAL B 65 -3.406 18.237 2.114 1.00 0.00 H new ATOM 0 HG22 VAL B 65 -4.740 19.384 1.846 1.00 0.00 H new ATOM 0 HG23 VAL B 65 -5.044 17.848 2.693 1.00 0.00 H new ATOM 2761 N VAL B 66 -6.530 16.077 -1.550 1.00 0.00 N ATOM 2762 CA VAL B 66 -6.920 14.784 -2.090 1.00 0.00 C ATOM 2763 C VAL B 66 -5.810 14.170 -2.935 1.00 0.00 C ATOM 2764 O VAL B 66 -5.582 14.591 -4.064 1.00 0.00 O ATOM 2765 CB VAL B 66 -8.206 14.876 -2.942 1.00 0.00 C ATOM 2766 CG1 VAL B 66 -8.866 13.513 -3.038 1.00 0.00 C ATOM 2767 CG2 VAL B 66 -9.183 15.897 -2.370 1.00 0.00 C ATOM 0 H VAL B 66 -6.102 16.711 -2.225 1.00 0.00 H new ATOM 0 HA VAL B 66 -7.113 14.144 -1.229 1.00 0.00 H new ATOM 0 HB VAL B 66 -7.924 15.209 -3.941 1.00 0.00 H new ATOM 0 HG11 VAL B 66 -9.771 13.589 -3.640 1.00 0.00 H new ATOM 0 HG12 VAL B 66 -8.178 12.808 -3.504 1.00 0.00 H new ATOM 0 HG13 VAL B 66 -9.124 13.162 -2.039 1.00 0.00 H new ATOM 0 HG21 VAL B 66 -10.076 15.936 -2.994 1.00 0.00 H new ATOM 0 HG22 VAL B 66 -9.461 15.607 -1.357 1.00 0.00 H new ATOM 0 HG23 VAL B 66 -8.712 16.880 -2.350 1.00 0.00 H new ATOM 2777 N THR B 67 -5.120 13.174 -2.393 1.00 0.00 N ATOM 2778 CA THR B 67 -4.044 12.511 -3.140 1.00 0.00 C ATOM 2779 C THR B 67 -4.208 10.996 -3.138 1.00 0.00 C ATOM 2780 O THR B 67 -4.875 10.433 -2.276 1.00 0.00 O ATOM 2781 CB THR B 67 -2.673 12.879 -2.583 1.00 0.00 C ATOM 2782 OG1 THR B 67 -1.660 12.111 -3.208 1.00 0.00 O ATOM 2783 CG2 THR B 67 -2.562 12.656 -1.097 1.00 0.00 C ATOM 0 H THR B 67 -5.278 12.808 -1.454 1.00 0.00 H new ATOM 0 HA THR B 67 -4.113 12.865 -4.169 1.00 0.00 H new ATOM 0 HB THR B 67 -2.547 13.942 -2.788 1.00 0.00 H new ATOM 0 HG1 THR B 67 -1.786 12.132 -4.180 1.00 0.00 H new ATOM 0 HG21 THR B 67 -1.564 12.936 -0.761 1.00 0.00 H new ATOM 0 HG22 THR B 67 -3.303 13.266 -0.581 1.00 0.00 H new ATOM 0 HG23 THR B 67 -2.739 11.604 -0.873 1.00 0.00 H new ATOM 2791 N CYS B 68 -3.589 10.349 -4.123 1.00 0.00 N ATOM 2792 CA CYS B 68 -3.648 8.899 -4.257 1.00 0.00 C ATOM 2793 C CYS B 68 -2.389 8.372 -4.941 1.00 0.00 C ATOM 2794 O CYS B 68 -1.728 9.085 -5.690 1.00 0.00 O ATOM 2795 CB CYS B 68 -4.890 8.475 -5.056 1.00 0.00 C ATOM 2796 SG CYS B 68 -4.983 6.698 -5.418 1.00 0.00 S ATOM 0 H CYS B 68 -3.037 10.813 -4.845 1.00 0.00 H new ATOM 0 HA CYS B 68 -3.713 8.472 -3.256 1.00 0.00 H new ATOM 0 HB2 CYS B 68 -5.781 8.767 -4.500 1.00 0.00 H new ATOM 0 HB3 CYS B 68 -4.907 9.026 -5.996 1.00 0.00 H new ATOM 0 HG CYS B 68 -6.018 6.187 -4.821 1.00 0.00 H new ATOM 2802 N ILE B 69 -2.078 7.113 -4.679 1.00 0.00 N ATOM 2803 CA ILE B 69 -0.920 6.462 -5.264 1.00 0.00 C ATOM 2804 C ILE B 69 -1.341 5.109 -5.847 1.00 0.00 C ATOM 2805 O ILE B 69 -1.871 4.252 -5.136 1.00 0.00 O ATOM 2806 CB ILE B 69 0.194 6.289 -4.202 1.00 0.00 C ATOM 2807 CG1 ILE B 69 0.751 7.654 -3.797 1.00 0.00 C ATOM 2808 CG2 ILE B 69 1.320 5.385 -4.696 1.00 0.00 C ATOM 2809 CD1 ILE B 69 -0.184 8.450 -2.913 1.00 0.00 C ATOM 0 H ILE B 69 -2.621 6.515 -4.056 1.00 0.00 H new ATOM 0 HA ILE B 69 -0.520 7.081 -6.067 1.00 0.00 H new ATOM 0 HB ILE B 69 -0.253 5.808 -3.332 1.00 0.00 H new ATOM 0 HG12 ILE B 69 1.697 7.511 -3.275 1.00 0.00 H new ATOM 0 HG13 ILE B 69 0.967 8.231 -4.696 1.00 0.00 H new ATOM 0 HG21 ILE B 69 2.079 5.292 -3.919 1.00 0.00 H new ATOM 0 HG22 ILE B 69 0.919 4.399 -4.931 1.00 0.00 H new ATOM 0 HG23 ILE B 69 1.768 5.817 -5.591 1.00 0.00 H new ATOM 0 HD11 ILE B 69 0.276 9.407 -2.665 1.00 0.00 H new ATOM 0 HD12 ILE B 69 -1.122 8.624 -3.440 1.00 0.00 H new ATOM 0 HD13 ILE B 69 -0.380 7.893 -1.997 1.00 0.00 H new ATOM 2821 N ILE B 70 -1.124 4.937 -7.146 1.00 0.00 N ATOM 2822 CA ILE B 70 -1.502 3.704 -7.829 1.00 0.00 C ATOM 2823 C ILE B 70 -0.489 2.588 -7.594 1.00 0.00 C ATOM 2824 O ILE B 70 0.714 2.831 -7.499 1.00 0.00 O ATOM 2825 CB ILE B 70 -1.654 3.928 -9.346 1.00 0.00 C ATOM 2826 CG1 ILE B 70 -0.341 4.446 -9.948 1.00 0.00 C ATOM 2827 CG2 ILE B 70 -2.797 4.893 -9.627 1.00 0.00 C ATOM 2828 CD1 ILE B 70 0.129 3.645 -11.143 1.00 0.00 C ATOM 0 H ILE B 70 -0.688 5.636 -7.748 1.00 0.00 H new ATOM 0 HA ILE B 70 -2.461 3.403 -7.407 1.00 0.00 H new ATOM 0 HB ILE B 70 -1.889 2.973 -9.817 1.00 0.00 H new ATOM 0 HG12 ILE B 70 -0.472 5.486 -10.246 1.00 0.00 H new ATOM 0 HG13 ILE B 70 0.433 4.429 -9.181 1.00 0.00 H new ATOM 0 HG21 ILE B 70 -2.892 5.041 -10.703 1.00 0.00 H new ATOM 0 HG22 ILE B 70 -3.726 4.481 -9.234 1.00 0.00 H new ATOM 0 HG23 ILE B 70 -2.592 5.849 -9.146 1.00 0.00 H new ATOM 0 HD11 ILE B 70 1.062 4.065 -11.519 1.00 0.00 H new ATOM 0 HD12 ILE B 70 0.292 2.609 -10.845 1.00 0.00 H new ATOM 0 HD13 ILE B 70 -0.628 3.683 -11.927 1.00 0.00 H new ATOM 2840 N MET B 71 -0.995 1.362 -7.516 1.00 0.00 N ATOM 2841 CA MET B 71 -0.154 0.190 -7.307 1.00 0.00 C ATOM 2842 C MET B 71 -0.368 -0.820 -8.432 1.00 0.00 C ATOM 2843 O MET B 71 -1.257 -1.668 -8.358 1.00 0.00 O ATOM 2844 CB MET B 71 -0.461 -0.449 -5.947 1.00 0.00 C ATOM 2845 CG MET B 71 0.644 -0.255 -4.921 1.00 0.00 C ATOM 2846 SD MET B 71 0.554 -1.446 -3.571 1.00 0.00 S ATOM 2847 CE MET B 71 1.243 -2.901 -4.356 1.00 0.00 C ATOM 0 H MET B 71 -1.990 1.154 -7.595 1.00 0.00 H new ATOM 0 HA MET B 71 0.890 0.502 -7.315 1.00 0.00 H new ATOM 0 HB2 MET B 71 -1.386 -0.026 -5.557 1.00 0.00 H new ATOM 0 HB3 MET B 71 -0.633 -1.516 -6.087 1.00 0.00 H new ATOM 0 HG2 MET B 71 1.612 -0.343 -5.414 1.00 0.00 H new ATOM 0 HG3 MET B 71 0.584 0.755 -4.514 1.00 0.00 H new ATOM 0 HE1 MET B 71 1.271 -3.722 -3.640 1.00 0.00 H new ATOM 0 HE2 MET B 71 0.623 -3.183 -5.207 1.00 0.00 H new ATOM 0 HE3 MET B 71 2.255 -2.685 -4.699 1.00 0.00 H new ATOM 2857 N GLN B 72 0.451 -0.715 -9.477 1.00 0.00 N ATOM 2858 CA GLN B 72 0.354 -1.610 -10.628 1.00 0.00 C ATOM 2859 C GLN B 72 0.438 -3.076 -10.206 1.00 0.00 C ATOM 2860 O GLN B 72 1.043 -3.407 -9.188 1.00 0.00 O ATOM 2861 CB GLN B 72 1.459 -1.292 -11.637 1.00 0.00 C ATOM 2862 CG GLN B 72 1.004 -1.382 -13.085 1.00 0.00 C ATOM 2863 CD GLN B 72 1.929 -0.647 -14.034 1.00 0.00 C ATOM 2864 OE1 GLN B 72 3.121 -0.940 -14.109 1.00 0.00 O ATOM 2865 NE2 GLN B 72 1.382 0.319 -14.763 1.00 0.00 N ATOM 0 H GLN B 72 1.191 -0.017 -9.550 1.00 0.00 H new ATOM 0 HA GLN B 72 -0.618 -1.450 -11.094 1.00 0.00 H new ATOM 0 HB2 GLN B 72 1.837 -0.288 -11.445 1.00 0.00 H new ATOM 0 HB3 GLN B 72 2.290 -1.980 -11.482 1.00 0.00 H new ATOM 0 HG2 GLN B 72 0.946 -2.430 -13.379 1.00 0.00 H new ATOM 0 HG3 GLN B 72 -0.002 -0.970 -13.172 1.00 0.00 H new ATOM 0 HE21 GLN B 72 0.388 0.529 -14.669 1.00 0.00 H new ATOM 0 HE22 GLN B 72 1.956 0.851 -15.417 1.00 0.00 H new ATOM 2874 N LYS B 73 -0.178 -3.946 -11.000 1.00 0.00 N ATOM 2875 CA LYS B 73 -0.178 -5.377 -10.718 1.00 0.00 C ATOM 2876 C LYS B 73 1.244 -5.927 -10.679 1.00 0.00 C ATOM 2877 O LYS B 73 1.758 -6.421 -11.682 1.00 0.00 O ATOM 2878 CB LYS B 73 -0.995 -6.123 -11.774 1.00 0.00 C ATOM 2879 CG LYS B 73 -1.216 -7.594 -11.449 1.00 0.00 C ATOM 2880 CD LYS B 73 -0.276 -8.496 -12.240 1.00 0.00 C ATOM 2881 CE LYS B 73 0.787 -9.121 -11.350 1.00 0.00 C ATOM 2882 NZ LYS B 73 2.007 -9.493 -12.118 1.00 0.00 N ATOM 0 H LYS B 73 -0.685 -3.684 -11.846 1.00 0.00 H new ATOM 0 HA LYS B 73 -0.632 -5.528 -9.739 1.00 0.00 H new ATOM 0 HB2 LYS B 73 -1.963 -5.635 -11.884 1.00 0.00 H new ATOM 0 HB3 LYS B 73 -0.488 -6.045 -12.736 1.00 0.00 H new ATOM 0 HG2 LYS B 73 -1.064 -7.757 -10.382 1.00 0.00 H new ATOM 0 HG3 LYS B 73 -2.249 -7.864 -11.669 1.00 0.00 H new ATOM 0 HD2 LYS B 73 -0.852 -9.283 -12.727 1.00 0.00 H new ATOM 0 HD3 LYS B 73 0.204 -7.918 -13.029 1.00 0.00 H new ATOM 0 HE2 LYS B 73 1.056 -8.421 -10.559 1.00 0.00 H new ATOM 0 HE3 LYS B 73 0.379 -10.008 -10.865 1.00 0.00 H new ATOM 0 HZ1 LYS B 73 2.707 -9.915 -11.475 1.00 0.00 H new ATOM 0 HZ2 LYS B 73 1.756 -10.181 -12.857 1.00 0.00 H new ATOM 0 HZ3 LYS B 73 2.412 -8.643 -12.560 1.00 0.00 H new ATOM 2896 N ASN B 74 1.873 -5.842 -9.512 1.00 0.00 N ATOM 2897 CA ASN B 74 3.234 -6.335 -9.337 1.00 0.00 C ATOM 2898 C ASN B 74 3.625 -6.326 -7.864 1.00 0.00 C ATOM 2899 O ASN B 74 3.731 -5.267 -7.244 1.00 0.00 O ATOM 2900 CB ASN B 74 4.219 -5.492 -10.151 1.00 0.00 C ATOM 2901 CG ASN B 74 4.267 -4.046 -9.696 1.00 0.00 C ATOM 2902 OD1 ASN B 74 3.379 -3.254 -10.010 1.00 0.00 O ATOM 2903 ND2 ASN B 74 5.310 -3.694 -8.956 1.00 0.00 N ATOM 0 H ASN B 74 1.461 -5.436 -8.672 1.00 0.00 H new ATOM 0 HA ASN B 74 3.272 -7.363 -9.699 1.00 0.00 H new ATOM 0 HB2 ASN B 74 5.215 -5.927 -10.071 1.00 0.00 H new ATOM 0 HB3 ASN B 74 3.938 -5.528 -11.204 1.00 0.00 H new ATOM 0 HD21 ASN B 74 5.399 -2.734 -8.624 1.00 0.00 H new ATOM 0 HD22 ASN B 74 6.023 -4.384 -8.719 1.00 0.00 H new ATOM 2910 N GLY B 75 3.832 -7.515 -7.307 1.00 0.00 N ATOM 2911 CA GLY B 75 4.202 -7.626 -5.908 1.00 0.00 C ATOM 2912 C GLY B 75 5.555 -7.007 -5.612 1.00 0.00 C ATOM 2913 O GLY B 75 6.590 -7.656 -5.762 1.00 0.00 O ATOM 0 H GLY B 75 3.750 -8.404 -7.800 1.00 0.00 H new ATOM 0 HA2 GLY B 75 3.442 -7.140 -5.295 1.00 0.00 H new ATOM 0 HA3 GLY B 75 4.217 -8.678 -5.622 1.00 0.00 H new ATOM 2917 N ALA B 76 5.542 -5.748 -5.188 1.00 0.00 N ATOM 2918 CA ALA B 76 6.772 -5.035 -4.866 1.00 0.00 C ATOM 2919 C ALA B 76 6.614 -4.229 -3.581 1.00 0.00 C ATOM 2920 O ALA B 76 5.566 -3.631 -3.341 1.00 0.00 O ATOM 2921 CB ALA B 76 7.174 -4.127 -6.017 1.00 0.00 C ATOM 0 H ALA B 76 4.692 -5.200 -5.059 1.00 0.00 H new ATOM 0 HA ALA B 76 7.561 -5.771 -4.709 1.00 0.00 H new ATOM 0 HB1 ALA B 76 8.094 -3.601 -5.762 1.00 0.00 H new ATOM 0 HB2 ALA B 76 7.335 -4.726 -6.914 1.00 0.00 H new ATOM 0 HB3 ALA B 76 6.382 -3.402 -6.202 1.00 0.00 H new ATOM 2927 N GLY B 77 7.657 -4.218 -2.760 1.00 0.00 N ATOM 2928 CA GLY B 77 7.606 -3.482 -1.510 1.00 0.00 C ATOM 2929 C GLY B 77 7.485 -1.987 -1.725 1.00 0.00 C ATOM 2930 O GLY B 77 8.438 -1.333 -2.149 1.00 0.00 O ATOM 0 H GLY B 77 8.536 -4.704 -2.936 1.00 0.00 H new ATOM 0 HA2 GLY B 77 6.759 -3.831 -0.920 1.00 0.00 H new ATOM 0 HA3 GLY B 77 8.505 -3.692 -0.931 1.00 0.00 H new ATOM 2934 N LEU B 78 6.307 -1.444 -1.432 1.00 0.00 N ATOM 2935 CA LEU B 78 6.059 -0.015 -1.593 1.00 0.00 C ATOM 2936 C LEU B 78 5.840 0.653 -0.240 1.00 0.00 C ATOM 2937 O LEU B 78 4.778 0.517 0.366 1.00 0.00 O ATOM 2938 CB LEU B 78 4.839 0.212 -2.490 1.00 0.00 C ATOM 2939 CG LEU B 78 4.439 1.676 -2.683 1.00 0.00 C ATOM 2940 CD1 LEU B 78 5.342 2.347 -3.707 1.00 0.00 C ATOM 2941 CD2 LEU B 78 2.982 1.778 -3.107 1.00 0.00 C ATOM 0 H LEU B 78 5.508 -1.973 -1.081 1.00 0.00 H new ATOM 0 HA LEU B 78 6.936 0.432 -2.062 1.00 0.00 H new ATOM 0 HB2 LEU B 78 5.040 -0.226 -3.468 1.00 0.00 H new ATOM 0 HB3 LEU B 78 3.991 -0.327 -2.067 1.00 0.00 H new ATOM 0 HG LEU B 78 4.558 2.193 -1.731 1.00 0.00 H new ATOM 0 HD11 LEU B 78 5.042 3.388 -3.830 1.00 0.00 H new ATOM 0 HD12 LEU B 78 6.376 2.306 -3.363 1.00 0.00 H new ATOM 0 HD13 LEU B 78 5.257 1.829 -4.662 1.00 0.00 H new ATOM 0 HD21 LEU B 78 2.714 2.826 -3.240 1.00 0.00 H new ATOM 0 HD22 LEU B 78 2.838 1.245 -4.047 1.00 0.00 H new ATOM 0 HD23 LEU B 78 2.348 1.336 -2.339 1.00 0.00 H new ATOM 2953 N HIS B 79 6.853 1.375 0.229 1.00 0.00 N ATOM 2954 CA HIS B 79 6.772 2.063 1.512 1.00 0.00 C ATOM 2955 C HIS B 79 6.966 3.566 1.340 1.00 0.00 C ATOM 2956 O HIS B 79 7.822 4.010 0.575 1.00 0.00 O ATOM 2957 CB HIS B 79 7.819 1.509 2.481 1.00 0.00 C ATOM 2958 CG HIS B 79 7.349 0.311 3.245 1.00 0.00 C ATOM 2959 ND1 HIS B 79 7.394 -0.971 2.737 1.00 0.00 N ATOM 2960 CD2 HIS B 79 6.821 0.203 4.488 1.00 0.00 C ATOM 2961 CE1 HIS B 79 6.914 -1.814 3.635 1.00 0.00 C ATOM 2962 NE2 HIS B 79 6.559 -1.127 4.704 1.00 0.00 N ATOM 0 H HIS B 79 7.739 1.499 -0.260 1.00 0.00 H new ATOM 0 HA HIS B 79 5.778 1.889 1.924 1.00 0.00 H new ATOM 0 HB2 HIS B 79 8.716 1.245 1.922 1.00 0.00 H new ATOM 0 HB3 HIS B 79 8.101 2.292 3.185 1.00 0.00 H new ATOM 0 HD2 HIS B 79 6.640 1.012 5.180 1.00 0.00 H new ATOM 0 HE1 HIS B 79 6.827 -2.884 3.514 1.00 0.00 H new ATOM 0 HE2 HIS B 79 6.155 -1.521 5.554 1.00 0.00 H new ATOM 2971 N THR B 80 6.164 4.343 2.060 1.00 0.00 N ATOM 2972 CA THR B 80 6.242 5.798 1.995 1.00 0.00 C ATOM 2973 C THR B 80 6.783 6.367 3.301 1.00 0.00 C ATOM 2974 O THR B 80 6.636 5.759 4.361 1.00 0.00 O ATOM 2975 CB THR B 80 4.863 6.390 1.698 1.00 0.00 C ATOM 2976 OG1 THR B 80 4.255 5.723 0.606 1.00 0.00 O ATOM 2977 CG2 THR B 80 4.904 7.867 1.369 1.00 0.00 C ATOM 0 H THR B 80 5.451 3.988 2.697 1.00 0.00 H new ATOM 0 HA THR B 80 6.925 6.068 1.190 1.00 0.00 H new ATOM 0 HB THR B 80 4.287 6.254 2.613 1.00 0.00 H new ATOM 0 HG1 THR B 80 3.374 6.115 0.433 1.00 0.00 H new ATOM 0 HG21 THR B 80 3.894 8.223 1.169 1.00 0.00 H new ATOM 0 HG22 THR B 80 5.322 8.416 2.213 1.00 0.00 H new ATOM 0 HG23 THR B 80 5.526 8.026 0.488 1.00 0.00 H new ATOM 2985 N ALA B 81 7.404 7.540 3.224 1.00 0.00 N ATOM 2986 CA ALA B 81 7.957 8.188 4.408 1.00 0.00 C ATOM 2987 C ALA B 81 7.492 9.631 4.479 1.00 0.00 C ATOM 2988 O ALA B 81 7.413 10.308 3.456 1.00 0.00 O ATOM 2989 CB ALA B 81 9.478 8.121 4.397 1.00 0.00 C ATOM 0 H ALA B 81 7.537 8.060 2.357 1.00 0.00 H new ATOM 0 HA ALA B 81 7.598 7.659 5.291 1.00 0.00 H new ATOM 0 HB1 ALA B 81 9.870 8.610 5.289 1.00 0.00 H new ATOM 0 HB2 ALA B 81 9.796 7.079 4.385 1.00 0.00 H new ATOM 0 HB3 ALA B 81 9.858 8.626 3.509 1.00 0.00 H new ATOM 2995 N ALA B 82 7.171 10.102 5.677 1.00 0.00 N ATOM 2996 CA ALA B 82 6.704 11.469 5.823 1.00 0.00 C ATOM 2997 C ALA B 82 6.859 12.010 7.234 1.00 0.00 C ATOM 2998 O ALA B 82 6.256 11.509 8.184 1.00 0.00 O ATOM 2999 CB ALA B 82 5.263 11.575 5.370 1.00 0.00 C ATOM 0 H ALA B 82 7.224 9.568 6.544 1.00 0.00 H new ATOM 0 HA ALA B 82 7.338 12.088 5.188 1.00 0.00 H new ATOM 0 HB1 ALA B 82 4.921 12.604 5.483 1.00 0.00 H new ATOM 0 HB2 ALA B 82 5.188 11.281 4.323 1.00 0.00 H new ATOM 0 HB3 ALA B 82 4.641 10.917 5.977 1.00 0.00 H new ATOM 3005 N SER B 83 7.644 13.072 7.341 1.00 0.00 N ATOM 3006 CA SER B 83 7.869 13.752 8.602 1.00 0.00 C ATOM 3007 C SER B 83 7.432 15.201 8.444 1.00 0.00 C ATOM 3008 O SER B 83 7.982 15.935 7.623 1.00 0.00 O ATOM 3009 CB SER B 83 9.345 13.677 8.993 1.00 0.00 C ATOM 3010 OG SER B 83 9.525 13.966 10.369 1.00 0.00 O ATOM 0 H SER B 83 8.142 13.485 6.553 1.00 0.00 H new ATOM 0 HA SER B 83 7.292 13.273 9.393 1.00 0.00 H new ATOM 0 HB2 SER B 83 9.732 12.682 8.774 1.00 0.00 H new ATOM 0 HB3 SER B 83 9.920 14.382 8.392 1.00 0.00 H new ATOM 0 HG SER B 83 10.477 13.910 10.593 1.00 0.00 H new ATOM 3016 N CYS B 84 6.421 15.602 9.201 1.00 0.00 N ATOM 3017 CA CYS B 84 5.898 16.957 9.100 1.00 0.00 C ATOM 3018 C CYS B 84 6.278 17.806 10.302 1.00 0.00 C ATOM 3019 O CYS B 84 6.528 17.293 11.393 1.00 0.00 O ATOM 3020 CB CYS B 84 4.379 16.930 8.955 1.00 0.00 C ATOM 3021 SG CYS B 84 3.757 15.686 7.796 1.00 0.00 S ATOM 0 H CYS B 84 5.949 15.013 9.887 1.00 0.00 H new ATOM 0 HA CYS B 84 6.345 17.408 8.214 1.00 0.00 H new ATOM 0 HB2 CYS B 84 3.936 16.749 9.935 1.00 0.00 H new ATOM 0 HB3 CYS B 84 4.040 17.913 8.629 1.00 0.00 H new ATOM 0 HG CYS B 84 2.459 15.746 7.750 1.00 0.00 H new ATOM 3027 N TRP B 85 6.306 19.115 10.086 1.00 0.00 N ATOM 3028 CA TRP B 85 6.640 20.058 11.144 1.00 0.00 C ATOM 3029 C TRP B 85 5.447 20.213 12.093 1.00 0.00 C ATOM 3030 O TRP B 85 4.597 19.327 12.167 1.00 0.00 O ATOM 3031 CB TRP B 85 7.018 21.409 10.529 1.00 0.00 C ATOM 3032 CG TRP B 85 8.189 22.056 11.194 1.00 0.00 C ATOM 3033 CD1 TRP B 85 9.444 21.539 11.316 1.00 0.00 C ATOM 3034 CD2 TRP B 85 8.219 23.340 11.829 1.00 0.00 C ATOM 3035 NE1 TRP B 85 10.257 22.422 11.980 1.00 0.00 N ATOM 3036 CE2 TRP B 85 9.528 23.535 12.308 1.00 0.00 C ATOM 3037 CE3 TRP B 85 7.268 24.344 12.036 1.00 0.00 C ATOM 3038 CZ2 TRP B 85 9.908 24.693 12.983 1.00 0.00 C ATOM 3039 CZ3 TRP B 85 7.647 25.491 12.705 1.00 0.00 C ATOM 3040 CH2 TRP B 85 8.957 25.658 13.172 1.00 0.00 C ATOM 0 H TRP B 85 6.101 19.548 9.185 1.00 0.00 H new ATOM 0 HA TRP B 85 7.491 19.683 11.713 1.00 0.00 H new ATOM 0 HB2 TRP B 85 7.242 21.269 9.471 1.00 0.00 H new ATOM 0 HB3 TRP B 85 6.160 22.079 10.587 1.00 0.00 H new ATOM 0 HD1 TRP B 85 9.754 20.574 10.944 1.00 0.00 H new ATOM 0 HE1 TRP B 85 11.243 22.274 12.195 1.00 0.00 H new ATOM 0 HE3 TRP B 85 6.256 24.225 11.679 1.00 0.00 H new ATOM 0 HZ2 TRP B 85 10.917 24.824 13.344 1.00 0.00 H new ATOM 0 HZ3 TRP B 85 6.921 26.273 12.871 1.00 0.00 H new ATOM 0 HH2 TRP B 85 9.222 26.567 13.692 1.00 0.00 H new ATOM 3051 N TRP B 86 5.376 21.328 12.818 1.00 0.00 N ATOM 3052 CA TRP B 86 4.272 21.551 13.743 1.00 0.00 C ATOM 3053 C TRP B 86 3.086 22.183 13.022 1.00 0.00 C ATOM 3054 O TRP B 86 3.252 23.103 12.221 1.00 0.00 O ATOM 3055 CB TRP B 86 4.718 22.449 14.899 1.00 0.00 C ATOM 3056 CG TRP B 86 5.351 21.697 16.031 1.00 0.00 C ATOM 3057 CD1 TRP B 86 5.961 20.477 15.968 1.00 0.00 C ATOM 3058 CD2 TRP B 86 5.436 22.119 17.397 1.00 0.00 C ATOM 3059 NE1 TRP B 86 6.418 20.114 17.212 1.00 0.00 N ATOM 3060 CE2 TRP B 86 6.109 21.105 18.105 1.00 0.00 C ATOM 3061 CE3 TRP B 86 5.009 23.255 18.090 1.00 0.00 C ATOM 3062 CZ2 TRP B 86 6.364 21.195 19.472 1.00 0.00 C ATOM 3063 CZ3 TRP B 86 5.262 23.343 19.446 1.00 0.00 C ATOM 3064 CH2 TRP B 86 5.935 22.319 20.124 1.00 0.00 C ATOM 0 H TRP B 86 6.062 22.082 12.783 1.00 0.00 H new ATOM 0 HA TRP B 86 3.963 20.585 14.144 1.00 0.00 H new ATOM 0 HB2 TRP B 86 5.426 23.187 14.523 1.00 0.00 H new ATOM 0 HB3 TRP B 86 3.855 22.998 15.276 1.00 0.00 H new ATOM 0 HD1 TRP B 86 6.069 19.884 15.072 1.00 0.00 H new ATOM 0 HE1 TRP B 86 6.908 19.247 17.434 1.00 0.00 H new ATOM 0 HE3 TRP B 86 4.490 24.050 17.575 1.00 0.00 H new ATOM 0 HZ2 TRP B 86 6.881 20.406 19.998 1.00 0.00 H new ATOM 0 HZ3 TRP B 86 4.935 24.216 19.992 1.00 0.00 H new ATOM 0 HH2 TRP B 86 6.119 22.418 21.184 1.00 0.00 H new ATOM 3075 N ASP B 87 1.887 21.683 13.316 1.00 0.00 N ATOM 3076 CA ASP B 87 0.662 22.190 12.699 1.00 0.00 C ATOM 3077 C ASP B 87 -0.553 21.400 13.177 1.00 0.00 C ATOM 3078 O ASP B 87 -0.808 20.291 12.706 1.00 0.00 O ATOM 3079 CB ASP B 87 0.753 22.114 11.171 1.00 0.00 C ATOM 3080 CG ASP B 87 0.086 23.295 10.492 1.00 0.00 C ATOM 3081 OD1 ASP B 87 -0.043 24.355 11.139 1.00 0.00 O ATOM 3082 OD2 ASP B 87 -0.306 23.158 9.315 1.00 0.00 O ATOM 0 H ASP B 87 1.737 20.924 13.981 1.00 0.00 H new ATOM 0 HA ASP B 87 0.547 23.232 12.998 1.00 0.00 H new ATOM 0 HB2 ASP B 87 1.801 22.072 10.874 1.00 0.00 H new ATOM 0 HB3 ASP B 87 0.287 21.190 10.828 1.00 0.00 H new ATOM 3087 N SER B 88 -1.298 21.976 14.114 1.00 0.00 N ATOM 3088 CA SER B 88 -2.486 21.322 14.655 1.00 0.00 C ATOM 3089 C SER B 88 -3.695 21.519 13.741 1.00 0.00 C ATOM 3090 O SER B 88 -4.627 20.714 13.752 1.00 0.00 O ATOM 3091 CB SER B 88 -2.796 21.865 16.050 1.00 0.00 C ATOM 3092 OG SER B 88 -4.094 21.480 16.471 1.00 0.00 O ATOM 0 H SER B 88 -1.102 22.893 14.515 1.00 0.00 H new ATOM 0 HA SER B 88 -2.279 20.254 14.719 1.00 0.00 H new ATOM 0 HB2 SER B 88 -2.056 21.496 16.760 1.00 0.00 H new ATOM 0 HB3 SER B 88 -2.719 22.952 16.046 1.00 0.00 H new ATOM 0 HG SER B 88 -4.267 21.838 17.366 1.00 0.00 H new ATOM 3098 N THR B 89 -3.681 22.594 12.957 1.00 0.00 N ATOM 3099 CA THR B 89 -4.782 22.894 12.049 1.00 0.00 C ATOM 3100 C THR B 89 -4.866 21.874 10.918 1.00 0.00 C ATOM 3101 O THR B 89 -5.946 21.382 10.595 1.00 0.00 O ATOM 3102 CB THR B 89 -4.621 24.301 11.469 1.00 0.00 C ATOM 3103 OG1 THR B 89 -5.696 24.612 10.601 1.00 0.00 O ATOM 3104 CG2 THR B 89 -3.335 24.484 10.692 1.00 0.00 C ATOM 0 H THR B 89 -2.919 23.271 12.933 1.00 0.00 H new ATOM 0 HA THR B 89 -5.708 22.842 12.622 1.00 0.00 H new ATOM 0 HB THR B 89 -4.604 24.968 12.331 1.00 0.00 H new ATOM 0 HG1 THR B 89 -6.546 24.434 11.056 1.00 0.00 H new ATOM 0 HG21 THR B 89 -3.284 25.503 10.308 1.00 0.00 H new ATOM 0 HG22 THR B 89 -2.484 24.300 11.348 1.00 0.00 H new ATOM 0 HG23 THR B 89 -3.310 23.781 9.859 1.00 0.00 H new ATOM 3112 N THR B 90 -3.725 21.562 10.313 1.00 0.00 N ATOM 3113 CA THR B 90 -3.678 20.609 9.214 1.00 0.00 C ATOM 3114 C THR B 90 -3.762 19.175 9.733 1.00 0.00 C ATOM 3115 O THR B 90 -2.826 18.389 9.585 1.00 0.00 O ATOM 3116 CB THR B 90 -2.394 20.804 8.403 1.00 0.00 C ATOM 3117 OG1 THR B 90 -1.260 20.810 9.252 1.00 0.00 O ATOM 3118 CG2 THR B 90 -2.379 22.093 7.609 1.00 0.00 C ATOM 0 H THR B 90 -2.820 21.957 10.567 1.00 0.00 H new ATOM 0 HA THR B 90 -4.537 20.788 8.568 1.00 0.00 H new ATOM 0 HB THR B 90 -2.362 19.966 7.707 1.00 0.00 H new ATOM 0 HG1 THR B 90 -0.678 21.562 9.016 1.00 0.00 H new ATOM 0 HG21 THR B 90 -1.442 22.170 7.057 1.00 0.00 H new ATOM 0 HG22 THR B 90 -3.214 22.099 6.909 1.00 0.00 H new ATOM 0 HG23 THR B 90 -2.470 22.940 8.289 1.00 0.00 H new ATOM 3126 N ASP B 91 -4.896 18.841 10.343 1.00 0.00 N ATOM 3127 CA ASP B 91 -5.107 17.504 10.885 1.00 0.00 C ATOM 3128 C ASP B 91 -6.232 16.785 10.148 1.00 0.00 C ATOM 3129 O ASP B 91 -7.411 17.033 10.398 1.00 0.00 O ATOM 3130 CB ASP B 91 -5.425 17.578 12.379 1.00 0.00 C ATOM 3131 CG ASP B 91 -5.520 16.207 13.019 1.00 0.00 C ATOM 3132 OD1 ASP B 91 -6.616 15.609 12.984 1.00 0.00 O ATOM 3133 OD2 ASP B 91 -4.498 15.731 13.557 1.00 0.00 O ATOM 0 H ASP B 91 -5.682 19.478 10.474 1.00 0.00 H new ATOM 0 HA ASP B 91 -4.187 16.937 10.745 1.00 0.00 H new ATOM 0 HB2 ASP B 91 -4.653 18.159 12.884 1.00 0.00 H new ATOM 0 HB3 ASP B 91 -6.367 18.108 12.521 1.00 0.00 H new ATOM 3138 N GLY B 92 -5.857 15.896 9.232 1.00 0.00 N ATOM 3139 CA GLY B 92 -6.851 15.159 8.466 1.00 0.00 C ATOM 3140 C GLY B 92 -6.308 13.913 7.775 1.00 0.00 C ATOM 3141 O GLY B 92 -7.054 12.957 7.565 1.00 0.00 O ATOM 0 H GLY B 92 -4.888 15.673 9.006 1.00 0.00 H new ATOM 0 HA2 GLY B 92 -7.663 14.867 9.132 1.00 0.00 H new ATOM 0 HA3 GLY B 92 -7.278 15.822 7.713 1.00 0.00 H new ATOM 3145 N SER B 93 -5.018 13.940 7.403 1.00 0.00 N ATOM 3146 CA SER B 93 -4.339 12.830 6.705 1.00 0.00 C ATOM 3147 C SER B 93 -4.930 11.447 7.002 1.00 0.00 C ATOM 3148 O SER B 93 -4.563 10.796 7.980 1.00 0.00 O ATOM 3149 CB SER B 93 -2.853 12.829 7.068 1.00 0.00 C ATOM 3150 OG SER B 93 -2.651 12.343 8.384 1.00 0.00 O ATOM 0 H SER B 93 -4.409 14.739 7.579 1.00 0.00 H new ATOM 0 HA SER B 93 -4.488 13.008 5.640 1.00 0.00 H new ATOM 0 HB2 SER B 93 -2.303 12.210 6.360 1.00 0.00 H new ATOM 0 HB3 SER B 93 -2.454 13.840 6.985 1.00 0.00 H new ATOM 0 HG SER B 93 -3.039 11.447 8.465 1.00 0.00 H new ATOM 3156 N ARG B 94 -5.836 11.005 6.132 1.00 0.00 N ATOM 3157 CA ARG B 94 -6.470 9.698 6.271 1.00 0.00 C ATOM 3158 C ARG B 94 -6.380 8.936 4.952 1.00 0.00 C ATOM 3159 O ARG B 94 -7.040 9.294 3.976 1.00 0.00 O ATOM 3160 CB ARG B 94 -7.934 9.856 6.690 1.00 0.00 C ATOM 3161 CG ARG B 94 -8.135 9.863 8.199 1.00 0.00 C ATOM 3162 CD ARG B 94 -9.083 10.970 8.638 1.00 0.00 C ATOM 3163 NE ARG B 94 -8.624 11.630 9.860 1.00 0.00 N ATOM 3164 CZ ARG B 94 -9.088 12.802 10.295 1.00 0.00 C ATOM 3165 NH1 ARG B 94 -10.028 13.453 9.617 1.00 0.00 N ATOM 3166 NH2 ARG B 94 -8.611 13.325 11.416 1.00 0.00 N ATOM 0 H ARG B 94 -6.148 11.537 5.320 1.00 0.00 H new ATOM 0 HA ARG B 94 -5.948 9.135 7.045 1.00 0.00 H new ATOM 0 HB2 ARG B 94 -8.324 10.785 6.275 1.00 0.00 H new ATOM 0 HB3 ARG B 94 -8.518 9.043 6.257 1.00 0.00 H new ATOM 0 HG2 ARG B 94 -8.530 8.898 8.517 1.00 0.00 H new ATOM 0 HG3 ARG B 94 -7.172 9.992 8.693 1.00 0.00 H new ATOM 0 HD2 ARG B 94 -9.174 11.707 7.840 1.00 0.00 H new ATOM 0 HD3 ARG B 94 -10.077 10.553 8.802 1.00 0.00 H new ATOM 0 HE ARG B 94 -7.905 11.165 10.414 1.00 0.00 H new ATOM 0 HH11 ARG B 94 -10.402 13.057 8.755 1.00 0.00 H new ATOM 0 HH12 ARG B 94 -10.376 14.349 9.959 1.00 0.00 H new ATOM 0 HH21 ARG B 94 -7.891 12.831 11.943 1.00 0.00 H new ATOM 0 HH22 ARG B 94 -8.964 14.221 11.751 1.00 0.00 H new ATOM 3180 N THR B 95 -5.543 7.902 4.915 1.00 0.00 N ATOM 3181 CA THR B 95 -5.361 7.124 3.694 1.00 0.00 C ATOM 3182 C THR B 95 -6.278 5.899 3.641 1.00 0.00 C ATOM 3183 O THR B 95 -6.617 5.313 4.667 1.00 0.00 O ATOM 3184 CB THR B 95 -3.882 6.728 3.525 1.00 0.00 C ATOM 3185 OG1 THR B 95 -3.563 6.571 2.155 1.00 0.00 O ATOM 3186 CG2 THR B 95 -3.488 5.446 4.227 1.00 0.00 C ATOM 0 H THR B 95 -4.985 7.586 5.709 1.00 0.00 H new ATOM 0 HA THR B 95 -5.647 7.759 2.855 1.00 0.00 H new ATOM 0 HB THR B 95 -3.328 7.546 3.986 1.00 0.00 H new ATOM 0 HG1 THR B 95 -2.620 6.796 2.011 1.00 0.00 H new ATOM 0 HG21 THR B 95 -2.431 5.246 4.053 1.00 0.00 H new ATOM 0 HG22 THR B 95 -3.667 5.547 5.297 1.00 0.00 H new ATOM 0 HG23 THR B 95 -4.082 4.620 3.836 1.00 0.00 H new ATOM 3194 N VAL B 96 -6.653 5.516 2.423 1.00 0.00 N ATOM 3195 CA VAL B 96 -7.509 4.358 2.202 1.00 0.00 C ATOM 3196 C VAL B 96 -6.968 3.545 1.025 1.00 0.00 C ATOM 3197 O VAL B 96 -6.661 4.096 -0.032 1.00 0.00 O ATOM 3198 CB VAL B 96 -8.982 4.786 1.942 1.00 0.00 C ATOM 3199 CG1 VAL B 96 -9.836 3.647 1.380 1.00 0.00 C ATOM 3200 CG2 VAL B 96 -9.610 5.314 3.217 1.00 0.00 C ATOM 0 H VAL B 96 -6.373 5.997 1.568 1.00 0.00 H new ATOM 0 HA VAL B 96 -7.503 3.742 3.101 1.00 0.00 H new ATOM 0 HB VAL B 96 -8.952 5.574 1.189 1.00 0.00 H new ATOM 0 HG11 VAL B 96 -10.854 4.001 1.218 1.00 0.00 H new ATOM 0 HG12 VAL B 96 -9.414 3.309 0.433 1.00 0.00 H new ATOM 0 HG13 VAL B 96 -9.849 2.818 2.088 1.00 0.00 H new ATOM 0 HG21 VAL B 96 -10.640 5.610 3.020 1.00 0.00 H new ATOM 0 HG22 VAL B 96 -9.596 4.535 3.979 1.00 0.00 H new ATOM 0 HG23 VAL B 96 -9.046 6.177 3.570 1.00 0.00 H new ATOM 3210 N ARG B 97 -6.846 2.239 1.218 1.00 0.00 N ATOM 3211 CA ARG B 97 -6.337 1.365 0.171 1.00 0.00 C ATOM 3212 C ARG B 97 -7.471 0.621 -0.524 1.00 0.00 C ATOM 3213 O ARG B 97 -8.188 -0.164 0.099 1.00 0.00 O ATOM 3214 CB ARG B 97 -5.337 0.365 0.755 1.00 0.00 C ATOM 3215 CG ARG B 97 -4.726 -0.563 -0.284 1.00 0.00 C ATOM 3216 CD ARG B 97 -3.288 -0.182 -0.604 1.00 0.00 C ATOM 3217 NE ARG B 97 -2.419 -0.297 0.565 1.00 0.00 N ATOM 3218 CZ ARG B 97 -1.089 -0.210 0.520 1.00 0.00 C ATOM 3219 NH1 ARG B 97 -0.463 -0.005 -0.633 1.00 0.00 N ATOM 3220 NH2 ARG B 97 -0.381 -0.330 1.635 1.00 0.00 N ATOM 0 H ARG B 97 -7.091 1.763 2.086 1.00 0.00 H new ATOM 0 HA ARG B 97 -5.832 1.986 -0.569 1.00 0.00 H new ATOM 0 HB2 ARG B 97 -4.538 0.913 1.255 1.00 0.00 H new ATOM 0 HB3 ARG B 97 -5.837 -0.234 1.516 1.00 0.00 H new ATOM 0 HG2 ARG B 97 -4.758 -1.589 0.082 1.00 0.00 H new ATOM 0 HG3 ARG B 97 -5.322 -0.531 -1.196 1.00 0.00 H new ATOM 0 HD2 ARG B 97 -2.911 -0.824 -1.400 1.00 0.00 H new ATOM 0 HD3 ARG B 97 -3.259 0.841 -0.979 1.00 0.00 H new ATOM 0 HE ARG B 97 -2.857 -0.454 1.473 1.00 0.00 H new ATOM 0 HH11 ARG B 97 -1.000 0.088 -1.495 1.00 0.00 H new ATOM 0 HH12 ARG B 97 0.555 0.060 -0.656 1.00 0.00 H new ATOM 0 HH21 ARG B 97 -0.854 -0.489 2.525 1.00 0.00 H new ATOM 0 HH22 ARG B 97 0.636 -0.264 1.603 1.00 0.00 H new ATOM 3234 N TRP B 98 -7.619 0.863 -1.822 1.00 0.00 N ATOM 3235 CA TRP B 98 -8.658 0.206 -2.608 1.00 0.00 C ATOM 3236 C TRP B 98 -8.081 -1.004 -3.331 1.00 0.00 C ATOM 3237 O TRP B 98 -6.911 -1.006 -3.719 1.00 0.00 O ATOM 3238 CB TRP B 98 -9.251 1.169 -3.641 1.00 0.00 C ATOM 3239 CG TRP B 98 -10.288 2.105 -3.102 1.00 0.00 C ATOM 3240 CD1 TRP B 98 -11.642 2.008 -3.256 1.00 0.00 C ATOM 3241 CD2 TRP B 98 -10.050 3.293 -2.348 1.00 0.00 C ATOM 3242 NE1 TRP B 98 -12.266 3.068 -2.642 1.00 0.00 N ATOM 3243 CE2 TRP B 98 -11.305 3.871 -2.069 1.00 0.00 C ATOM 3244 CE3 TRP B 98 -8.897 3.921 -1.877 1.00 0.00 C ATOM 3245 CZ2 TRP B 98 -11.425 5.052 -1.338 1.00 0.00 C ATOM 3246 CZ3 TRP B 98 -9.024 5.089 -1.156 1.00 0.00 C ATOM 3247 CH2 TRP B 98 -10.279 5.643 -0.892 1.00 0.00 C ATOM 0 H TRP B 98 -7.034 1.509 -2.352 1.00 0.00 H new ATOM 0 HA TRP B 98 -9.446 -0.112 -1.925 1.00 0.00 H new ATOM 0 HB2 TRP B 98 -8.442 1.756 -4.076 1.00 0.00 H new ATOM 0 HB3 TRP B 98 -9.692 0.586 -4.449 1.00 0.00 H new ATOM 0 HD1 TRP B 98 -12.149 1.214 -3.784 1.00 0.00 H new ATOM 0 HE1 TRP B 98 -13.272 3.232 -2.615 1.00 0.00 H new ATOM 0 HE3 TRP B 98 -7.922 3.500 -2.074 1.00 0.00 H new ATOM 0 HZ2 TRP B 98 -12.393 5.485 -1.132 1.00 0.00 H new ATOM 0 HZ3 TRP B 98 -8.138 5.585 -0.789 1.00 0.00 H new ATOM 0 HH2 TRP B 98 -10.343 6.559 -0.323 1.00 0.00 H new ATOM 3258 N GLU B 99 -8.902 -2.029 -3.512 1.00 0.00 N ATOM 3259 CA GLU B 99 -8.466 -3.242 -4.190 1.00 0.00 C ATOM 3260 C GLU B 99 -9.610 -3.870 -4.979 1.00 0.00 C ATOM 3261 O GLU B 99 -10.746 -3.928 -4.507 1.00 0.00 O ATOM 3262 CB GLU B 99 -7.915 -4.243 -3.174 1.00 0.00 C ATOM 3263 CG GLU B 99 -6.410 -4.138 -2.970 1.00 0.00 C ATOM 3264 CD GLU B 99 -6.034 -3.784 -1.543 1.00 0.00 C ATOM 3265 OE1 GLU B 99 -6.857 -3.150 -0.852 1.00 0.00 O ATOM 3266 OE2 GLU B 99 -4.916 -4.144 -1.118 1.00 0.00 O ATOM 0 H GLU B 99 -9.873 -2.045 -3.199 1.00 0.00 H new ATOM 0 HA GLU B 99 -7.676 -2.974 -4.892 1.00 0.00 H new ATOM 0 HB2 GLU B 99 -8.415 -4.089 -2.217 1.00 0.00 H new ATOM 0 HB3 GLU B 99 -8.159 -5.253 -3.503 1.00 0.00 H new ATOM 0 HG2 GLU B 99 -5.944 -5.086 -3.239 1.00 0.00 H new ATOM 0 HG3 GLU B 99 -6.008 -3.382 -3.645 1.00 0.00 H new ATOM 3273 N ASN B 100 -9.301 -4.339 -6.185 1.00 0.00 N ATOM 3274 CA ASN B 100 -10.301 -4.966 -7.043 1.00 0.00 C ATOM 3275 C ASN B 100 -10.025 -6.459 -7.202 1.00 0.00 C ATOM 3276 O ASN B 100 -10.859 -7.294 -6.850 1.00 0.00 O ATOM 3277 CB ASN B 100 -10.345 -4.288 -8.420 1.00 0.00 C ATOM 3278 CG ASN B 100 -8.969 -3.926 -8.950 1.00 0.00 C ATOM 3279 OD1 ASN B 100 -8.332 -4.716 -9.648 1.00 0.00 O ATOM 3280 ND2 ASN B 100 -8.504 -2.726 -8.620 1.00 0.00 N ATOM 0 H ASN B 100 -8.366 -4.296 -6.590 1.00 0.00 H new ATOM 0 HA ASN B 100 -11.272 -4.842 -6.564 1.00 0.00 H new ATOM 0 HB2 ASN B 100 -10.838 -4.952 -9.130 1.00 0.00 H new ATOM 0 HB3 ASN B 100 -10.952 -3.385 -8.354 1.00 0.00 H new ATOM 0 HD21 ASN B 100 -7.585 -2.427 -8.947 1.00 0.00 H new ATOM 0 HD22 ASN B 100 -9.066 -2.103 -8.039 1.00 0.00 H new ATOM 3287 N LYS B 101 -8.849 -6.793 -7.727 1.00 0.00 N ATOM 3288 CA LYS B 101 -8.476 -8.190 -7.921 1.00 0.00 C ATOM 3289 C LYS B 101 -6.960 -8.363 -8.007 1.00 0.00 C ATOM 3290 O LYS B 101 -6.407 -9.302 -7.435 1.00 0.00 O ATOM 3291 CB LYS B 101 -9.145 -8.763 -9.175 1.00 0.00 C ATOM 3292 CG LYS B 101 -9.119 -7.830 -10.377 1.00 0.00 C ATOM 3293 CD LYS B 101 -7.873 -8.042 -11.219 1.00 0.00 C ATOM 3294 CE LYS B 101 -7.350 -6.728 -11.771 1.00 0.00 C ATOM 3295 NZ LYS B 101 -6.745 -6.894 -13.122 1.00 0.00 N ATOM 0 H LYS B 101 -8.143 -6.120 -8.024 1.00 0.00 H new ATOM 0 HA LYS B 101 -8.828 -8.743 -7.050 1.00 0.00 H new ATOM 0 HB2 LYS B 101 -8.650 -9.696 -9.443 1.00 0.00 H new ATOM 0 HB3 LYS B 101 -10.181 -9.007 -8.941 1.00 0.00 H new ATOM 0 HG2 LYS B 101 -10.006 -7.998 -10.988 1.00 0.00 H new ATOM 0 HG3 LYS B 101 -9.158 -6.795 -10.037 1.00 0.00 H new ATOM 0 HD2 LYS B 101 -7.100 -8.519 -10.616 1.00 0.00 H new ATOM 0 HD3 LYS B 101 -8.099 -8.720 -12.042 1.00 0.00 H new ATOM 0 HE2 LYS B 101 -8.165 -6.007 -11.825 1.00 0.00 H new ATOM 0 HE3 LYS B 101 -6.606 -6.318 -11.088 1.00 0.00 H new ATOM 0 HZ1 LYS B 101 -6.370 -5.981 -13.449 1.00 0.00 H new ATOM 0 HZ2 LYS B 101 -5.972 -7.588 -13.073 1.00 0.00 H new ATOM 0 HZ3 LYS B 101 -7.470 -7.229 -13.788 1.00 0.00 H new ATOM 3309 N SER B 102 -6.291 -7.464 -8.723 1.00 0.00 N ATOM 3310 CA SER B 102 -4.841 -7.541 -8.872 1.00 0.00 C ATOM 3311 C SER B 102 -4.189 -6.190 -8.597 1.00 0.00 C ATOM 3312 O SER B 102 -3.215 -6.100 -7.850 1.00 0.00 O ATOM 3313 CB SER B 102 -4.464 -8.026 -10.274 1.00 0.00 C ATOM 3314 OG SER B 102 -4.468 -6.960 -11.208 1.00 0.00 O ATOM 0 H SER B 102 -6.726 -6.678 -9.206 1.00 0.00 H new ATOM 0 HA SER B 102 -4.472 -8.259 -8.140 1.00 0.00 H new ATOM 0 HB2 SER B 102 -3.476 -8.486 -10.248 1.00 0.00 H new ATOM 0 HB3 SER B 102 -5.165 -8.796 -10.595 1.00 0.00 H new ATOM 0 HG SER B 102 -4.238 -7.303 -12.097 1.00 0.00 H new ATOM 3320 N MET B 103 -4.729 -5.145 -9.211 1.00 0.00 N ATOM 3321 CA MET B 103 -4.198 -3.798 -9.038 1.00 0.00 C ATOM 3322 C MET B 103 -4.738 -3.154 -7.765 1.00 0.00 C ATOM 3323 O MET B 103 -5.871 -3.413 -7.358 1.00 0.00 O ATOM 3324 CB MET B 103 -4.550 -2.931 -10.248 1.00 0.00 C ATOM 3325 CG MET B 103 -3.710 -1.669 -10.357 1.00 0.00 C ATOM 3326 SD MET B 103 -4.125 -0.680 -11.806 1.00 0.00 S ATOM 3327 CE MET B 103 -2.929 -1.295 -12.989 1.00 0.00 C ATOM 0 H MET B 103 -5.535 -5.204 -9.834 1.00 0.00 H new ATOM 0 HA MET B 103 -3.114 -3.873 -8.952 1.00 0.00 H new ATOM 0 HB2 MET B 103 -4.424 -3.521 -11.156 1.00 0.00 H new ATOM 0 HB3 MET B 103 -5.602 -2.653 -10.192 1.00 0.00 H new ATOM 0 HG2 MET B 103 -3.849 -1.067 -9.459 1.00 0.00 H new ATOM 0 HG3 MET B 103 -2.655 -1.942 -10.398 1.00 0.00 H new ATOM 0 HE1 MET B 103 -2.283 -0.479 -13.311 1.00 0.00 H new ATOM 0 HE2 MET B 103 -2.325 -2.074 -12.524 1.00 0.00 H new ATOM 0 HE3 MET B 103 -3.451 -1.707 -13.853 1.00 0.00 H new ATOM 3337 N TYR B 104 -3.920 -2.311 -7.143 1.00 0.00 N ATOM 3338 CA TYR B 104 -4.314 -1.625 -5.918 1.00 0.00 C ATOM 3339 C TYR B 104 -4.201 -0.113 -6.088 1.00 0.00 C ATOM 3340 O TYR B 104 -3.418 0.371 -6.906 1.00 0.00 O ATOM 3341 CB TYR B 104 -3.445 -2.085 -4.744 1.00 0.00 C ATOM 3342 CG TYR B 104 -3.220 -3.582 -4.695 1.00 0.00 C ATOM 3343 CD1 TYR B 104 -4.239 -4.471 -5.017 1.00 0.00 C ATOM 3344 CD2 TYR B 104 -1.988 -4.106 -4.323 1.00 0.00 C ATOM 3345 CE1 TYR B 104 -4.037 -5.837 -4.970 1.00 0.00 C ATOM 3346 CE2 TYR B 104 -1.778 -5.471 -4.275 1.00 0.00 C ATOM 3347 CZ TYR B 104 -2.805 -6.331 -4.599 1.00 0.00 C ATOM 3348 OH TYR B 104 -2.599 -7.691 -4.551 1.00 0.00 O ATOM 0 H TYR B 104 -2.979 -2.087 -7.468 1.00 0.00 H new ATOM 0 HA TYR B 104 -5.354 -1.876 -5.707 1.00 0.00 H new ATOM 0 HB2 TYR B 104 -2.479 -1.584 -4.802 1.00 0.00 H new ATOM 0 HB3 TYR B 104 -3.913 -1.767 -3.812 1.00 0.00 H new ATOM 0 HD1 TYR B 104 -5.205 -4.087 -5.309 1.00 0.00 H new ATOM 0 HD2 TYR B 104 -1.181 -3.435 -4.067 1.00 0.00 H new ATOM 0 HE1 TYR B 104 -4.840 -6.514 -5.223 1.00 0.00 H new ATOM 0 HE2 TYR B 104 -0.814 -5.862 -3.985 1.00 0.00 H new ATOM 0 HH TYR B 104 -1.677 -7.873 -4.272 1.00 0.00 H new ATOM 3358 N CYS B 105 -4.988 0.629 -5.316 1.00 0.00 N ATOM 3359 CA CYS B 105 -4.971 2.086 -5.391 1.00 0.00 C ATOM 3360 C CYS B 105 -5.199 2.707 -4.016 1.00 0.00 C ATOM 3361 O CYS B 105 -6.286 2.602 -3.451 1.00 0.00 O ATOM 3362 CB CYS B 105 -6.039 2.579 -6.368 1.00 0.00 C ATOM 3363 SG CYS B 105 -5.758 2.078 -8.083 1.00 0.00 S ATOM 0 H CYS B 105 -5.643 0.248 -4.634 1.00 0.00 H new ATOM 0 HA CYS B 105 -3.989 2.394 -5.749 1.00 0.00 H new ATOM 0 HB2 CYS B 105 -7.011 2.205 -6.046 1.00 0.00 H new ATOM 0 HB3 CYS B 105 -6.084 3.667 -6.321 1.00 0.00 H new ATOM 0 HG CYS B 105 -4.654 1.396 -8.160 1.00 0.00 H new ATOM 3369 N ILE B 106 -4.167 3.357 -3.486 1.00 0.00 N ATOM 3370 CA ILE B 106 -4.263 3.997 -2.179 1.00 0.00 C ATOM 3371 C ILE B 106 -4.604 5.479 -2.326 1.00 0.00 C ATOM 3372 O ILE B 106 -3.797 6.269 -2.805 1.00 0.00 O ATOM 3373 CB ILE B 106 -2.945 3.829 -1.376 1.00 0.00 C ATOM 3374 CG1 ILE B 106 -2.957 4.669 -0.092 1.00 0.00 C ATOM 3375 CG2 ILE B 106 -1.748 4.197 -2.234 1.00 0.00 C ATOM 3376 CD1 ILE B 106 -2.211 4.028 1.051 1.00 0.00 C ATOM 0 H ILE B 106 -3.259 3.454 -3.940 1.00 0.00 H new ATOM 0 HA ILE B 106 -5.065 3.506 -1.628 1.00 0.00 H new ATOM 0 HB ILE B 106 -2.865 2.780 -1.089 1.00 0.00 H new ATOM 0 HG12 ILE B 106 -2.518 5.644 -0.301 1.00 0.00 H new ATOM 0 HG13 ILE B 106 -3.990 4.842 0.210 1.00 0.00 H new ATOM 0 HG21 ILE B 106 -0.833 4.073 -1.655 1.00 0.00 H new ATOM 0 HG22 ILE B 106 -1.714 3.548 -3.109 1.00 0.00 H new ATOM 0 HG23 ILE B 106 -1.836 5.235 -2.556 1.00 0.00 H new ATOM 0 HD11 ILE B 106 -2.260 4.676 1.926 1.00 0.00 H new ATOM 0 HD12 ILE B 106 -2.664 3.065 1.286 1.00 0.00 H new ATOM 0 HD13 ILE B 106 -1.169 3.879 0.768 1.00 0.00 H new ATOM 3388 N CYS B 107 -5.798 5.849 -1.885 1.00 0.00 N ATOM 3389 CA CYS B 107 -6.238 7.241 -1.954 1.00 0.00 C ATOM 3390 C CYS B 107 -6.380 7.818 -0.552 1.00 0.00 C ATOM 3391 O CYS B 107 -7.139 7.302 0.269 1.00 0.00 O ATOM 3392 CB CYS B 107 -7.578 7.384 -2.702 1.00 0.00 C ATOM 3393 SG CYS B 107 -7.922 6.114 -3.950 1.00 0.00 S ATOM 0 H CYS B 107 -6.480 5.209 -1.476 1.00 0.00 H new ATOM 0 HA CYS B 107 -5.479 7.793 -2.508 1.00 0.00 H new ATOM 0 HB2 CYS B 107 -8.385 7.375 -1.969 1.00 0.00 H new ATOM 0 HB3 CYS B 107 -7.600 8.360 -3.188 1.00 0.00 H new ATOM 0 HG CYS B 107 -8.645 5.171 -3.422 1.00 0.00 H new ATOM 3399 N THR B 108 -5.639 8.886 -0.280 1.00 0.00 N ATOM 3400 CA THR B 108 -5.681 9.526 1.027 1.00 0.00 C ATOM 3401 C THR B 108 -6.319 10.909 0.956 1.00 0.00 C ATOM 3402 O THR B 108 -5.960 11.734 0.113 1.00 0.00 O ATOM 3403 CB THR B 108 -4.269 9.619 1.630 1.00 0.00 C ATOM 3404 OG1 THR B 108 -4.338 9.816 3.030 1.00 0.00 O ATOM 3405 CG2 THR B 108 -3.416 10.740 1.055 1.00 0.00 C ATOM 0 H THR B 108 -5.004 9.325 -0.946 1.00 0.00 H new ATOM 0 HA THR B 108 -6.301 8.907 1.675 1.00 0.00 H new ATOM 0 HB THR B 108 -3.797 8.670 1.375 1.00 0.00 H new ATOM 0 HG1 THR B 108 -3.431 9.871 3.398 1.00 0.00 H new ATOM 0 HG21 THR B 108 -2.437 10.735 1.534 1.00 0.00 H new ATOM 0 HG22 THR B 108 -3.295 10.592 -0.018 1.00 0.00 H new ATOM 0 HG23 THR B 108 -3.904 11.698 1.236 1.00 0.00 H new ATOM 3413 N VAL B 109 -7.242 11.161 1.875 1.00 0.00 N ATOM 3414 CA VAL B 109 -7.906 12.453 1.952 1.00 0.00 C ATOM 3415 C VAL B 109 -7.371 13.203 3.157 1.00 0.00 C ATOM 3416 O VAL B 109 -7.405 12.698 4.281 1.00 0.00 O ATOM 3417 CB VAL B 109 -9.455 12.358 2.065 1.00 0.00 C ATOM 3418 CG1 VAL B 109 -10.118 13.433 1.206 1.00 0.00 C ATOM 3419 CG2 VAL B 109 -9.969 10.975 1.687 1.00 0.00 C ATOM 0 H VAL B 109 -7.547 10.487 2.577 1.00 0.00 H new ATOM 0 HA VAL B 109 -7.692 12.974 1.019 1.00 0.00 H new ATOM 0 HB VAL B 109 -9.720 12.527 3.109 1.00 0.00 H new ATOM 0 HG11 VAL B 109 -11.201 13.353 1.296 1.00 0.00 H new ATOM 0 HG12 VAL B 109 -9.797 14.418 1.544 1.00 0.00 H new ATOM 0 HG13 VAL B 109 -9.829 13.296 0.164 1.00 0.00 H new ATOM 0 HG21 VAL B 109 -11.055 10.952 1.780 1.00 0.00 H new ATOM 0 HG22 VAL B 109 -9.688 10.751 0.658 1.00 0.00 H new ATOM 0 HG23 VAL B 109 -9.532 10.230 2.352 1.00 0.00 H new ATOM 3429 N PHE B 110 -6.866 14.400 2.925 1.00 0.00 N ATOM 3430 CA PHE B 110 -6.319 15.201 4.000 1.00 0.00 C ATOM 3431 C PHE B 110 -7.309 16.278 4.424 1.00 0.00 C ATOM 3432 O PHE B 110 -7.415 17.321 3.791 1.00 0.00 O ATOM 3433 CB PHE B 110 -5.003 15.835 3.548 1.00 0.00 C ATOM 3434 CG PHE B 110 -3.789 15.000 3.842 1.00 0.00 C ATOM 3435 CD1 PHE B 110 -3.694 13.701 3.370 1.00 0.00 C ATOM 3436 CD2 PHE B 110 -2.740 15.520 4.584 1.00 0.00 C ATOM 3437 CE1 PHE B 110 -2.574 12.934 3.635 1.00 0.00 C ATOM 3438 CE2 PHE B 110 -1.620 14.757 4.851 1.00 0.00 C ATOM 3439 CZ PHE B 110 -1.536 13.463 4.376 1.00 0.00 C ATOM 0 H PHE B 110 -6.824 14.837 2.004 1.00 0.00 H new ATOM 0 HA PHE B 110 -6.130 14.558 4.859 1.00 0.00 H new ATOM 0 HB2 PHE B 110 -5.051 16.022 2.475 1.00 0.00 H new ATOM 0 HB3 PHE B 110 -4.892 16.803 4.036 1.00 0.00 H new ATOM 0 HD1 PHE B 110 -4.503 13.283 2.789 1.00 0.00 H new ATOM 0 HD2 PHE B 110 -2.799 16.532 4.957 1.00 0.00 H new ATOM 0 HE1 PHE B 110 -2.511 11.922 3.263 1.00 0.00 H new ATOM 0 HE2 PHE B 110 -0.810 15.173 5.431 1.00 0.00 H new ATOM 0 HZ PHE B 110 -0.660 12.866 4.584 1.00 0.00 H new ATOM 3449 N GLY B 111 -8.023 16.015 5.508 1.00 0.00 N ATOM 3450 CA GLY B 111 -8.993 16.973 6.017 1.00 0.00 C ATOM 3451 C GLY B 111 -8.348 17.960 6.968 1.00 0.00 C ATOM 3452 O GLY B 111 -8.283 17.723 8.174 1.00 0.00 O ATOM 0 H GLY B 111 -7.950 15.153 6.049 1.00 0.00 H new ATOM 0 HA2 GLY B 111 -9.447 17.511 5.185 1.00 0.00 H new ATOM 0 HA3 GLY B 111 -9.796 16.443 6.530 1.00 0.00 H new ATOM 3456 N LEU B 112 -7.847 19.060 6.423 1.00 0.00 N ATOM 3457 CA LEU B 112 -7.173 20.068 7.228 1.00 0.00 C ATOM 3458 C LEU B 112 -8.155 21.134 7.712 1.00 0.00 C ATOM 3459 O LEU B 112 -8.958 21.653 6.939 1.00 0.00 O ATOM 3460 CB LEU B 112 -6.041 20.711 6.409 1.00 0.00 C ATOM 3461 CG LEU B 112 -4.827 19.809 6.070 1.00 0.00 C ATOM 3462 CD1 LEU B 112 -5.202 18.342 5.930 1.00 0.00 C ATOM 3463 CD2 LEU B 112 -4.172 20.275 4.787 1.00 0.00 C ATOM 0 H LEU B 112 -7.895 19.277 5.427 1.00 0.00 H new ATOM 0 HA LEU B 112 -6.750 19.584 8.108 1.00 0.00 H new ATOM 0 HB2 LEU B 112 -6.464 21.078 5.474 1.00 0.00 H new ATOM 0 HB3 LEU B 112 -5.677 21.580 6.956 1.00 0.00 H new ATOM 0 HG LEU B 112 -4.134 19.896 6.907 1.00 0.00 H new ATOM 0 HD11 LEU B 112 -4.312 17.760 5.692 1.00 0.00 H new ATOM 0 HD12 LEU B 112 -5.630 17.985 6.867 1.00 0.00 H new ATOM 0 HD13 LEU B 112 -5.934 18.228 5.130 1.00 0.00 H new ATOM 0 HD21 LEU B 112 -3.321 19.634 4.559 1.00 0.00 H new ATOM 0 HD22 LEU B 112 -4.893 20.224 3.971 1.00 0.00 H new ATOM 0 HD23 LEU B 112 -3.830 21.303 4.906 1.00 0.00 H new ATOM 3475 N ALA B 113 -8.085 21.452 9.000 1.00 0.00 N ATOM 3476 CA ALA B 113 -8.967 22.452 9.590 1.00 0.00 C ATOM 3477 C ALA B 113 -8.706 23.834 9.000 1.00 0.00 C ATOM 3478 O ALA B 113 -8.029 24.662 9.610 1.00 0.00 O ATOM 3479 CB ALA B 113 -8.794 22.481 11.101 1.00 0.00 C ATOM 0 H ALA B 113 -7.426 21.032 9.656 1.00 0.00 H new ATOM 0 HA ALA B 113 -9.995 22.175 9.357 1.00 0.00 H new ATOM 0 HB1 ALA B 113 -9.458 23.232 11.529 1.00 0.00 H new ATOM 0 HB2 ALA B 113 -9.039 21.502 11.514 1.00 0.00 H new ATOM 0 HB3 ALA B 113 -7.761 22.730 11.344 1.00 0.00 H new ATOM 3485 N ILE B 114 -9.249 24.076 7.811 1.00 0.00 N ATOM 3486 CA ILE B 114 -9.077 25.359 7.138 1.00 0.00 C ATOM 3487 C ILE B 114 -7.603 25.659 6.894 1.00 0.00 C ATOM 3488 O ILE B 114 -7.312 26.685 6.243 1.00 0.00 O ATOM 3489 CB ILE B 114 -9.695 26.510 7.954 1.00 0.00 C ATOM 3490 CG1 ILE B 114 -11.111 26.146 8.404 1.00 0.00 C ATOM 3491 CG2 ILE B 114 -9.707 27.793 7.136 1.00 0.00 C ATOM 3492 CD1 ILE B 114 -11.705 27.130 9.387 1.00 0.00 C ATOM 0 H ILE B 114 -9.812 23.401 7.294 1.00 0.00 H new ATOM 0 HA ILE B 114 -9.593 25.284 6.181 1.00 0.00 H new ATOM 0 HB ILE B 114 -9.084 26.673 8.842 1.00 0.00 H new ATOM 0 HG12 ILE B 114 -11.757 26.085 7.528 1.00 0.00 H new ATOM 0 HG13 ILE B 114 -11.096 25.155 8.859 1.00 0.00 H new ATOM 0 HG21 ILE B 114 -10.147 28.597 7.726 1.00 0.00 H new ATOM 0 HG22 ILE B 114 -8.686 28.060 6.863 1.00 0.00 H new ATOM 0 HG23 ILE B 114 -10.297 27.643 6.232 1.00 0.00 H new ATOM 0 HD11 ILE B 114 -12.710 26.808 9.662 1.00 0.00 H new ATOM 0 HD12 ILE B 114 -11.081 27.174 10.280 1.00 0.00 H new ATOM 0 HD13 ILE B 114 -11.753 28.118 8.929 1.00 0.00 H new TER 3504 ILE B 114