USER MOD reduce.3.24.130724 H: found=0, std=0, add=1494, rem=0, adj=52 USER MOD reduce.3.24.130724 removed 1496 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: A 76 CYS SG : rot 74:sc= 1.14 USER MOD Set 1.2: B 80 SER OG : rot 98:sc= 0.00964 USER MOD Set 1.3: B 84 MET CE :methyl -161:sc= -0.837 (180deg=-1.96!) USER MOD Set 2.1: A 80 SER OG : rot 100:sc= 0.00357 USER MOD Set 2.2: A 84 MET CE :methyl -157:sc= -0.817 (180deg=-2) USER MOD Set 2.3: B 76 CYS SG : rot 72:sc= 1.19 USER MOD Single : A 3 CYS SG : rot 173:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 MET CE :methyl 159:sc= -0.184 (180deg=-1.32!) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot -92:sc= 1.17 USER MOD Single : A 17 HIS : no HD1:sc= 0 X(o=0,f=-0.052) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 TYR OH : rot 150:sc= -0.851 USER MOD Single : A 20 SER OG : rot 12:sc= 1.1 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ -163:sc= -0.0245 (180deg=-0.274) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 ASN :FLIP amide:sc= -0.318 F(o=-1.4,f=-0.32) USER MOD Single : A 31 LYS NZ :NH3+ -120:sc= 0.131 (180deg=-1.84) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0651) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0.15! USER MOD Single : A 56 GLN : amide:sc= -0.0228 K(o=-0.023,f=-1.9!) USER MOD Single : A 57 LYS NZ :NH3+ -158:sc= 0 (180deg=-0.623) USER MOD Single : A 59 MET CE :methyl -165:sc=-0.00318 (180deg=-0.266) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 ASN : amide:sc= -0.157 X(o=-0.16,f=-0.46) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 65 ASN : amide:sc= -0.083 X(o=-0.083,f=-0.37) USER MOD Single : A 68 ASN : amide:sc= -0.523 K(o=-0.52,f=-6!) USER MOD Single : A 73 GLN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 CYS SG : rot 140:sc= -1.61! USER MOD Single : A 85 MET CE :methyl 137:sc= -0.278 (180deg=-1.53!) USER MOD Single : A 86 CYS SG : rot 180:sc= -0.0284 USER MOD Single : A 87 ASN :FLIP amide:sc= -1.48 F(o=-9.9!,f=-1.5) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 3 CYS SG : rot 174:sc= 0 USER MOD Single : B 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 12 MET CE :methyl 162:sc= -0.232 (180deg=-1.32) USER MOD Single : B 14 SER OG : rot 180:sc= 0 USER MOD Single : B 15 THR OG1 : rot -135:sc= 1.09 USER MOD Single : B 17 HIS : no HD1:sc= 0 X(o=0,f=-0.054) USER MOD Single : B 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 19 TYR OH : rot 150:sc= -0.875 USER MOD Single : B 20 SER OG : rot 3:sc= 1.16 USER MOD Single : B 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 26 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.0986) USER MOD Single : B 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 30 ASN :FLIP amide:sc= -0.32 F(o=-1.5,f=-0.32) USER MOD Single : B 31 LYS NZ :NH3+ -121:sc= 0.137 (180deg=-1.75) USER MOD Single : B 32 SER OG : rot 180:sc= 0 USER MOD Single : B 35 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.0941) USER MOD Single : B 39 THR OG1 : rot 180:sc= 0 USER MOD Single : B 44 SER OG : rot 180:sc= 0 USER MOD Single : B 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 50 THR OG1 : rot -139:sc= -0.252! USER MOD Single : B 56 GLN : amide:sc=-0.00931 K(o=-0.0093,f=-1.9!) USER MOD Single : B 57 LYS NZ :NH3+ -159:sc= 0 (180deg=-0.621) USER MOD Single : B 59 MET CE :methyl -163:sc= -0.0292 (180deg=-0.407) USER MOD Single : B 60 SER OG : rot 180:sc= 0 USER MOD Single : B 61 ASN : amide:sc= -0.199 X(o=-0.2,f=-0.48) USER MOD Single : B 64 SER OG : rot -23:sc= 0.157! USER MOD Single : B 65 ASN : amide:sc= -0.104 X(o=-0.1,f=-0.45) USER MOD Single : B 68 ASN : amide:sc= -0.678 K(o=-0.68,f=-5.8!) USER MOD Single : B 73 GLN : amide:sc= 0 X(o=0,f=-0.4) USER MOD Single : B 75 TYR OH : rot 180:sc= 0 USER MOD Single : B 81 CYS SG : rot 142:sc= -1.49 USER MOD Single : B 85 MET CE :methyl 151:sc= -0.31 (180deg=-1.5!) USER MOD Single : B 86 CYS SG : rot 180:sc= -0.0212 USER MOD Single : B 87 ASN :FLIP amide:sc= -1.63 F(o=-10!,f=-1.6) USER MOD Single : B 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 20 N ALA A 2 76.649 0.625 -20.677 1.00 0.00 N ATOM 21 CA ALA A 2 76.317 -0.093 -19.410 1.00 0.00 C ATOM 22 C ALA A 2 76.695 0.789 -18.219 1.00 0.00 C ATOM 23 O ALA A 2 77.470 1.717 -18.345 1.00 0.00 O ATOM 24 CB ALA A 2 77.101 -1.405 -19.343 1.00 0.00 C ATOM 0 HA ALA A 2 75.249 -0.310 -19.382 1.00 0.00 H new ATOM 0 HB1 ALA A 2 76.858 -1.928 -18.418 1.00 0.00 H new ATOM 0 HB2 ALA A 2 76.835 -2.032 -20.194 1.00 0.00 H new ATOM 0 HB3 ALA A 2 78.170 -1.192 -19.369 1.00 0.00 H new ATOM 30 N CYS A 3 76.156 0.513 -17.064 1.00 0.00 N ATOM 31 CA CYS A 3 76.489 1.341 -15.873 1.00 0.00 C ATOM 32 C CYS A 3 77.869 0.904 -15.326 1.00 0.00 C ATOM 33 O CYS A 3 78.065 -0.265 -15.058 1.00 0.00 O ATOM 34 CB CYS A 3 75.426 1.111 -14.797 1.00 0.00 C ATOM 35 SG CYS A 3 73.820 1.685 -15.406 1.00 0.00 S ATOM 0 H CYS A 3 75.500 -0.249 -16.894 1.00 0.00 H new ATOM 0 HA CYS A 3 76.518 2.396 -16.147 1.00 0.00 H new ATOM 0 HB2 CYS A 3 75.374 0.052 -14.542 1.00 0.00 H new ATOM 0 HB3 CYS A 3 75.694 1.645 -13.885 1.00 0.00 H new ATOM 0 HG CYS A 3 72.892 1.361 -14.555 1.00 0.00 H new ATOM 41 N PRO A 4 78.827 1.802 -15.147 1.00 0.00 N ATOM 42 CA PRO A 4 80.161 1.392 -14.614 1.00 0.00 C ATOM 43 C PRO A 4 80.095 1.051 -13.122 1.00 0.00 C ATOM 44 O PRO A 4 81.003 0.464 -12.567 1.00 0.00 O ATOM 45 CB PRO A 4 81.009 2.648 -14.864 1.00 0.00 C ATOM 46 CG PRO A 4 80.042 3.828 -15.021 1.00 0.00 C ATOM 47 CD PRO A 4 78.679 3.261 -15.450 1.00 0.00 C ATOM 0 HA PRO A 4 80.558 0.492 -15.084 1.00 0.00 H new ATOM 0 HB2 PRO A 4 81.694 2.821 -14.034 1.00 0.00 H new ATOM 0 HB3 PRO A 4 81.618 2.528 -15.760 1.00 0.00 H new ATOM 0 HG2 PRO A 4 79.951 4.375 -14.083 1.00 0.00 H new ATOM 0 HG3 PRO A 4 80.415 4.532 -15.765 1.00 0.00 H new ATOM 0 HD2 PRO A 4 77.858 3.711 -14.891 1.00 0.00 H new ATOM 0 HD3 PRO A 4 78.480 3.438 -16.507 1.00 0.00 H new ATOM 55 N LEU A 5 79.027 1.417 -12.472 1.00 0.00 N ATOM 56 CA LEU A 5 78.905 1.113 -11.023 1.00 0.00 C ATOM 57 C LEU A 5 78.976 -0.402 -10.856 1.00 0.00 C ATOM 58 O LEU A 5 79.585 -0.916 -9.939 1.00 0.00 O ATOM 59 CB LEU A 5 77.568 1.642 -10.492 1.00 0.00 C ATOM 60 CG LEU A 5 77.435 1.333 -8.993 1.00 0.00 C ATOM 61 CD1 LEU A 5 78.553 2.044 -8.205 1.00 0.00 C ATOM 62 CD2 LEU A 5 76.071 1.827 -8.506 1.00 0.00 C ATOM 0 H LEU A 5 78.235 1.913 -12.882 1.00 0.00 H new ATOM 0 HA LEU A 5 79.708 1.591 -10.462 1.00 0.00 H new ATOM 0 HB2 LEU A 5 77.503 2.718 -10.657 1.00 0.00 H new ATOM 0 HB3 LEU A 5 76.744 1.185 -11.040 1.00 0.00 H new ATOM 0 HG LEU A 5 77.522 0.258 -8.833 1.00 0.00 H new ATOM 0 HD11 LEU A 5 78.450 1.819 -7.144 1.00 0.00 H new ATOM 0 HD12 LEU A 5 79.524 1.696 -8.557 1.00 0.00 H new ATOM 0 HD13 LEU A 5 78.477 3.121 -8.356 1.00 0.00 H new ATOM 0 HD21 LEU A 5 75.965 1.613 -7.442 1.00 0.00 H new ATOM 0 HD22 LEU A 5 75.994 2.902 -8.669 1.00 0.00 H new ATOM 0 HD23 LEU A 5 75.281 1.318 -9.059 1.00 0.00 H new ATOM 74 N GLU A 6 78.350 -1.118 -11.747 1.00 0.00 N ATOM 75 CA GLU A 6 78.365 -2.602 -11.667 1.00 0.00 C ATOM 76 C GLU A 6 79.810 -3.105 -11.747 1.00 0.00 C ATOM 77 O GLU A 6 80.242 -3.916 -10.952 1.00 0.00 O ATOM 78 CB GLU A 6 77.589 -3.153 -12.865 1.00 0.00 C ATOM 79 CG GLU A 6 76.101 -2.843 -12.696 1.00 0.00 C ATOM 80 CD GLU A 6 75.325 -3.369 -13.907 1.00 0.00 C ATOM 81 OE1 GLU A 6 75.962 -3.808 -14.851 1.00 0.00 O ATOM 82 OE2 GLU A 6 74.107 -3.314 -13.874 1.00 0.00 O ATOM 0 H GLU A 6 77.825 -0.734 -12.533 1.00 0.00 H new ATOM 0 HA GLU A 6 77.916 -2.929 -10.729 1.00 0.00 H new ATOM 0 HB2 GLU A 6 77.961 -2.709 -13.788 1.00 0.00 H new ATOM 0 HB3 GLU A 6 77.740 -4.229 -12.946 1.00 0.00 H new ATOM 0 HG2 GLU A 6 75.725 -3.304 -11.783 1.00 0.00 H new ATOM 0 HG3 GLU A 6 75.952 -1.768 -12.595 1.00 0.00 H new ATOM 89 N LYS A 7 80.559 -2.623 -12.701 1.00 0.00 N ATOM 90 CA LYS A 7 81.975 -3.060 -12.839 1.00 0.00 C ATOM 91 C LYS A 7 82.791 -2.480 -11.693 1.00 0.00 C ATOM 92 O LYS A 7 83.584 -3.159 -11.077 1.00 0.00 O ATOM 93 CB LYS A 7 82.537 -2.557 -14.169 1.00 0.00 C ATOM 94 CG LYS A 7 83.992 -3.011 -14.321 1.00 0.00 C ATOM 95 CD LYS A 7 84.483 -2.687 -15.736 1.00 0.00 C ATOM 96 CE LYS A 7 84.448 -1.172 -15.965 1.00 0.00 C ATOM 97 NZ LYS A 7 85.350 -0.823 -17.095 1.00 0.00 N ATOM 0 H LYS A 7 80.248 -1.942 -13.394 1.00 0.00 H new ATOM 0 HA LYS A 7 82.027 -4.148 -12.813 1.00 0.00 H new ATOM 0 HB2 LYS A 7 81.938 -2.940 -14.996 1.00 0.00 H new ATOM 0 HB3 LYS A 7 82.479 -1.469 -14.211 1.00 0.00 H new ATOM 0 HG2 LYS A 7 84.619 -2.510 -13.583 1.00 0.00 H new ATOM 0 HG3 LYS A 7 84.072 -4.082 -14.133 1.00 0.00 H new ATOM 0 HD2 LYS A 7 85.498 -3.061 -15.873 1.00 0.00 H new ATOM 0 HD3 LYS A 7 83.856 -3.190 -16.472 1.00 0.00 H new ATOM 0 HE2 LYS A 7 83.430 -0.850 -16.185 1.00 0.00 H new ATOM 0 HE3 LYS A 7 84.760 -0.649 -15.061 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 85.328 0.205 -17.252 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 86.321 -1.118 -16.868 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 85.033 -1.312 -17.956 1.00 0.00 H new ATOM 111 N ALA A 8 82.591 -1.229 -11.385 1.00 0.00 N ATOM 112 CA ALA A 8 83.352 -0.637 -10.261 1.00 0.00 C ATOM 113 C ALA A 8 83.000 -1.437 -9.022 1.00 0.00 C ATOM 114 O ALA A 8 83.843 -1.788 -8.224 1.00 0.00 O ATOM 115 CB ALA A 8 82.977 0.826 -10.077 1.00 0.00 C ATOM 0 H ALA A 8 81.941 -0.601 -11.859 1.00 0.00 H new ATOM 0 HA ALA A 8 84.424 -0.674 -10.454 1.00 0.00 H new ATOM 0 HB1 ALA A 8 83.545 1.246 -9.247 1.00 0.00 H new ATOM 0 HB2 ALA A 8 83.206 1.378 -10.989 1.00 0.00 H new ATOM 0 HB3 ALA A 8 81.911 0.904 -9.863 1.00 0.00 H new ATOM 121 N LEU A 9 81.756 -1.795 -8.894 1.00 0.00 N ATOM 122 CA LEU A 9 81.366 -2.639 -7.745 1.00 0.00 C ATOM 123 C LEU A 9 82.180 -3.917 -7.879 1.00 0.00 C ATOM 124 O LEU A 9 82.695 -4.449 -6.918 1.00 0.00 O ATOM 125 CB LEU A 9 79.867 -2.955 -7.799 1.00 0.00 C ATOM 126 CG LEU A 9 79.472 -3.834 -6.603 1.00 0.00 C ATOM 127 CD1 LEU A 9 79.724 -3.084 -5.281 1.00 0.00 C ATOM 128 CD2 LEU A 9 77.986 -4.187 -6.719 1.00 0.00 C ATOM 0 H LEU A 9 81.001 -1.541 -9.531 1.00 0.00 H new ATOM 0 HA LEU A 9 81.555 -2.138 -6.796 1.00 0.00 H new ATOM 0 HB2 LEU A 9 79.291 -2.030 -7.787 1.00 0.00 H new ATOM 0 HB3 LEU A 9 79.628 -3.467 -8.731 1.00 0.00 H new ATOM 0 HG LEU A 9 80.074 -4.742 -6.607 1.00 0.00 H new ATOM 0 HD11 LEU A 9 79.439 -3.719 -4.442 1.00 0.00 H new ATOM 0 HD12 LEU A 9 80.781 -2.831 -5.202 1.00 0.00 H new ATOM 0 HD13 LEU A 9 79.130 -2.170 -5.262 1.00 0.00 H new ATOM 0 HD21 LEU A 9 77.693 -4.811 -5.875 1.00 0.00 H new ATOM 0 HD22 LEU A 9 77.393 -3.272 -6.716 1.00 0.00 H new ATOM 0 HD23 LEU A 9 77.812 -4.729 -7.649 1.00 0.00 H new ATOM 140 N ASP A 10 82.322 -4.392 -9.091 1.00 0.00 N ATOM 141 CA ASP A 10 83.134 -5.614 -9.314 1.00 0.00 C ATOM 142 C ASP A 10 84.600 -5.283 -9.037 1.00 0.00 C ATOM 143 O ASP A 10 85.338 -6.099 -8.540 1.00 0.00 O ATOM 144 CB ASP A 10 82.967 -6.101 -10.758 1.00 0.00 C ATOM 145 CG ASP A 10 83.525 -7.519 -10.888 1.00 0.00 C ATOM 146 OD1 ASP A 10 84.394 -7.868 -10.105 1.00 0.00 O ATOM 147 OD2 ASP A 10 83.075 -8.232 -11.769 1.00 0.00 O ATOM 0 H ASP A 10 81.910 -3.984 -9.930 1.00 0.00 H new ATOM 0 HA ASP A 10 82.801 -6.407 -8.644 1.00 0.00 H new ATOM 0 HB2 ASP A 10 81.914 -6.087 -11.038 1.00 0.00 H new ATOM 0 HB3 ASP A 10 83.488 -5.430 -11.441 1.00 0.00 H new ATOM 152 N VAL A 11 85.033 -4.088 -9.348 1.00 0.00 N ATOM 153 CA VAL A 11 86.458 -3.733 -9.078 1.00 0.00 C ATOM 154 C VAL A 11 86.721 -3.867 -7.575 1.00 0.00 C ATOM 155 O VAL A 11 87.740 -4.377 -7.156 1.00 0.00 O ATOM 156 CB VAL A 11 86.727 -2.288 -9.514 1.00 0.00 C ATOM 157 CG1 VAL A 11 88.105 -1.840 -9.022 1.00 0.00 C ATOM 158 CG2 VAL A 11 86.672 -2.191 -11.042 1.00 0.00 C ATOM 0 H VAL A 11 84.469 -3.351 -9.772 1.00 0.00 H new ATOM 0 HA VAL A 11 87.115 -4.401 -9.636 1.00 0.00 H new ATOM 0 HB VAL A 11 85.965 -1.640 -9.081 1.00 0.00 H new ATOM 0 HG11 VAL A 11 88.287 -0.812 -9.336 1.00 0.00 H new ATOM 0 HG12 VAL A 11 88.140 -1.898 -7.934 1.00 0.00 H new ATOM 0 HG13 VAL A 11 88.871 -2.490 -9.445 1.00 0.00 H new ATOM 0 HG21 VAL A 11 86.864 -1.163 -11.348 1.00 0.00 H new ATOM 0 HG22 VAL A 11 87.428 -2.846 -11.476 1.00 0.00 H new ATOM 0 HG23 VAL A 11 85.685 -2.496 -11.391 1.00 0.00 H new ATOM 168 N MET A 12 85.799 -3.424 -6.760 1.00 0.00 N ATOM 169 CA MET A 12 85.994 -3.541 -5.288 1.00 0.00 C ATOM 170 C MET A 12 86.144 -5.017 -4.933 1.00 0.00 C ATOM 171 O MET A 12 86.959 -5.404 -4.119 1.00 0.00 O ATOM 172 CB MET A 12 84.768 -2.976 -4.565 1.00 0.00 C ATOM 173 CG MET A 12 84.722 -1.451 -4.719 1.00 0.00 C ATOM 174 SD MET A 12 83.052 -0.846 -4.347 1.00 0.00 S ATOM 175 CE MET A 12 82.768 -1.807 -2.840 1.00 0.00 C ATOM 0 H MET A 12 84.924 -2.988 -7.050 1.00 0.00 H new ATOM 0 HA MET A 12 86.882 -2.986 -4.986 1.00 0.00 H new ATOM 0 HB2 MET A 12 83.859 -3.418 -4.974 1.00 0.00 H new ATOM 0 HB3 MET A 12 84.805 -3.242 -3.509 1.00 0.00 H new ATOM 0 HG2 MET A 12 85.445 -0.987 -4.048 1.00 0.00 H new ATOM 0 HG3 MET A 12 85.003 -1.170 -5.734 1.00 0.00 H new ATOM 0 HE1 MET A 12 81.984 -1.333 -2.249 1.00 0.00 H new ATOM 0 HE2 MET A 12 82.461 -2.818 -3.106 1.00 0.00 H new ATOM 0 HE3 MET A 12 83.688 -1.849 -2.256 1.00 0.00 H new ATOM 185 N VAL A 13 85.340 -5.838 -5.542 1.00 0.00 N ATOM 186 CA VAL A 13 85.388 -7.301 -5.272 1.00 0.00 C ATOM 187 C VAL A 13 86.534 -7.955 -6.050 1.00 0.00 C ATOM 188 O VAL A 13 87.197 -8.850 -5.563 1.00 0.00 O ATOM 189 CB VAL A 13 84.057 -7.914 -5.697 1.00 0.00 C ATOM 190 CG1 VAL A 13 84.047 -9.409 -5.373 1.00 0.00 C ATOM 191 CG2 VAL A 13 82.937 -7.210 -4.934 1.00 0.00 C ATOM 0 H VAL A 13 84.640 -5.554 -6.227 1.00 0.00 H new ATOM 0 HA VAL A 13 85.560 -7.470 -4.209 1.00 0.00 H new ATOM 0 HB VAL A 13 83.913 -7.790 -6.770 1.00 0.00 H new ATOM 0 HG11 VAL A 13 83.094 -9.841 -5.679 1.00 0.00 H new ATOM 0 HG12 VAL A 13 84.858 -9.903 -5.909 1.00 0.00 H new ATOM 0 HG13 VAL A 13 84.182 -9.550 -4.301 1.00 0.00 H new ATOM 0 HG21 VAL A 13 81.976 -7.635 -5.224 1.00 0.00 H new ATOM 0 HG22 VAL A 13 83.085 -7.346 -3.863 1.00 0.00 H new ATOM 0 HG23 VAL A 13 82.949 -6.146 -5.169 1.00 0.00 H new ATOM 201 N SER A 14 86.759 -7.534 -7.264 1.00 0.00 N ATOM 202 CA SER A 14 87.842 -8.154 -8.078 1.00 0.00 C ATOM 203 C SER A 14 89.183 -7.973 -7.371 1.00 0.00 C ATOM 204 O SER A 14 89.924 -8.918 -7.189 1.00 0.00 O ATOM 205 CB SER A 14 87.895 -7.483 -9.452 1.00 0.00 C ATOM 206 OG SER A 14 88.779 -8.211 -10.293 1.00 0.00 O ATOM 0 H SER A 14 86.240 -6.788 -7.727 1.00 0.00 H new ATOM 0 HA SER A 14 87.639 -9.218 -8.200 1.00 0.00 H new ATOM 0 HB2 SER A 14 86.899 -7.450 -9.893 1.00 0.00 H new ATOM 0 HB3 SER A 14 88.234 -6.452 -9.354 1.00 0.00 H new ATOM 0 HG SER A 14 88.815 -7.786 -11.175 1.00 0.00 H new ATOM 212 N THR A 15 89.502 -6.780 -6.958 1.00 0.00 N ATOM 213 CA THR A 15 90.797 -6.583 -6.250 1.00 0.00 C ATOM 214 C THR A 15 90.803 -7.449 -4.984 1.00 0.00 C ATOM 215 O THR A 15 91.785 -8.081 -4.650 1.00 0.00 O ATOM 216 CB THR A 15 90.963 -5.095 -5.902 1.00 0.00 C ATOM 217 OG1 THR A 15 92.342 -4.799 -5.744 1.00 0.00 O ATOM 218 CG2 THR A 15 90.208 -4.741 -4.613 1.00 0.00 C ATOM 0 H THR A 15 88.932 -5.943 -7.077 1.00 0.00 H new ATOM 0 HA THR A 15 91.631 -6.882 -6.885 1.00 0.00 H new ATOM 0 HB THR A 15 90.546 -4.501 -6.715 1.00 0.00 H new ATOM 0 HG1 THR A 15 92.593 -4.900 -4.802 1.00 0.00 H new ATOM 0 HG21 THR A 15 90.343 -3.682 -4.391 1.00 0.00 H new ATOM 0 HG22 THR A 15 89.147 -4.952 -4.743 1.00 0.00 H new ATOM 0 HG23 THR A 15 90.598 -5.337 -3.788 1.00 0.00 H new ATOM 226 N PHE A 16 89.696 -7.479 -4.295 1.00 0.00 N ATOM 227 CA PHE A 16 89.583 -8.295 -3.046 1.00 0.00 C ATOM 228 C PHE A 16 89.835 -9.764 -3.382 1.00 0.00 C ATOM 229 O PHE A 16 90.475 -10.487 -2.645 1.00 0.00 O ATOM 230 CB PHE A 16 88.165 -8.143 -2.485 1.00 0.00 C ATOM 231 CG PHE A 16 88.010 -8.946 -1.211 1.00 0.00 C ATOM 232 CD1 PHE A 16 87.762 -10.326 -1.262 1.00 0.00 C ATOM 233 CD2 PHE A 16 88.097 -8.297 0.025 1.00 0.00 C ATOM 234 CE1 PHE A 16 87.602 -11.050 -0.071 1.00 0.00 C ATOM 235 CE2 PHE A 16 87.939 -9.021 1.211 1.00 0.00 C ATOM 236 CZ PHE A 16 87.691 -10.398 1.164 1.00 0.00 C ATOM 0 H PHE A 16 88.851 -6.966 -4.546 1.00 0.00 H new ATOM 0 HA PHE A 16 90.314 -7.957 -2.311 1.00 0.00 H new ATOM 0 HB2 PHE A 16 87.957 -7.092 -2.287 1.00 0.00 H new ATOM 0 HB3 PHE A 16 87.437 -8.478 -3.224 1.00 0.00 H new ATOM 0 HD1 PHE A 16 87.694 -10.829 -2.215 1.00 0.00 H new ATOM 0 HD2 PHE A 16 88.287 -7.234 0.064 1.00 0.00 H new ATOM 0 HE1 PHE A 16 87.410 -12.112 -0.107 1.00 0.00 H new ATOM 0 HE2 PHE A 16 88.008 -8.517 2.164 1.00 0.00 H new ATOM 0 HZ PHE A 16 87.568 -10.957 2.080 1.00 0.00 H new ATOM 246 N HIS A 17 89.323 -10.204 -4.495 1.00 0.00 N ATOM 247 CA HIS A 17 89.504 -11.623 -4.909 1.00 0.00 C ATOM 248 C HIS A 17 90.971 -11.881 -5.242 1.00 0.00 C ATOM 249 O HIS A 17 91.455 -12.988 -5.110 1.00 0.00 O ATOM 250 CB HIS A 17 88.639 -11.906 -6.138 1.00 0.00 C ATOM 251 CG HIS A 17 88.526 -13.392 -6.351 1.00 0.00 C ATOM 252 ND1 HIS A 17 89.411 -14.098 -7.158 1.00 0.00 N ATOM 253 CD2 HIS A 17 87.633 -14.320 -5.874 1.00 0.00 C ATOM 254 CE1 HIS A 17 89.030 -15.390 -7.143 1.00 0.00 C ATOM 255 NE2 HIS A 17 87.955 -15.576 -6.375 1.00 0.00 N ATOM 0 H HIS A 17 88.780 -9.635 -5.144 1.00 0.00 H new ATOM 0 HA HIS A 17 89.203 -12.280 -4.093 1.00 0.00 H new ATOM 0 HB2 HIS A 17 87.648 -11.472 -6.004 1.00 0.00 H new ATOM 0 HB3 HIS A 17 89.077 -11.435 -7.018 1.00 0.00 H new ATOM 0 HD2 HIS A 17 86.807 -14.107 -5.211 1.00 0.00 H new ATOM 0 HE1 HIS A 17 89.532 -16.177 -7.685 1.00 0.00 H new ATOM 0 HE2 HIS A 17 87.471 -16.455 -6.194 1.00 0.00 H new ATOM 264 N LYS A 18 91.692 -10.879 -5.660 1.00 0.00 N ATOM 265 CA LYS A 18 93.125 -11.103 -5.979 1.00 0.00 C ATOM 266 C LYS A 18 93.790 -11.603 -4.701 1.00 0.00 C ATOM 267 O LYS A 18 94.596 -12.510 -4.717 1.00 0.00 O ATOM 268 CB LYS A 18 93.775 -9.793 -6.442 1.00 0.00 C ATOM 269 CG LYS A 18 95.238 -10.050 -6.826 1.00 0.00 C ATOM 270 CD LYS A 18 95.782 -8.853 -7.617 1.00 0.00 C ATOM 271 CE LYS A 18 95.875 -7.625 -6.708 1.00 0.00 C ATOM 272 NZ LYS A 18 96.705 -6.580 -7.371 1.00 0.00 N ATOM 0 H LYS A 18 91.354 -9.926 -5.793 1.00 0.00 H new ATOM 0 HA LYS A 18 93.238 -11.829 -6.784 1.00 0.00 H new ATOM 0 HB2 LYS A 18 93.231 -9.387 -7.295 1.00 0.00 H new ATOM 0 HB3 LYS A 18 93.723 -9.049 -5.647 1.00 0.00 H new ATOM 0 HG2 LYS A 18 95.837 -10.208 -5.929 1.00 0.00 H new ATOM 0 HG3 LYS A 18 95.313 -10.958 -7.424 1.00 0.00 H new ATOM 0 HD2 LYS A 18 96.765 -9.091 -8.023 1.00 0.00 H new ATOM 0 HD3 LYS A 18 95.131 -8.640 -8.465 1.00 0.00 H new ATOM 0 HE2 LYS A 18 94.878 -7.236 -6.501 1.00 0.00 H new ATOM 0 HE3 LYS A 18 96.315 -7.901 -5.750 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 96.769 -5.745 -6.755 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 97.659 -6.955 -7.547 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 96.267 -6.310 -8.275 1.00 0.00 H new ATOM 286 N TYR A 19 93.421 -11.040 -3.583 1.00 0.00 N ATOM 287 CA TYR A 19 93.992 -11.508 -2.289 1.00 0.00 C ATOM 288 C TYR A 19 93.434 -12.897 -1.999 1.00 0.00 C ATOM 289 O TYR A 19 94.102 -13.749 -1.453 1.00 0.00 O ATOM 290 CB TYR A 19 93.595 -10.534 -1.176 1.00 0.00 C ATOM 291 CG TYR A 19 94.328 -9.237 -1.401 1.00 0.00 C ATOM 292 CD1 TYR A 19 95.601 -9.043 -0.855 1.00 0.00 C ATOM 293 CD2 TYR A 19 93.741 -8.240 -2.180 1.00 0.00 C ATOM 294 CE1 TYR A 19 96.291 -7.850 -1.094 1.00 0.00 C ATOM 295 CE2 TYR A 19 94.423 -7.042 -2.417 1.00 0.00 C ATOM 296 CZ TYR A 19 95.702 -6.848 -1.876 1.00 0.00 C ATOM 297 OH TYR A 19 96.384 -5.673 -2.118 1.00 0.00 O ATOM 0 H TYR A 19 92.749 -10.276 -3.510 1.00 0.00 H new ATOM 0 HA TYR A 19 95.080 -11.550 -2.341 1.00 0.00 H new ATOM 0 HB2 TYR A 19 92.518 -10.368 -1.183 1.00 0.00 H new ATOM 0 HB3 TYR A 19 93.847 -10.949 -0.200 1.00 0.00 H new ATOM 0 HD1 TYR A 19 96.051 -9.815 -0.249 1.00 0.00 H new ATOM 0 HD2 TYR A 19 92.758 -8.393 -2.601 1.00 0.00 H new ATOM 0 HE1 TYR A 19 97.276 -7.702 -0.676 1.00 0.00 H new ATOM 0 HE2 TYR A 19 93.965 -6.268 -3.015 1.00 0.00 H new ATOM 0 HH TYR A 19 96.117 -5.313 -2.990 1.00 0.00 H new ATOM 307 N SER A 20 92.203 -13.131 -2.368 1.00 0.00 N ATOM 308 CA SER A 20 91.587 -14.463 -2.121 1.00 0.00 C ATOM 309 C SER A 20 91.770 -14.827 -0.653 1.00 0.00 C ATOM 310 O SER A 20 91.514 -15.940 -0.238 1.00 0.00 O ATOM 311 CB SER A 20 92.261 -15.516 -2.998 1.00 0.00 C ATOM 312 OG SER A 20 91.905 -15.291 -4.356 1.00 0.00 O ATOM 0 H SER A 20 91.597 -12.454 -2.831 1.00 0.00 H new ATOM 0 HA SER A 20 90.525 -14.427 -2.364 1.00 0.00 H new ATOM 0 HB2 SER A 20 93.343 -15.466 -2.880 1.00 0.00 H new ATOM 0 HB3 SER A 20 91.953 -16.515 -2.689 1.00 0.00 H new ATOM 0 HG SER A 20 91.470 -14.417 -4.440 1.00 0.00 H new ATOM 318 N GLY A 21 92.208 -13.891 0.138 1.00 0.00 N ATOM 319 CA GLY A 21 92.405 -14.177 1.589 1.00 0.00 C ATOM 320 C GLY A 21 93.639 -15.061 1.778 1.00 0.00 C ATOM 321 O GLY A 21 93.567 -16.142 2.321 1.00 0.00 O ATOM 0 H GLY A 21 92.439 -12.941 -0.154 1.00 0.00 H new ATOM 0 HA2 GLY A 21 92.526 -13.244 2.140 1.00 0.00 H new ATOM 0 HA3 GLY A 21 91.524 -14.675 1.994 1.00 0.00 H new ATOM 325 N LYS A 22 94.771 -14.610 1.334 1.00 0.00 N ATOM 326 CA LYS A 22 96.013 -15.421 1.487 1.00 0.00 C ATOM 327 C LYS A 22 96.266 -15.670 2.984 1.00 0.00 C ATOM 328 O LYS A 22 96.688 -16.735 3.386 1.00 0.00 O ATOM 329 CB LYS A 22 97.214 -14.660 0.862 1.00 0.00 C ATOM 330 CG LYS A 22 96.792 -13.236 0.468 1.00 0.00 C ATOM 331 CD LYS A 22 98.024 -12.410 0.093 1.00 0.00 C ATOM 332 CE LYS A 22 98.700 -13.002 -1.142 1.00 0.00 C ATOM 333 NZ LYS A 22 99.606 -11.982 -1.739 1.00 0.00 N ATOM 0 H LYS A 22 94.896 -13.711 0.869 1.00 0.00 H new ATOM 0 HA LYS A 22 95.898 -16.376 0.974 1.00 0.00 H new ATOM 0 HB2 LYS A 22 98.038 -14.619 1.574 1.00 0.00 H new ATOM 0 HB3 LYS A 22 97.577 -15.196 -0.015 1.00 0.00 H new ATOM 0 HG2 LYS A 22 96.099 -13.273 -0.373 1.00 0.00 H new ATOM 0 HG3 LYS A 22 96.264 -12.762 1.296 1.00 0.00 H new ATOM 0 HD2 LYS A 22 97.733 -11.378 -0.102 1.00 0.00 H new ATOM 0 HD3 LYS A 22 98.726 -12.391 0.927 1.00 0.00 H new ATOM 0 HE2 LYS A 22 99.265 -13.893 -0.870 1.00 0.00 H new ATOM 0 HE3 LYS A 22 97.949 -13.310 -1.870 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 100.069 -12.380 -2.581 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 99.054 -11.144 -2.011 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 100.329 -11.709 -1.042 1.00 0.00 H new ATOM 347 N GLU A 23 96.036 -14.679 3.797 1.00 0.00 N ATOM 348 CA GLU A 23 96.284 -14.829 5.266 1.00 0.00 C ATOM 349 C GLU A 23 95.034 -15.332 5.988 1.00 0.00 C ATOM 350 O GLU A 23 95.039 -15.500 7.191 1.00 0.00 O ATOM 351 CB GLU A 23 96.647 -13.464 5.834 1.00 0.00 C ATOM 352 CG GLU A 23 97.899 -12.968 5.133 1.00 0.00 C ATOM 353 CD GLU A 23 98.286 -11.596 5.686 1.00 0.00 C ATOM 354 OE1 GLU A 23 97.540 -11.076 6.499 1.00 0.00 O ATOM 355 OE2 GLU A 23 99.324 -11.090 5.290 1.00 0.00 O ATOM 0 H GLU A 23 95.685 -13.765 3.511 1.00 0.00 H new ATOM 0 HA GLU A 23 97.088 -15.550 5.412 1.00 0.00 H new ATOM 0 HB2 GLU A 23 95.827 -12.762 5.686 1.00 0.00 H new ATOM 0 HB3 GLU A 23 96.817 -13.534 6.908 1.00 0.00 H new ATOM 0 HG2 GLU A 23 98.715 -13.675 5.281 1.00 0.00 H new ATOM 0 HG3 GLU A 23 97.725 -12.903 4.059 1.00 0.00 H new ATOM 362 N GLY A 24 93.958 -15.561 5.290 1.00 0.00 N ATOM 363 CA GLY A 24 92.732 -16.033 5.997 1.00 0.00 C ATOM 364 C GLY A 24 91.711 -16.604 5.003 1.00 0.00 C ATOM 365 O GLY A 24 92.022 -16.883 3.868 1.00 0.00 O ATOM 0 H GLY A 24 93.872 -15.445 4.280 1.00 0.00 H new ATOM 0 HA2 GLY A 24 93.000 -16.796 6.728 1.00 0.00 H new ATOM 0 HA3 GLY A 24 92.285 -15.206 6.549 1.00 0.00 H new ATOM 369 N ASP A 25 90.487 -16.786 5.430 1.00 0.00 N ATOM 370 CA ASP A 25 89.448 -17.339 4.509 1.00 0.00 C ATOM 371 C ASP A 25 89.228 -16.385 3.342 1.00 0.00 C ATOM 372 O ASP A 25 89.271 -15.179 3.490 1.00 0.00 O ATOM 373 CB ASP A 25 88.133 -17.534 5.266 1.00 0.00 C ATOM 374 CG ASP A 25 88.283 -18.693 6.251 1.00 0.00 C ATOM 375 OD1 ASP A 25 89.177 -19.499 6.054 1.00 0.00 O ATOM 376 OD2 ASP A 25 87.498 -18.759 7.183 1.00 0.00 O ATOM 0 H ASP A 25 90.163 -16.576 6.374 1.00 0.00 H new ATOM 0 HA ASP A 25 89.790 -18.301 4.127 1.00 0.00 H new ATOM 0 HB2 ASP A 25 87.868 -16.621 5.799 1.00 0.00 H new ATOM 0 HB3 ASP A 25 87.324 -17.740 4.565 1.00 0.00 H new ATOM 381 N LYS A 26 88.994 -16.923 2.179 1.00 0.00 N ATOM 382 CA LYS A 26 88.772 -16.060 0.990 1.00 0.00 C ATOM 383 C LYS A 26 87.452 -15.319 1.141 1.00 0.00 C ATOM 384 O LYS A 26 87.148 -14.414 0.390 1.00 0.00 O ATOM 385 CB LYS A 26 88.757 -16.919 -0.279 1.00 0.00 C ATOM 386 CG LYS A 26 87.635 -17.960 -0.199 1.00 0.00 C ATOM 387 CD LYS A 26 87.667 -18.831 -1.458 1.00 0.00 C ATOM 388 CE LYS A 26 86.550 -19.878 -1.395 1.00 0.00 C ATOM 389 NZ LYS A 26 86.860 -20.868 -0.324 1.00 0.00 N ATOM 0 H LYS A 26 88.947 -17.926 2.001 1.00 0.00 H new ATOM 0 HA LYS A 26 89.581 -15.333 0.911 1.00 0.00 H new ATOM 0 HB2 LYS A 26 88.614 -16.285 -1.154 1.00 0.00 H new ATOM 0 HB3 LYS A 26 89.718 -17.418 -0.401 1.00 0.00 H new ATOM 0 HG2 LYS A 26 87.759 -18.579 0.689 1.00 0.00 H new ATOM 0 HG3 LYS A 26 86.668 -17.464 -0.109 1.00 0.00 H new ATOM 0 HD2 LYS A 26 87.545 -18.209 -2.345 1.00 0.00 H new ATOM 0 HD3 LYS A 26 88.635 -19.324 -1.545 1.00 0.00 H new ATOM 0 HE2 LYS A 26 85.594 -19.395 -1.193 1.00 0.00 H new ATOM 0 HE3 LYS A 26 86.455 -20.383 -2.356 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 86.280 -21.720 -0.461 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 87.867 -21.124 -0.368 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 86.649 -20.451 0.605 1.00 0.00 H new ATOM 403 N PHE A 27 86.668 -15.687 2.118 1.00 0.00 N ATOM 404 CA PHE A 27 85.362 -14.991 2.333 1.00 0.00 C ATOM 405 C PHE A 27 85.536 -13.969 3.457 1.00 0.00 C ATOM 406 O PHE A 27 84.617 -13.264 3.825 1.00 0.00 O ATOM 407 CB PHE A 27 84.297 -16.027 2.729 1.00 0.00 C ATOM 408 CG PHE A 27 82.919 -15.471 2.458 1.00 0.00 C ATOM 409 CD1 PHE A 27 82.239 -14.748 3.447 1.00 0.00 C ATOM 410 CD2 PHE A 27 82.325 -15.676 1.209 1.00 0.00 C ATOM 411 CE1 PHE A 27 80.966 -14.228 3.181 1.00 0.00 C ATOM 412 CE2 PHE A 27 81.053 -15.159 0.944 1.00 0.00 C ATOM 413 CZ PHE A 27 80.374 -14.434 1.929 1.00 0.00 C ATOM 0 H PHE A 27 86.873 -16.438 2.777 1.00 0.00 H new ATOM 0 HA PHE A 27 85.046 -14.485 1.421 1.00 0.00 H new ATOM 0 HB2 PHE A 27 84.445 -16.948 2.166 1.00 0.00 H new ATOM 0 HB3 PHE A 27 84.396 -16.280 3.785 1.00 0.00 H new ATOM 0 HD1 PHE A 27 82.696 -14.592 4.413 1.00 0.00 H new ATOM 0 HD2 PHE A 27 82.849 -16.234 0.448 1.00 0.00 H new ATOM 0 HE1 PHE A 27 80.441 -13.668 3.941 1.00 0.00 H new ATOM 0 HE2 PHE A 27 80.595 -15.319 -0.021 1.00 0.00 H new ATOM 0 HZ PHE A 27 79.393 -14.033 1.724 1.00 0.00 H new ATOM 423 N LYS A 28 86.721 -13.892 4.013 1.00 0.00 N ATOM 424 CA LYS A 28 86.982 -12.927 5.127 1.00 0.00 C ATOM 425 C LYS A 28 88.390 -12.353 4.981 1.00 0.00 C ATOM 426 O LYS A 28 89.233 -12.921 4.312 1.00 0.00 O ATOM 427 CB LYS A 28 86.880 -13.658 6.466 1.00 0.00 C ATOM 428 CG LYS A 28 85.480 -14.246 6.618 1.00 0.00 C ATOM 429 CD LYS A 28 85.377 -14.973 7.953 1.00 0.00 C ATOM 430 CE LYS A 28 83.974 -15.556 8.092 1.00 0.00 C ATOM 431 NZ LYS A 28 83.810 -16.143 9.450 1.00 0.00 N ATOM 0 H LYS A 28 87.523 -14.460 3.741 1.00 0.00 H new ATOM 0 HA LYS A 28 86.248 -12.122 5.088 1.00 0.00 H new ATOM 0 HB2 LYS A 28 87.627 -14.450 6.518 1.00 0.00 H new ATOM 0 HB3 LYS A 28 87.088 -12.970 7.285 1.00 0.00 H new ATOM 0 HG2 LYS A 28 84.733 -13.454 6.565 1.00 0.00 H new ATOM 0 HG3 LYS A 28 85.272 -14.935 5.799 1.00 0.00 H new ATOM 0 HD2 LYS A 28 86.122 -15.767 8.008 1.00 0.00 H new ATOM 0 HD3 LYS A 28 85.582 -14.285 8.773 1.00 0.00 H new ATOM 0 HE2 LYS A 28 83.228 -14.778 7.928 1.00 0.00 H new ATOM 0 HE3 LYS A 28 83.810 -16.320 7.332 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 82.853 -16.540 9.543 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 84.513 -16.897 9.590 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 83.949 -15.403 10.167 1.00 0.00 H new ATOM 445 N LEU A 29 88.656 -11.234 5.609 1.00 0.00 N ATOM 446 CA LEU A 29 90.017 -10.611 5.525 1.00 0.00 C ATOM 447 C LEU A 29 90.478 -10.259 6.934 1.00 0.00 C ATOM 448 O LEU A 29 89.688 -10.171 7.851 1.00 0.00 O ATOM 449 CB LEU A 29 89.962 -9.345 4.631 1.00 0.00 C ATOM 450 CG LEU A 29 91.189 -9.276 3.709 1.00 0.00 C ATOM 451 CD1 LEU A 29 90.998 -10.208 2.501 1.00 0.00 C ATOM 452 CD2 LEU A 29 91.384 -7.831 3.218 1.00 0.00 C ATOM 0 H LEU A 29 87.985 -10.721 6.181 1.00 0.00 H new ATOM 0 HA LEU A 29 90.725 -11.309 5.078 1.00 0.00 H new ATOM 0 HB2 LEU A 29 89.051 -9.356 4.032 1.00 0.00 H new ATOM 0 HB3 LEU A 29 89.921 -8.454 5.257 1.00 0.00 H new ATOM 0 HG LEU A 29 92.069 -9.595 4.267 1.00 0.00 H new ATOM 0 HD11 LEU A 29 91.874 -10.150 1.855 1.00 0.00 H new ATOM 0 HD12 LEU A 29 90.870 -11.233 2.849 1.00 0.00 H new ATOM 0 HD13 LEU A 29 90.114 -9.902 1.942 1.00 0.00 H new ATOM 0 HD21 LEU A 29 92.255 -7.783 2.564 1.00 0.00 H new ATOM 0 HD22 LEU A 29 90.499 -7.511 2.668 1.00 0.00 H new ATOM 0 HD23 LEU A 29 91.537 -7.173 4.074 1.00 0.00 H new ATOM 464 N ASN A 30 91.758 -10.073 7.110 1.00 0.00 N ATOM 465 CA ASN A 30 92.299 -9.725 8.453 1.00 0.00 C ATOM 466 C ASN A 30 92.593 -8.224 8.488 1.00 0.00 C ATOM 467 O ASN A 30 93.089 -7.656 7.534 1.00 0.00 O ATOM 468 CB ASN A 30 93.590 -10.511 8.696 1.00 0.00 C ATOM 469 CG ASN A 30 93.272 -12.007 8.728 1.00 0.00 C ATOM 470 OD1 ASN A 30 92.247 -12.428 9.416 1.00 0.00 O flip ATOM 471 ND2 ASN A 30 93.962 -12.801 8.118 1.00 0.00 N flip ATOM 0 H ASN A 30 92.458 -10.148 6.372 1.00 0.00 H new ATOM 0 HA ASN A 30 91.575 -9.977 9.228 1.00 0.00 H new ATOM 0 HB2 ASN A 30 94.313 -10.298 7.909 1.00 0.00 H new ATOM 0 HB3 ASN A 30 94.045 -10.204 9.638 1.00 0.00 H new ATOM 0 HD21 ASN A 30 94.764 -12.472 7.580 1.00 0.00 H new ATOM 0 HD22 ASN A 30 93.739 -13.796 8.144 1.00 0.00 H new ATOM 478 N LYS A 31 92.287 -7.577 9.574 1.00 0.00 N ATOM 479 CA LYS A 31 92.539 -6.114 9.671 1.00 0.00 C ATOM 480 C LYS A 31 94.008 -5.842 9.356 1.00 0.00 C ATOM 481 O LYS A 31 94.364 -4.788 8.899 1.00 0.00 O ATOM 482 CB LYS A 31 92.207 -5.629 11.083 1.00 0.00 C ATOM 483 CG LYS A 31 90.694 -5.709 11.300 1.00 0.00 C ATOM 484 CD LYS A 31 90.346 -5.227 12.710 1.00 0.00 C ATOM 485 CE LYS A 31 88.832 -5.313 12.917 1.00 0.00 C ATOM 486 NZ LYS A 31 88.152 -4.329 12.031 1.00 0.00 N ATOM 0 H LYS A 31 91.871 -8.000 10.404 1.00 0.00 H new ATOM 0 HA LYS A 31 91.910 -5.580 8.959 1.00 0.00 H new ATOM 0 HB2 LYS A 31 92.725 -6.241 11.822 1.00 0.00 H new ATOM 0 HB3 LYS A 31 92.552 -4.604 11.219 1.00 0.00 H new ATOM 0 HG2 LYS A 31 90.178 -5.098 10.559 1.00 0.00 H new ATOM 0 HG3 LYS A 31 90.351 -6.734 11.161 1.00 0.00 H new ATOM 0 HD2 LYS A 31 90.861 -5.837 13.452 1.00 0.00 H new ATOM 0 HD3 LYS A 31 90.686 -4.201 12.850 1.00 0.00 H new ATOM 0 HE2 LYS A 31 88.481 -6.321 12.696 1.00 0.00 H new ATOM 0 HE3 LYS A 31 88.585 -5.111 13.959 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 87.609 -3.658 12.610 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 88.864 -3.811 11.477 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 87.508 -4.830 11.386 1.00 0.00 H new ATOM 500 N SER A 32 94.863 -6.795 9.565 1.00 0.00 N ATOM 501 CA SER A 32 96.295 -6.572 9.233 1.00 0.00 C ATOM 502 C SER A 32 96.366 -6.269 7.750 1.00 0.00 C ATOM 503 O SER A 32 97.090 -5.397 7.312 1.00 0.00 O ATOM 504 CB SER A 32 97.121 -7.812 9.539 1.00 0.00 C ATOM 505 OG SER A 32 97.131 -8.039 10.944 1.00 0.00 O ATOM 0 H SER A 32 94.638 -7.713 9.948 1.00 0.00 H new ATOM 0 HA SER A 32 96.695 -5.751 9.828 1.00 0.00 H new ATOM 0 HB2 SER A 32 96.704 -8.677 9.023 1.00 0.00 H new ATOM 0 HB3 SER A 32 98.140 -7.683 9.173 1.00 0.00 H new ATOM 0 HG SER A 32 97.661 -8.839 11.142 1.00 0.00 H new ATOM 511 N GLU A 33 95.588 -6.967 6.973 1.00 0.00 N ATOM 512 CA GLU A 33 95.583 -6.692 5.522 1.00 0.00 C ATOM 513 C GLU A 33 95.135 -5.263 5.341 1.00 0.00 C ATOM 514 O GLU A 33 95.442 -4.643 4.361 1.00 0.00 O ATOM 515 CB GLU A 33 94.666 -7.667 4.779 1.00 0.00 C ATOM 516 CG GLU A 33 95.293 -9.067 4.812 1.00 0.00 C ATOM 517 CD GLU A 33 94.579 -9.980 3.817 1.00 0.00 C ATOM 518 OE1 GLU A 33 93.956 -9.458 2.905 1.00 0.00 O ATOM 519 OE2 GLU A 33 94.667 -11.186 3.980 1.00 0.00 O ATOM 0 H GLU A 33 94.961 -7.710 7.282 1.00 0.00 H new ATOM 0 HA GLU A 33 96.579 -6.831 5.101 1.00 0.00 H new ATOM 0 HB2 GLU A 33 93.680 -7.685 5.244 1.00 0.00 H new ATOM 0 HB3 GLU A 33 94.526 -7.341 3.748 1.00 0.00 H new ATOM 0 HG2 GLU A 33 96.353 -9.006 4.567 1.00 0.00 H new ATOM 0 HG3 GLU A 33 95.222 -9.483 5.817 1.00 0.00 H new ATOM 526 N LEU A 34 94.451 -4.698 6.296 1.00 0.00 N ATOM 527 CA LEU A 34 94.074 -3.269 6.117 1.00 0.00 C ATOM 528 C LEU A 34 95.382 -2.513 5.980 1.00 0.00 C ATOM 529 O LEU A 34 95.509 -1.604 5.192 1.00 0.00 O ATOM 530 CB LEU A 34 93.293 -2.716 7.332 1.00 0.00 C ATOM 531 CG LEU A 34 92.862 -1.247 7.089 1.00 0.00 C ATOM 532 CD1 LEU A 34 91.545 -1.208 6.305 1.00 0.00 C ATOM 533 CD2 LEU A 34 92.673 -0.522 8.438 1.00 0.00 C ATOM 0 H LEU A 34 94.146 -5.143 7.162 1.00 0.00 H new ATOM 0 HA LEU A 34 93.424 -3.158 5.249 1.00 0.00 H new ATOM 0 HB2 LEU A 34 92.413 -3.332 7.515 1.00 0.00 H new ATOM 0 HB3 LEU A 34 93.914 -2.774 8.226 1.00 0.00 H new ATOM 0 HG LEU A 34 93.641 -0.746 6.514 1.00 0.00 H new ATOM 0 HD11 LEU A 34 91.251 -0.172 6.139 1.00 0.00 H new ATOM 0 HD12 LEU A 34 91.679 -1.705 5.344 1.00 0.00 H new ATOM 0 HD13 LEU A 34 90.768 -1.719 6.873 1.00 0.00 H new ATOM 0 HD21 LEU A 34 92.370 0.509 8.257 1.00 0.00 H new ATOM 0 HD22 LEU A 34 91.903 -1.030 9.019 1.00 0.00 H new ATOM 0 HD23 LEU A 34 93.612 -0.533 8.992 1.00 0.00 H new ATOM 545 N LYS A 35 96.366 -2.887 6.742 1.00 0.00 N ATOM 546 CA LYS A 35 97.658 -2.182 6.632 1.00 0.00 C ATOM 547 C LYS A 35 98.311 -2.517 5.289 1.00 0.00 C ATOM 548 O LYS A 35 98.689 -1.642 4.539 1.00 0.00 O ATOM 549 CB LYS A 35 98.567 -2.627 7.780 1.00 0.00 C ATOM 550 CG LYS A 35 99.889 -1.862 7.735 1.00 0.00 C ATOM 551 CD LYS A 35 100.779 -2.343 8.881 1.00 0.00 C ATOM 552 CE LYS A 35 102.106 -1.585 8.852 1.00 0.00 C ATOM 553 NZ LYS A 35 101.900 -0.206 9.378 1.00 0.00 N ATOM 0 H LYS A 35 96.329 -3.642 7.427 1.00 0.00 H new ATOM 0 HA LYS A 35 97.500 -1.105 6.690 1.00 0.00 H new ATOM 0 HB2 LYS A 35 98.070 -2.453 8.735 1.00 0.00 H new ATOM 0 HB3 LYS A 35 98.756 -3.698 7.709 1.00 0.00 H new ATOM 0 HG2 LYS A 35 100.386 -2.024 6.778 1.00 0.00 H new ATOM 0 HG3 LYS A 35 99.708 -0.791 7.823 1.00 0.00 H new ATOM 0 HD2 LYS A 35 100.278 -2.183 9.836 1.00 0.00 H new ATOM 0 HD3 LYS A 35 100.958 -3.414 8.791 1.00 0.00 H new ATOM 0 HE2 LYS A 35 102.849 -2.108 9.453 1.00 0.00 H new ATOM 0 HE3 LYS A 35 102.492 -1.544 7.833 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 102.821 0.265 9.486 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 101.310 0.335 8.713 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 101.425 -0.254 10.302 1.00 0.00 H new ATOM 567 N GLU A 36 98.454 -3.778 4.989 1.00 0.00 N ATOM 568 CA GLU A 36 99.091 -4.180 3.700 1.00 0.00 C ATOM 569 C GLU A 36 98.194 -3.855 2.505 1.00 0.00 C ATOM 570 O GLU A 36 98.660 -3.426 1.469 1.00 0.00 O ATOM 571 CB GLU A 36 99.375 -5.685 3.733 1.00 0.00 C ATOM 572 CG GLU A 36 99.991 -6.125 2.406 1.00 0.00 C ATOM 573 CD GLU A 36 100.499 -7.561 2.525 1.00 0.00 C ATOM 574 OE1 GLU A 36 100.367 -8.129 3.597 1.00 0.00 O ATOM 575 OE2 GLU A 36 101.013 -8.070 1.543 1.00 0.00 O ATOM 0 H GLU A 36 98.156 -4.552 5.583 1.00 0.00 H new ATOM 0 HA GLU A 36 100.018 -3.619 3.584 1.00 0.00 H new ATOM 0 HB2 GLU A 36 100.053 -5.918 4.554 1.00 0.00 H new ATOM 0 HB3 GLU A 36 98.452 -6.235 3.916 1.00 0.00 H new ATOM 0 HG2 GLU A 36 99.250 -6.056 1.609 1.00 0.00 H new ATOM 0 HG3 GLU A 36 100.811 -5.460 2.137 1.00 0.00 H new ATOM 582 N LEU A 37 96.918 -4.066 2.629 1.00 0.00 N ATOM 583 CA LEU A 37 96.003 -3.781 1.495 1.00 0.00 C ATOM 584 C LEU A 37 96.052 -2.298 1.183 1.00 0.00 C ATOM 585 O LEU A 37 95.950 -1.890 0.043 1.00 0.00 O ATOM 586 CB LEU A 37 94.566 -4.175 1.877 1.00 0.00 C ATOM 587 CG LEU A 37 93.591 -3.913 0.715 1.00 0.00 C ATOM 588 CD1 LEU A 37 93.900 -4.848 -0.461 1.00 0.00 C ATOM 589 CD2 LEU A 37 92.164 -4.173 1.202 1.00 0.00 C ATOM 0 H LEU A 37 96.467 -4.425 3.470 1.00 0.00 H new ATOM 0 HA LEU A 37 96.312 -4.355 0.622 1.00 0.00 H new ATOM 0 HB2 LEU A 37 94.535 -5.230 2.150 1.00 0.00 H new ATOM 0 HB3 LEU A 37 94.252 -3.609 2.754 1.00 0.00 H new ATOM 0 HG LEU A 37 93.697 -2.881 0.382 1.00 0.00 H new ATOM 0 HD11 LEU A 37 93.203 -4.651 -1.275 1.00 0.00 H new ATOM 0 HD12 LEU A 37 94.919 -4.674 -0.806 1.00 0.00 H new ATOM 0 HD13 LEU A 37 93.798 -5.884 -0.138 1.00 0.00 H new ATOM 0 HD21 LEU A 37 91.463 -3.991 0.388 1.00 0.00 H new ATOM 0 HD22 LEU A 37 92.075 -5.208 1.533 1.00 0.00 H new ATOM 0 HD23 LEU A 37 91.936 -3.506 2.033 1.00 0.00 H new ATOM 601 N LEU A 38 96.157 -1.481 2.188 1.00 0.00 N ATOM 602 CA LEU A 38 96.149 -0.009 1.920 1.00 0.00 C ATOM 603 C LEU A 38 97.369 0.424 1.099 1.00 0.00 C ATOM 604 O LEU A 38 97.235 1.150 0.135 1.00 0.00 O ATOM 605 CB LEU A 38 96.090 0.752 3.257 1.00 0.00 C ATOM 606 CG LEU A 38 94.628 1.089 3.644 1.00 0.00 C ATOM 607 CD1 LEU A 38 94.172 2.357 2.892 1.00 0.00 C ATOM 608 CD2 LEU A 38 93.667 -0.087 3.324 1.00 0.00 C ATOM 0 H LEU A 38 96.247 -1.754 3.167 1.00 0.00 H new ATOM 0 HA LEU A 38 95.266 0.231 1.327 1.00 0.00 H new ATOM 0 HB2 LEU A 38 96.547 0.150 4.042 1.00 0.00 H new ATOM 0 HB3 LEU A 38 96.670 1.671 3.181 1.00 0.00 H new ATOM 0 HG LEU A 38 94.595 1.264 4.719 1.00 0.00 H new ATOM 0 HD11 LEU A 38 93.143 2.592 3.166 1.00 0.00 H new ATOM 0 HD12 LEU A 38 94.819 3.192 3.161 1.00 0.00 H new ATOM 0 HD13 LEU A 38 94.231 2.184 1.817 1.00 0.00 H new ATOM 0 HD21 LEU A 38 92.651 0.186 3.609 1.00 0.00 H new ATOM 0 HD22 LEU A 38 93.699 -0.303 2.256 1.00 0.00 H new ATOM 0 HD23 LEU A 38 93.975 -0.971 3.882 1.00 0.00 H new ATOM 620 N THR A 39 98.546 0.016 1.457 1.00 0.00 N ATOM 621 CA THR A 39 99.729 0.459 0.659 1.00 0.00 C ATOM 622 C THR A 39 99.728 -0.262 -0.688 1.00 0.00 C ATOM 623 O THR A 39 100.199 0.253 -1.683 1.00 0.00 O ATOM 624 CB THR A 39 101.039 0.139 1.408 1.00 0.00 C ATOM 625 OG1 THR A 39 101.585 -1.079 0.912 1.00 0.00 O ATOM 626 CG2 THR A 39 100.761 -0.009 2.903 1.00 0.00 C ATOM 0 H THR A 39 98.747 -0.593 2.250 1.00 0.00 H new ATOM 0 HA THR A 39 99.666 1.536 0.507 1.00 0.00 H new ATOM 0 HB THR A 39 101.747 0.953 1.250 1.00 0.00 H new ATOM 0 HG1 THR A 39 102.418 -1.281 1.387 1.00 0.00 H new ATOM 0 HG21 THR A 39 101.691 -0.235 3.425 1.00 0.00 H new ATOM 0 HG22 THR A 39 100.344 0.921 3.289 1.00 0.00 H new ATOM 0 HG23 THR A 39 100.049 -0.819 3.062 1.00 0.00 H new ATOM 634 N ARG A 40 99.212 -1.457 -0.721 1.00 0.00 N ATOM 635 CA ARG A 40 99.194 -2.224 -1.992 1.00 0.00 C ATOM 636 C ARG A 40 98.208 -1.597 -2.967 1.00 0.00 C ATOM 637 O ARG A 40 98.457 -1.531 -4.156 1.00 0.00 O ATOM 638 CB ARG A 40 98.770 -3.670 -1.727 1.00 0.00 C ATOM 639 CG ARG A 40 99.869 -4.424 -0.964 1.00 0.00 C ATOM 640 CD ARG A 40 100.981 -4.884 -1.917 1.00 0.00 C ATOM 641 NE ARG A 40 101.806 -5.936 -1.235 1.00 0.00 N ATOM 642 CZ ARG A 40 102.390 -5.713 -0.086 1.00 0.00 C ATOM 643 NH1 ARG A 40 102.447 -4.508 0.409 1.00 0.00 N ATOM 644 NH2 ARG A 40 102.963 -6.700 0.550 1.00 0.00 N ATOM 0 H ARG A 40 98.801 -1.936 0.081 1.00 0.00 H new ATOM 0 HA ARG A 40 100.197 -2.206 -2.419 1.00 0.00 H new ATOM 0 HB2 ARG A 40 97.845 -3.684 -1.151 1.00 0.00 H new ATOM 0 HB3 ARG A 40 98.565 -4.173 -2.672 1.00 0.00 H new ATOM 0 HG2 ARG A 40 100.290 -3.779 -0.193 1.00 0.00 H new ATOM 0 HG3 ARG A 40 99.438 -5.288 -0.457 1.00 0.00 H new ATOM 0 HD2 ARG A 40 100.549 -5.281 -2.835 1.00 0.00 H new ATOM 0 HD3 ARG A 40 101.608 -4.038 -2.200 1.00 0.00 H new ATOM 0 HE ARG A 40 101.914 -6.848 -1.679 1.00 0.00 H new ATOM 0 HH11 ARG A 40 102.034 -3.727 -0.101 1.00 0.00 H new ATOM 0 HH12 ARG A 40 102.905 -4.346 1.306 1.00 0.00 H new ATOM 0 HH21 ARG A 40 102.953 -7.638 0.150 1.00 0.00 H new ATOM 0 HH22 ARG A 40 103.420 -6.532 1.446 1.00 0.00 H new ATOM 658 N GLU A 41 97.073 -1.158 -2.481 1.00 0.00 N ATOM 659 CA GLU A 41 96.053 -0.559 -3.394 1.00 0.00 C ATOM 660 C GLU A 41 96.076 0.951 -3.303 1.00 0.00 C ATOM 661 O GLU A 41 95.630 1.625 -4.211 1.00 0.00 O ATOM 662 CB GLU A 41 94.669 -1.081 -3.007 1.00 0.00 C ATOM 663 CG GLU A 41 94.569 -2.562 -3.372 1.00 0.00 C ATOM 664 CD GLU A 41 93.195 -3.095 -2.967 1.00 0.00 C ATOM 665 OE1 GLU A 41 92.491 -2.387 -2.267 1.00 0.00 O ATOM 666 OE2 GLU A 41 92.875 -4.206 -3.351 1.00 0.00 O ATOM 0 H GLU A 41 96.810 -1.189 -1.496 1.00 0.00 H new ATOM 0 HA GLU A 41 96.283 -0.843 -4.421 1.00 0.00 H new ATOM 0 HB2 GLU A 41 94.502 -0.946 -1.938 1.00 0.00 H new ATOM 0 HB3 GLU A 41 93.896 -0.514 -3.525 1.00 0.00 H new ATOM 0 HG2 GLU A 41 94.721 -2.695 -4.443 1.00 0.00 H new ATOM 0 HG3 GLU A 41 95.353 -3.126 -2.867 1.00 0.00 H new ATOM 673 N LEU A 42 96.602 1.502 -2.240 1.00 0.00 N ATOM 674 CA LEU A 42 96.645 2.994 -2.142 1.00 0.00 C ATOM 675 C LEU A 42 97.968 3.442 -1.509 1.00 0.00 C ATOM 676 O LEU A 42 98.003 3.821 -0.355 1.00 0.00 O ATOM 677 CB LEU A 42 95.482 3.515 -1.278 1.00 0.00 C ATOM 678 CG LEU A 42 94.133 2.905 -1.734 1.00 0.00 C ATOM 679 CD1 LEU A 42 93.841 1.610 -0.959 1.00 0.00 C ATOM 680 CD2 LEU A 42 92.993 3.904 -1.475 1.00 0.00 C ATOM 0 H LEU A 42 96.997 0.996 -1.448 1.00 0.00 H new ATOM 0 HA LEU A 42 96.558 3.401 -3.149 1.00 0.00 H new ATOM 0 HB2 LEU A 42 95.662 3.267 -0.232 1.00 0.00 H new ATOM 0 HB3 LEU A 42 95.434 4.602 -1.344 1.00 0.00 H new ATOM 0 HG LEU A 42 94.200 2.684 -2.799 1.00 0.00 H new ATOM 0 HD11 LEU A 42 92.890 1.194 -1.291 1.00 0.00 H new ATOM 0 HD12 LEU A 42 94.637 0.888 -1.143 1.00 0.00 H new ATOM 0 HD13 LEU A 42 93.789 1.828 0.108 1.00 0.00 H new ATOM 0 HD21 LEU A 42 92.047 3.469 -1.798 1.00 0.00 H new ATOM 0 HD22 LEU A 42 92.943 4.131 -0.410 1.00 0.00 H new ATOM 0 HD23 LEU A 42 93.179 4.822 -2.033 1.00 0.00 H new ATOM 692 N PRO A 43 99.052 3.408 -2.246 1.00 0.00 N ATOM 693 CA PRO A 43 100.365 3.833 -1.689 1.00 0.00 C ATOM 694 C PRO A 43 100.506 5.368 -1.599 1.00 0.00 C ATOM 695 O PRO A 43 100.242 5.964 -0.572 1.00 0.00 O ATOM 696 CB PRO A 43 101.350 3.225 -2.705 1.00 0.00 C ATOM 697 CG PRO A 43 100.563 2.865 -3.983 1.00 0.00 C ATOM 698 CD PRO A 43 99.056 2.941 -3.663 1.00 0.00 C ATOM 0 HA PRO A 43 100.524 3.503 -0.662 1.00 0.00 H new ATOM 0 HB2 PRO A 43 102.145 3.934 -2.935 1.00 0.00 H new ATOM 0 HB3 PRO A 43 101.826 2.337 -2.289 1.00 0.00 H new ATOM 0 HG2 PRO A 43 100.815 3.553 -4.790 1.00 0.00 H new ATOM 0 HG3 PRO A 43 100.829 1.864 -4.323 1.00 0.00 H new ATOM 0 HD2 PRO A 43 98.536 3.637 -4.321 1.00 0.00 H new ATOM 0 HD3 PRO A 43 98.568 1.973 -3.773 1.00 0.00 H new ATOM 706 N SER A 44 100.935 6.004 -2.659 1.00 0.00 N ATOM 707 CA SER A 44 101.113 7.488 -2.633 1.00 0.00 C ATOM 708 C SER A 44 99.757 8.204 -2.696 1.00 0.00 C ATOM 709 O SER A 44 99.657 9.375 -2.404 1.00 0.00 O ATOM 710 CB SER A 44 101.960 7.916 -3.832 1.00 0.00 C ATOM 711 OG SER A 44 103.245 7.314 -3.740 1.00 0.00 O ATOM 0 H SER A 44 101.171 5.558 -3.545 1.00 0.00 H new ATOM 0 HA SER A 44 101.609 7.760 -1.701 1.00 0.00 H new ATOM 0 HB2 SER A 44 101.472 7.619 -4.761 1.00 0.00 H new ATOM 0 HB3 SER A 44 102.055 9.002 -3.855 1.00 0.00 H new ATOM 0 HG SER A 44 103.789 7.586 -4.508 1.00 0.00 H new ATOM 717 N PHE A 45 98.720 7.521 -3.093 1.00 0.00 N ATOM 718 CA PHE A 45 97.378 8.180 -3.188 1.00 0.00 C ATOM 719 C PHE A 45 96.725 8.252 -1.805 1.00 0.00 C ATOM 720 O PHE A 45 95.714 8.900 -1.614 1.00 0.00 O ATOM 721 CB PHE A 45 96.479 7.347 -4.091 1.00 0.00 C ATOM 722 CG PHE A 45 96.949 7.443 -5.523 1.00 0.00 C ATOM 723 CD1 PHE A 45 96.492 8.484 -6.338 1.00 0.00 C ATOM 724 CD2 PHE A 45 97.833 6.487 -6.039 1.00 0.00 C ATOM 725 CE1 PHE A 45 96.917 8.570 -7.669 1.00 0.00 C ATOM 726 CE2 PHE A 45 98.259 6.573 -7.369 1.00 0.00 C ATOM 727 CZ PHE A 45 97.801 7.616 -8.184 1.00 0.00 C ATOM 0 H PHE A 45 98.739 6.536 -3.357 1.00 0.00 H new ATOM 0 HA PHE A 45 97.508 9.186 -3.588 1.00 0.00 H new ATOM 0 HB2 PHE A 45 96.488 6.307 -3.766 1.00 0.00 H new ATOM 0 HB3 PHE A 45 95.449 7.696 -4.014 1.00 0.00 H new ATOM 0 HD1 PHE A 45 95.811 9.222 -5.940 1.00 0.00 H new ATOM 0 HD2 PHE A 45 98.186 5.683 -5.410 1.00 0.00 H new ATOM 0 HE1 PHE A 45 96.562 9.373 -8.298 1.00 0.00 H new ATOM 0 HE2 PHE A 45 98.940 5.836 -7.767 1.00 0.00 H new ATOM 0 HZ PHE A 45 98.130 7.684 -9.210 1.00 0.00 H new ATOM 737 N LEU A 46 97.290 7.579 -0.850 1.00 0.00 N ATOM 738 CA LEU A 46 96.716 7.574 0.538 1.00 0.00 C ATOM 739 C LEU A 46 97.876 7.614 1.520 1.00 0.00 C ATOM 740 O LEU A 46 97.878 8.360 2.479 1.00 0.00 O ATOM 741 CB LEU A 46 95.887 6.294 0.735 1.00 0.00 C ATOM 742 CG LEU A 46 95.383 6.166 2.199 1.00 0.00 C ATOM 743 CD1 LEU A 46 93.946 5.620 2.214 1.00 0.00 C ATOM 744 CD2 LEU A 46 96.282 5.195 2.988 1.00 0.00 C ATOM 0 H LEU A 46 98.137 7.022 -0.963 1.00 0.00 H new ATOM 0 HA LEU A 46 96.066 8.434 0.699 1.00 0.00 H new ATOM 0 HB2 LEU A 46 95.035 6.302 0.055 1.00 0.00 H new ATOM 0 HB3 LEU A 46 96.492 5.424 0.479 1.00 0.00 H new ATOM 0 HG LEU A 46 95.412 7.154 2.659 1.00 0.00 H new ATOM 0 HD11 LEU A 46 93.600 5.533 3.244 1.00 0.00 H new ATOM 0 HD12 LEU A 46 93.293 6.300 1.668 1.00 0.00 H new ATOM 0 HD13 LEU A 46 93.925 4.638 1.740 1.00 0.00 H new ATOM 0 HD21 LEU A 46 95.919 5.114 4.012 1.00 0.00 H new ATOM 0 HD22 LEU A 46 96.259 4.213 2.516 1.00 0.00 H new ATOM 0 HD23 LEU A 46 97.305 5.571 2.995 1.00 0.00 H new ATOM 756 N GLY A 47 98.895 6.855 1.241 1.00 0.00 N ATOM 757 CA GLY A 47 100.107 6.876 2.098 1.00 0.00 C ATOM 758 C GLY A 47 100.962 8.011 1.564 1.00 0.00 C ATOM 759 O GLY A 47 102.173 8.012 1.658 1.00 0.00 O ATOM 0 H GLY A 47 98.940 6.215 0.448 1.00 0.00 H new ATOM 0 HA2 GLY A 47 99.846 7.040 3.143 1.00 0.00 H new ATOM 0 HA3 GLY A 47 100.640 5.926 2.048 1.00 0.00 H new ATOM 763 N LYS A 48 100.309 8.964 0.957 1.00 0.00 N ATOM 764 CA LYS A 48 101.013 10.115 0.345 1.00 0.00 C ATOM 765 C LYS A 48 101.932 10.795 1.375 1.00 0.00 C ATOM 766 O LYS A 48 102.579 11.777 1.076 1.00 0.00 O ATOM 767 CB LYS A 48 99.963 11.118 -0.166 1.00 0.00 C ATOM 768 CG LYS A 48 100.549 11.973 -1.300 1.00 0.00 C ATOM 769 CD LYS A 48 99.423 12.743 -1.997 1.00 0.00 C ATOM 770 CE LYS A 48 98.869 13.823 -1.064 1.00 0.00 C ATOM 771 NZ LYS A 48 98.112 14.825 -1.865 1.00 0.00 N ATOM 0 H LYS A 48 99.294 8.989 0.860 1.00 0.00 H new ATOM 0 HA LYS A 48 101.631 9.766 -0.483 1.00 0.00 H new ATOM 0 HB2 LYS A 48 99.083 10.583 -0.522 1.00 0.00 H new ATOM 0 HB3 LYS A 48 99.636 11.761 0.651 1.00 0.00 H new ATOM 0 HG2 LYS A 48 101.286 12.669 -0.900 1.00 0.00 H new ATOM 0 HG3 LYS A 48 101.067 11.337 -2.018 1.00 0.00 H new ATOM 0 HD2 LYS A 48 99.797 13.200 -2.913 1.00 0.00 H new ATOM 0 HD3 LYS A 48 98.627 12.057 -2.285 1.00 0.00 H new ATOM 0 HE2 LYS A 48 98.218 13.373 -0.314 1.00 0.00 H new ATOM 0 HE3 LYS A 48 99.684 14.310 -0.528 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 97.734 15.560 -1.234 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 98.746 15.261 -2.564 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 97.326 14.354 -2.357 1.00 0.00 H new ATOM 785 N ARG A 49 101.979 10.285 2.580 1.00 0.00 N ATOM 786 CA ARG A 49 102.840 10.893 3.642 1.00 0.00 C ATOM 787 C ARG A 49 102.249 12.242 4.063 1.00 0.00 C ATOM 788 O ARG A 49 102.943 13.114 4.544 1.00 0.00 O ATOM 789 CB ARG A 49 104.277 11.088 3.124 1.00 0.00 C ATOM 790 CG ARG A 49 105.244 11.188 4.312 1.00 0.00 C ATOM 791 CD ARG A 49 106.669 11.381 3.795 1.00 0.00 C ATOM 792 NE ARG A 49 107.644 11.119 4.904 1.00 0.00 N ATOM 793 CZ ARG A 49 107.594 11.778 6.032 1.00 0.00 C ATOM 794 NH1 ARG A 49 106.814 12.815 6.164 1.00 0.00 N ATOM 795 NH2 ARG A 49 108.369 11.426 7.020 1.00 0.00 N ATOM 0 H ARG A 49 101.452 9.464 2.877 1.00 0.00 H new ATOM 0 HA ARG A 49 102.871 10.223 4.501 1.00 0.00 H new ATOM 0 HB2 ARG A 49 104.559 10.254 2.482 1.00 0.00 H new ATOM 0 HB3 ARG A 49 104.336 11.991 2.517 1.00 0.00 H new ATOM 0 HG2 ARG A 49 104.963 12.023 4.954 1.00 0.00 H new ATOM 0 HG3 ARG A 49 105.185 10.285 4.919 1.00 0.00 H new ATOM 0 HD2 ARG A 49 106.860 10.705 2.962 1.00 0.00 H new ATOM 0 HD3 ARG A 49 106.796 12.396 3.417 1.00 0.00 H new ATOM 0 HE ARG A 49 108.364 10.409 4.775 1.00 0.00 H new ATOM 0 HH11 ARG A 49 106.234 13.120 5.382 1.00 0.00 H new ATOM 0 HH12 ARG A 49 106.784 13.321 7.049 1.00 0.00 H new ATOM 0 HH21 ARG A 49 109.010 10.640 6.910 1.00 0.00 H new ATOM 0 HH22 ARG A 49 108.334 11.937 7.902 1.00 0.00 H new ATOM 809 N THR A 50 100.966 12.413 3.901 1.00 0.00 N ATOM 810 CA THR A 50 100.329 13.696 4.314 1.00 0.00 C ATOM 811 C THR A 50 100.045 13.627 5.815 1.00 0.00 C ATOM 812 O THR A 50 100.865 13.167 6.585 1.00 0.00 O ATOM 813 CB THR A 50 99.018 13.897 3.541 1.00 0.00 C ATOM 814 OG1 THR A 50 98.327 15.020 4.071 1.00 0.00 O ATOM 815 CG2 THR A 50 98.135 12.651 3.659 1.00 0.00 C ATOM 0 H THR A 50 100.332 11.721 3.501 1.00 0.00 H new ATOM 0 HA THR A 50 100.991 14.534 4.097 1.00 0.00 H new ATOM 0 HB THR A 50 99.248 14.067 2.489 1.00 0.00 H new ATOM 0 HG1 THR A 50 97.490 15.152 3.578 1.00 0.00 H new ATOM 0 HG21 THR A 50 97.209 12.808 3.106 1.00 0.00 H new ATOM 0 HG22 THR A 50 98.663 11.791 3.247 1.00 0.00 H new ATOM 0 HG23 THR A 50 97.904 12.467 4.708 1.00 0.00 H new ATOM 823 N ASP A 51 98.891 14.054 6.244 1.00 0.00 N ATOM 824 CA ASP A 51 98.578 13.977 7.699 1.00 0.00 C ATOM 825 C ASP A 51 98.122 12.549 8.008 1.00 0.00 C ATOM 826 O ASP A 51 96.968 12.206 7.848 1.00 0.00 O ATOM 827 CB ASP A 51 97.458 14.962 8.035 1.00 0.00 C ATOM 828 CG ASP A 51 97.231 14.985 9.547 1.00 0.00 C ATOM 829 OD1 ASP A 51 97.632 14.037 10.201 1.00 0.00 O ATOM 830 OD2 ASP A 51 96.659 15.952 10.024 1.00 0.00 O ATOM 0 H ASP A 51 98.156 14.450 5.657 1.00 0.00 H new ATOM 0 HA ASP A 51 99.456 14.231 8.293 1.00 0.00 H new ATOM 0 HB2 ASP A 51 97.719 15.959 7.681 1.00 0.00 H new ATOM 0 HB3 ASP A 51 96.540 14.672 7.524 1.00 0.00 H new ATOM 835 N GLU A 52 99.030 11.708 8.425 1.00 0.00 N ATOM 836 CA GLU A 52 98.661 10.292 8.715 1.00 0.00 C ATOM 837 C GLU A 52 98.010 10.169 10.097 1.00 0.00 C ATOM 838 O GLU A 52 97.514 9.124 10.461 1.00 0.00 O ATOM 839 CB GLU A 52 99.909 9.408 8.658 1.00 0.00 C ATOM 840 CG GLU A 52 100.473 9.417 7.234 1.00 0.00 C ATOM 841 CD GLU A 52 101.721 8.536 7.170 1.00 0.00 C ATOM 842 OE1 GLU A 52 102.190 8.127 8.221 1.00 0.00 O ATOM 843 OE2 GLU A 52 102.190 8.287 6.071 1.00 0.00 O ATOM 0 H GLU A 52 100.011 11.940 8.577 1.00 0.00 H new ATOM 0 HA GLU A 52 97.944 9.965 7.962 1.00 0.00 H new ATOM 0 HB2 GLU A 52 100.659 9.772 9.360 1.00 0.00 H new ATOM 0 HB3 GLU A 52 99.661 8.389 8.956 1.00 0.00 H new ATOM 0 HG2 GLU A 52 99.722 9.053 6.533 1.00 0.00 H new ATOM 0 HG3 GLU A 52 100.720 10.436 6.936 1.00 0.00 H new ATOM 850 N ALA A 53 98.026 11.210 10.880 1.00 0.00 N ATOM 851 CA ALA A 53 97.422 11.111 12.241 1.00 0.00 C ATOM 852 C ALA A 53 96.018 10.504 12.153 1.00 0.00 C ATOM 853 O ALA A 53 95.738 9.491 12.753 1.00 0.00 O ATOM 854 CB ALA A 53 97.336 12.505 12.865 1.00 0.00 C ATOM 0 H ALA A 53 98.426 12.117 10.642 1.00 0.00 H new ATOM 0 HA ALA A 53 98.049 10.469 12.861 1.00 0.00 H new ATOM 0 HB1 ALA A 53 96.895 12.432 13.859 1.00 0.00 H new ATOM 0 HB2 ALA A 53 98.336 12.931 12.942 1.00 0.00 H new ATOM 0 HB3 ALA A 53 96.716 13.146 12.239 1.00 0.00 H new ATOM 860 N ALA A 54 95.129 11.103 11.416 1.00 0.00 N ATOM 861 CA ALA A 54 93.757 10.529 11.315 1.00 0.00 C ATOM 862 C ALA A 54 93.829 9.135 10.701 1.00 0.00 C ATOM 863 O ALA A 54 93.209 8.207 11.172 1.00 0.00 O ATOM 864 CB ALA A 54 92.896 11.435 10.450 1.00 0.00 C ATOM 0 H ALA A 54 95.288 11.958 10.883 1.00 0.00 H new ATOM 0 HA ALA A 54 93.316 10.455 12.309 1.00 0.00 H new ATOM 0 HB1 ALA A 54 91.892 11.018 10.374 1.00 0.00 H new ATOM 0 HB2 ALA A 54 92.844 12.426 10.900 1.00 0.00 H new ATOM 0 HB3 ALA A 54 93.334 11.511 9.455 1.00 0.00 H new ATOM 870 N PHE A 55 94.591 8.958 9.664 1.00 0.00 N ATOM 871 CA PHE A 55 94.687 7.598 9.077 1.00 0.00 C ATOM 872 C PHE A 55 95.227 6.679 10.159 1.00 0.00 C ATOM 873 O PHE A 55 94.790 5.557 10.326 1.00 0.00 O ATOM 874 CB PHE A 55 95.667 7.609 7.914 1.00 0.00 C ATOM 875 CG PHE A 55 95.031 8.284 6.724 1.00 0.00 C ATOM 876 CD1 PHE A 55 94.299 7.528 5.801 1.00 0.00 C ATOM 877 CD2 PHE A 55 95.170 9.665 6.547 1.00 0.00 C ATOM 878 CE1 PHE A 55 93.704 8.156 4.701 1.00 0.00 C ATOM 879 CE2 PHE A 55 94.574 10.291 5.448 1.00 0.00 C ATOM 880 CZ PHE A 55 93.841 9.537 4.525 1.00 0.00 C ATOM 0 H PHE A 55 95.143 9.682 9.203 1.00 0.00 H new ATOM 0 HA PHE A 55 93.712 7.266 8.719 1.00 0.00 H new ATOM 0 HB2 PHE A 55 96.579 8.134 8.198 1.00 0.00 H new ATOM 0 HB3 PHE A 55 95.953 6.589 7.657 1.00 0.00 H new ATOM 0 HD1 PHE A 55 94.194 6.462 5.938 1.00 0.00 H new ATOM 0 HD2 PHE A 55 95.737 10.247 7.259 1.00 0.00 H new ATOM 0 HE1 PHE A 55 93.139 7.574 3.988 1.00 0.00 H new ATOM 0 HE2 PHE A 55 94.679 11.357 5.311 1.00 0.00 H new ATOM 0 HZ PHE A 55 93.381 10.021 3.676 1.00 0.00 H new ATOM 890 N GLN A 56 96.170 7.169 10.911 1.00 0.00 N ATOM 891 CA GLN A 56 96.746 6.352 12.004 1.00 0.00 C ATOM 892 C GLN A 56 95.635 6.007 12.987 1.00 0.00 C ATOM 893 O GLN A 56 95.648 4.969 13.604 1.00 0.00 O ATOM 894 CB GLN A 56 97.868 7.124 12.706 1.00 0.00 C ATOM 895 CG GLN A 56 98.455 6.273 13.828 1.00 0.00 C ATOM 896 CD GLN A 56 99.690 6.973 14.395 1.00 0.00 C ATOM 897 OE1 GLN A 56 100.252 7.843 13.760 1.00 0.00 O ATOM 898 NE2 GLN A 56 100.131 6.635 15.573 1.00 0.00 N ATOM 0 H GLN A 56 96.566 8.104 10.813 1.00 0.00 H new ATOM 0 HA GLN A 56 97.173 5.435 11.599 1.00 0.00 H new ATOM 0 HB2 GLN A 56 98.647 7.385 11.989 1.00 0.00 H new ATOM 0 HB3 GLN A 56 97.481 8.059 13.110 1.00 0.00 H new ATOM 0 HG2 GLN A 56 97.714 6.124 14.613 1.00 0.00 H new ATOM 0 HG3 GLN A 56 98.723 5.286 13.450 1.00 0.00 H new ATOM 0 HE21 GLN A 56 99.658 5.904 16.104 1.00 0.00 H new ATOM 0 HE22 GLN A 56 100.950 7.101 15.964 1.00 0.00 H new ATOM 907 N LYS A 57 94.664 6.863 13.119 1.00 0.00 N ATOM 908 CA LYS A 57 93.534 6.555 14.050 1.00 0.00 C ATOM 909 C LYS A 57 92.729 5.432 13.435 1.00 0.00 C ATOM 910 O LYS A 57 92.284 4.520 14.101 1.00 0.00 O ATOM 911 CB LYS A 57 92.621 7.769 14.238 1.00 0.00 C ATOM 912 CG LYS A 57 93.351 8.858 15.019 1.00 0.00 C ATOM 913 CD LYS A 57 92.442 10.089 15.156 1.00 0.00 C ATOM 914 CE LYS A 57 93.294 11.328 15.427 1.00 0.00 C ATOM 915 NZ LYS A 57 94.328 11.006 16.451 1.00 0.00 N ATOM 0 H LYS A 57 94.599 7.756 12.630 1.00 0.00 H new ATOM 0 HA LYS A 57 93.936 6.279 15.025 1.00 0.00 H new ATOM 0 HB2 LYS A 57 92.310 8.154 13.267 1.00 0.00 H new ATOM 0 HB3 LYS A 57 91.716 7.474 14.769 1.00 0.00 H new ATOM 0 HG2 LYS A 57 93.630 8.488 16.005 1.00 0.00 H new ATOM 0 HG3 LYS A 57 94.274 9.130 14.508 1.00 0.00 H new ATOM 0 HD2 LYS A 57 91.861 10.227 14.244 1.00 0.00 H new ATOM 0 HD3 LYS A 57 91.731 9.940 15.968 1.00 0.00 H new ATOM 0 HE2 LYS A 57 93.771 11.663 14.506 1.00 0.00 H new ATOM 0 HE3 LYS A 57 92.664 12.146 15.776 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 94.651 11.884 16.906 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 93.920 10.374 17.169 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 95.135 10.536 15.994 1.00 0.00 H new ATOM 929 N LEU A 58 92.553 5.490 12.149 1.00 0.00 N ATOM 930 CA LEU A 58 91.794 4.419 11.468 1.00 0.00 C ATOM 931 C LEU A 58 92.639 3.165 11.595 1.00 0.00 C ATOM 932 O LEU A 58 92.153 2.088 11.861 1.00 0.00 O ATOM 933 CB LEU A 58 91.580 4.786 9.997 1.00 0.00 C ATOM 934 CG LEU A 58 90.692 3.739 9.312 1.00 0.00 C ATOM 935 CD1 LEU A 58 89.274 3.754 9.921 1.00 0.00 C ATOM 936 CD2 LEU A 58 90.613 4.066 7.816 1.00 0.00 C ATOM 0 H LEU A 58 92.902 6.232 11.543 1.00 0.00 H new ATOM 0 HA LEU A 58 90.808 4.273 11.909 1.00 0.00 H new ATOM 0 HB2 LEU A 58 91.117 5.770 9.924 1.00 0.00 H new ATOM 0 HB3 LEU A 58 92.541 4.848 9.487 1.00 0.00 H new ATOM 0 HG LEU A 58 91.121 2.748 9.459 1.00 0.00 H new ATOM 0 HD11 LEU A 58 88.657 3.006 9.424 1.00 0.00 H new ATOM 0 HD12 LEU A 58 89.333 3.527 10.986 1.00 0.00 H new ATOM 0 HD13 LEU A 58 88.830 4.740 9.784 1.00 0.00 H new ATOM 0 HD21 LEU A 58 89.984 3.330 7.315 1.00 0.00 H new ATOM 0 HD22 LEU A 58 90.184 5.059 7.683 1.00 0.00 H new ATOM 0 HD23 LEU A 58 91.614 4.042 7.385 1.00 0.00 H new ATOM 948 N MET A 59 93.922 3.319 11.446 1.00 0.00 N ATOM 949 CA MET A 59 94.827 2.159 11.608 1.00 0.00 C ATOM 950 C MET A 59 94.874 1.813 13.090 1.00 0.00 C ATOM 951 O MET A 59 94.971 0.664 13.471 1.00 0.00 O ATOM 952 CB MET A 59 96.231 2.509 11.115 1.00 0.00 C ATOM 953 CG MET A 59 97.086 1.242 11.052 1.00 0.00 C ATOM 954 SD MET A 59 98.811 1.685 10.718 1.00 0.00 S ATOM 955 CE MET A 59 98.624 2.081 8.959 1.00 0.00 C ATOM 0 H MET A 59 94.381 4.201 11.219 1.00 0.00 H new ATOM 0 HA MET A 59 94.463 1.313 11.025 1.00 0.00 H new ATOM 0 HB2 MET A 59 96.176 2.972 10.130 1.00 0.00 H new ATOM 0 HB3 MET A 59 96.691 3.237 11.784 1.00 0.00 H new ATOM 0 HG2 MET A 59 97.016 0.697 11.994 1.00 0.00 H new ATOM 0 HG3 MET A 59 96.713 0.579 10.272 1.00 0.00 H new ATOM 0 HE1 MET A 59 99.607 2.123 8.489 1.00 0.00 H new ATOM 0 HE2 MET A 59 98.023 1.312 8.475 1.00 0.00 H new ATOM 0 HE3 MET A 59 98.130 3.047 8.854 1.00 0.00 H new ATOM 965 N SER A 60 94.796 2.807 13.935 1.00 0.00 N ATOM 966 CA SER A 60 94.827 2.530 15.396 1.00 0.00 C ATOM 967 C SER A 60 93.712 1.543 15.704 1.00 0.00 C ATOM 968 O SER A 60 93.809 0.737 16.608 1.00 0.00 O ATOM 969 CB SER A 60 94.600 3.814 16.195 1.00 0.00 C ATOM 970 OG SER A 60 94.774 3.539 17.579 1.00 0.00 O ATOM 0 H SER A 60 94.713 3.790 13.677 1.00 0.00 H new ATOM 0 HA SER A 60 95.800 2.124 15.673 1.00 0.00 H new ATOM 0 HB2 SER A 60 95.300 4.585 15.874 1.00 0.00 H new ATOM 0 HB3 SER A 60 93.597 4.198 16.011 1.00 0.00 H new ATOM 0 HG SER A 60 94.631 4.359 18.096 1.00 0.00 H new ATOM 976 N ASN A 61 92.654 1.593 14.940 1.00 0.00 N ATOM 977 CA ASN A 61 91.536 0.640 15.175 1.00 0.00 C ATOM 978 C ASN A 61 92.041 -0.746 14.791 1.00 0.00 C ATOM 979 O ASN A 61 91.802 -1.717 15.471 1.00 0.00 O ATOM 980 CB ASN A 61 90.311 1.029 14.337 1.00 0.00 C ATOM 981 CG ASN A 61 89.705 2.324 14.887 1.00 0.00 C ATOM 982 OD1 ASN A 61 89.542 3.285 14.162 1.00 0.00 O ATOM 983 ND2 ASN A 61 89.364 2.391 16.144 1.00 0.00 N ATOM 0 H ASN A 61 92.518 2.248 14.170 1.00 0.00 H new ATOM 0 HA ASN A 61 91.225 0.657 16.220 1.00 0.00 H new ATOM 0 HB2 ASN A 61 90.599 1.164 13.294 1.00 0.00 H new ATOM 0 HB3 ASN A 61 89.571 0.229 14.363 1.00 0.00 H new ATOM 0 HD21 ASN A 61 88.961 3.250 16.518 1.00 0.00 H new ATOM 0 HD22 ASN A 61 89.501 1.584 16.753 1.00 0.00 H new ATOM 990 N LEU A 62 92.790 -0.844 13.728 1.00 0.00 N ATOM 991 CA LEU A 62 93.350 -2.169 13.361 1.00 0.00 C ATOM 992 C LEU A 62 94.200 -2.603 14.559 1.00 0.00 C ATOM 993 O LEU A 62 94.291 -3.765 14.901 1.00 0.00 O ATOM 994 CB LEU A 62 94.177 -2.031 12.052 1.00 0.00 C ATOM 995 CG LEU A 62 95.504 -2.821 12.101 1.00 0.00 C ATOM 996 CD1 LEU A 62 95.251 -4.323 12.397 1.00 0.00 C ATOM 997 CD2 LEU A 62 96.222 -2.659 10.746 1.00 0.00 C ATOM 0 H LEU A 62 93.035 -0.073 13.106 1.00 0.00 H new ATOM 0 HA LEU A 62 92.586 -2.920 13.159 1.00 0.00 H new ATOM 0 HB2 LEU A 62 93.580 -2.383 11.211 1.00 0.00 H new ATOM 0 HB3 LEU A 62 94.392 -0.978 11.872 1.00 0.00 H new ATOM 0 HG LEU A 62 96.126 -2.428 12.905 1.00 0.00 H new ATOM 0 HD11 LEU A 62 96.203 -4.854 12.425 1.00 0.00 H new ATOM 0 HD12 LEU A 62 94.750 -4.425 13.360 1.00 0.00 H new ATOM 0 HD13 LEU A 62 94.622 -4.747 11.614 1.00 0.00 H new ATOM 0 HD21 LEU A 62 97.162 -3.211 10.764 1.00 0.00 H new ATOM 0 HD22 LEU A 62 95.588 -3.048 9.949 1.00 0.00 H new ATOM 0 HD23 LEU A 62 96.425 -1.603 10.566 1.00 0.00 H new ATOM 1009 N ASP A 63 94.775 -1.649 15.234 1.00 0.00 N ATOM 1010 CA ASP A 63 95.573 -1.963 16.445 1.00 0.00 C ATOM 1011 C ASP A 63 94.610 -2.031 17.633 1.00 0.00 C ATOM 1012 O ASP A 63 95.017 -2.065 18.778 1.00 0.00 O ATOM 1013 CB ASP A 63 96.605 -0.863 16.686 1.00 0.00 C ATOM 1014 CG ASP A 63 97.605 -0.840 15.529 1.00 0.00 C ATOM 1015 OD1 ASP A 63 97.637 -1.804 14.782 1.00 0.00 O ATOM 1016 OD2 ASP A 63 98.315 0.145 15.405 1.00 0.00 O ATOM 0 H ASP A 63 94.725 -0.659 14.995 1.00 0.00 H new ATOM 0 HA ASP A 63 96.097 -2.910 16.319 1.00 0.00 H new ATOM 0 HB2 ASP A 63 96.109 0.104 16.771 1.00 0.00 H new ATOM 0 HB3 ASP A 63 97.126 -1.038 17.627 1.00 0.00 H new ATOM 1021 N SER A 64 93.325 -2.037 17.360 1.00 0.00 N ATOM 1022 CA SER A 64 92.324 -2.088 18.463 1.00 0.00 C ATOM 1023 C SER A 64 92.582 -3.336 19.306 1.00 0.00 C ATOM 1024 O SER A 64 92.087 -3.469 20.408 1.00 0.00 O ATOM 1025 CB SER A 64 90.905 -2.177 17.891 1.00 0.00 C ATOM 1026 OG SER A 64 89.990 -2.436 18.947 1.00 0.00 O ATOM 0 H SER A 64 92.931 -2.009 16.419 1.00 0.00 H new ATOM 0 HA SER A 64 92.416 -1.185 19.066 1.00 0.00 H new ATOM 0 HB2 SER A 64 90.644 -1.246 17.388 1.00 0.00 H new ATOM 0 HB3 SER A 64 90.850 -2.969 17.144 1.00 0.00 H new ATOM 0 HG SER A 64 89.081 -2.492 18.586 1.00 0.00 H new ATOM 1032 N ASN A 65 93.335 -4.265 18.772 1.00 0.00 N ATOM 1033 CA ASN A 65 93.622 -5.530 19.506 1.00 0.00 C ATOM 1034 C ASN A 65 92.295 -6.211 19.846 1.00 0.00 C ATOM 1035 O ASN A 65 92.147 -6.843 20.873 1.00 0.00 O ATOM 1036 CB ASN A 65 94.415 -5.234 20.786 1.00 0.00 C ATOM 1037 CG ASN A 65 95.745 -4.570 20.420 1.00 0.00 C ATOM 1038 OD1 ASN A 65 96.054 -3.496 20.898 1.00 0.00 O ATOM 1039 ND2 ASN A 65 96.554 -5.168 19.586 1.00 0.00 N ATOM 0 H ASN A 65 93.766 -4.198 17.850 1.00 0.00 H new ATOM 0 HA ASN A 65 94.224 -6.191 18.882 1.00 0.00 H new ATOM 0 HB2 ASN A 65 93.838 -4.581 21.441 1.00 0.00 H new ATOM 0 HB3 ASN A 65 94.596 -6.157 21.336 1.00 0.00 H new ATOM 0 HD21 ASN A 65 97.443 -4.733 19.337 1.00 0.00 H new ATOM 0 HD22 ASN A 65 96.297 -6.069 19.184 1.00 0.00 H new ATOM 1046 N ARG A 66 91.328 -6.082 18.975 1.00 0.00 N ATOM 1047 CA ARG A 66 89.995 -6.710 19.208 1.00 0.00 C ATOM 1048 C ARG A 66 89.361 -7.028 17.850 1.00 0.00 C ATOM 1049 O ARG A 66 89.418 -6.230 16.936 1.00 0.00 O ATOM 1050 CB ARG A 66 89.105 -5.733 19.977 1.00 0.00 C ATOM 1051 CG ARG A 66 87.797 -6.426 20.370 1.00 0.00 C ATOM 1052 CD ARG A 66 86.908 -5.446 21.139 1.00 0.00 C ATOM 1053 NE ARG A 66 85.670 -6.142 21.592 1.00 0.00 N ATOM 1054 CZ ARG A 66 84.914 -5.600 22.508 1.00 0.00 C ATOM 1055 NH1 ARG A 66 85.246 -4.452 23.035 1.00 0.00 N ATOM 1056 NH2 ARG A 66 83.824 -6.204 22.896 1.00 0.00 N ATOM 0 H ARG A 66 91.407 -5.561 18.101 1.00 0.00 H new ATOM 0 HA ARG A 66 90.105 -7.626 19.788 1.00 0.00 H new ATOM 0 HB2 ARG A 66 89.623 -5.379 20.869 1.00 0.00 H new ATOM 0 HB3 ARG A 66 88.894 -4.858 19.363 1.00 0.00 H new ATOM 0 HG2 ARG A 66 87.279 -6.780 19.479 1.00 0.00 H new ATOM 0 HG3 ARG A 66 88.008 -7.301 20.985 1.00 0.00 H new ATOM 0 HD2 ARG A 66 87.448 -5.047 21.998 1.00 0.00 H new ATOM 0 HD3 ARG A 66 86.649 -4.599 20.504 1.00 0.00 H new ATOM 0 HE ARG A 66 85.414 -7.042 21.186 1.00 0.00 H new ATOM 0 HH11 ARG A 66 86.097 -3.978 22.731 1.00 0.00 H new ATOM 0 HH12 ARG A 66 84.655 -4.029 23.751 1.00 0.00 H new ATOM 0 HH21 ARG A 66 83.563 -7.100 22.484 1.00 0.00 H new ATOM 0 HH22 ARG A 66 83.233 -5.780 23.612 1.00 0.00 H new ATOM 1070 N ASP A 67 88.765 -8.181 17.694 1.00 0.00 N ATOM 1071 CA ASP A 67 88.150 -8.508 16.375 1.00 0.00 C ATOM 1072 C ASP A 67 89.194 -8.280 15.275 1.00 0.00 C ATOM 1073 O ASP A 67 89.272 -7.219 14.691 1.00 0.00 O ATOM 1074 CB ASP A 67 86.940 -7.604 16.135 1.00 0.00 C ATOM 1075 CG ASP A 67 86.196 -8.073 14.884 1.00 0.00 C ATOM 1076 OD1 ASP A 67 86.802 -8.771 14.086 1.00 0.00 O ATOM 1077 OD2 ASP A 67 85.035 -7.727 14.745 1.00 0.00 O ATOM 0 H ASP A 67 88.678 -8.901 18.412 1.00 0.00 H new ATOM 0 HA ASP A 67 87.823 -9.548 16.364 1.00 0.00 H new ATOM 0 HB2 ASP A 67 86.275 -7.631 16.998 1.00 0.00 H new ATOM 0 HB3 ASP A 67 87.263 -6.570 16.013 1.00 0.00 H new ATOM 1082 N ASN A 68 90.017 -9.261 15.015 1.00 0.00 N ATOM 1083 CA ASN A 68 91.087 -9.104 13.980 1.00 0.00 C ATOM 1084 C ASN A 68 90.587 -9.534 12.596 1.00 0.00 C ATOM 1085 O ASN A 68 91.372 -9.685 11.680 1.00 0.00 O ATOM 1086 CB ASN A 68 92.289 -9.970 14.369 1.00 0.00 C ATOM 1087 CG ASN A 68 91.883 -11.445 14.372 1.00 0.00 C ATOM 1088 OD1 ASN A 68 90.718 -11.768 14.249 1.00 0.00 O ATOM 1089 ND2 ASN A 68 92.804 -12.360 14.510 1.00 0.00 N ATOM 0 H ASN A 68 89.996 -10.170 15.476 1.00 0.00 H new ATOM 0 HA ASN A 68 91.370 -8.053 13.933 1.00 0.00 H new ATOM 0 HB2 ASN A 68 93.107 -9.810 13.667 1.00 0.00 H new ATOM 0 HB3 ASN A 68 92.654 -9.681 15.355 1.00 0.00 H new ATOM 0 HD21 ASN A 68 92.546 -13.347 14.515 1.00 0.00 H new ATOM 0 HD22 ASN A 68 93.782 -12.088 14.613 1.00 0.00 H new ATOM 1096 N GLU A 69 89.301 -9.749 12.430 1.00 0.00 N ATOM 1097 CA GLU A 69 88.770 -10.188 11.091 1.00 0.00 C ATOM 1098 C GLU A 69 87.955 -9.061 10.439 1.00 0.00 C ATOM 1099 O GLU A 69 87.361 -8.233 11.100 1.00 0.00 O ATOM 1100 CB GLU A 69 87.872 -11.417 11.272 1.00 0.00 C ATOM 1101 CG GLU A 69 87.704 -12.140 9.932 1.00 0.00 C ATOM 1102 CD GLU A 69 89.021 -12.817 9.539 1.00 0.00 C ATOM 1103 OE1 GLU A 69 89.874 -12.955 10.398 1.00 0.00 O ATOM 1104 OE2 GLU A 69 89.152 -13.183 8.383 1.00 0.00 O ATOM 0 H GLU A 69 88.596 -9.641 13.159 1.00 0.00 H new ATOM 0 HA GLU A 69 89.614 -10.435 10.447 1.00 0.00 H new ATOM 0 HB2 GLU A 69 88.309 -12.092 12.008 1.00 0.00 H new ATOM 0 HB3 GLU A 69 86.898 -11.114 11.656 1.00 0.00 H new ATOM 0 HG2 GLU A 69 86.910 -12.883 10.006 1.00 0.00 H new ATOM 0 HG3 GLU A 69 87.405 -11.431 9.161 1.00 0.00 H new ATOM 1111 N VAL A 70 87.937 -9.043 9.132 1.00 0.00 N ATOM 1112 CA VAL A 70 87.186 -8.002 8.366 1.00 0.00 C ATOM 1113 C VAL A 70 86.088 -8.687 7.564 1.00 0.00 C ATOM 1114 O VAL A 70 86.352 -9.416 6.629 1.00 0.00 O ATOM 1115 CB VAL A 70 88.161 -7.344 7.396 1.00 0.00 C ATOM 1116 CG1 VAL A 70 87.580 -6.054 6.842 1.00 0.00 C ATOM 1117 CG2 VAL A 70 89.469 -7.041 8.114 1.00 0.00 C ATOM 0 H VAL A 70 88.424 -9.723 8.548 1.00 0.00 H new ATOM 0 HA VAL A 70 86.751 -7.263 9.039 1.00 0.00 H new ATOM 0 HB VAL A 70 88.342 -8.030 6.569 1.00 0.00 H new ATOM 0 HG11 VAL A 70 88.292 -5.601 6.152 1.00 0.00 H new ATOM 0 HG12 VAL A 70 86.651 -6.270 6.314 1.00 0.00 H new ATOM 0 HG13 VAL A 70 87.379 -5.364 7.661 1.00 0.00 H new ATOM 0 HG21 VAL A 70 90.165 -6.571 7.419 1.00 0.00 H new ATOM 0 HG22 VAL A 70 89.278 -6.367 8.949 1.00 0.00 H new ATOM 0 HG23 VAL A 70 89.902 -7.969 8.489 1.00 0.00 H new ATOM 1127 N ASP A 71 84.862 -8.431 7.889 1.00 0.00 N ATOM 1128 CA ASP A 71 83.763 -9.043 7.105 1.00 0.00 C ATOM 1129 C ASP A 71 83.642 -8.219 5.836 1.00 0.00 C ATOM 1130 O ASP A 71 84.220 -7.155 5.736 1.00 0.00 O ATOM 1131 CB ASP A 71 82.450 -8.984 7.893 1.00 0.00 C ATOM 1132 CG ASP A 71 82.517 -9.943 9.082 1.00 0.00 C ATOM 1133 OD1 ASP A 71 83.338 -10.844 9.047 1.00 0.00 O ATOM 1134 OD2 ASP A 71 81.741 -9.763 10.007 1.00 0.00 O ATOM 0 H ASP A 71 84.571 -7.828 8.659 1.00 0.00 H new ATOM 0 HA ASP A 71 83.969 -10.091 6.887 1.00 0.00 H new ATOM 0 HB2 ASP A 71 82.271 -7.968 8.243 1.00 0.00 H new ATOM 0 HB3 ASP A 71 81.614 -9.250 7.246 1.00 0.00 H new ATOM 1139 N PHE A 72 82.914 -8.665 4.860 1.00 0.00 N ATOM 1140 CA PHE A 72 82.802 -7.854 3.631 1.00 0.00 C ATOM 1141 C PHE A 72 82.355 -6.451 4.038 1.00 0.00 C ATOM 1142 O PHE A 72 82.793 -5.456 3.497 1.00 0.00 O ATOM 1143 CB PHE A 72 81.760 -8.468 2.705 1.00 0.00 C ATOM 1144 CG PHE A 72 81.808 -7.745 1.390 1.00 0.00 C ATOM 1145 CD1 PHE A 72 81.030 -6.602 1.195 1.00 0.00 C ATOM 1146 CD2 PHE A 72 82.647 -8.207 0.374 1.00 0.00 C ATOM 1147 CE1 PHE A 72 81.088 -5.919 -0.022 1.00 0.00 C ATOM 1148 CE2 PHE A 72 82.708 -7.526 -0.843 1.00 0.00 C ATOM 1149 CZ PHE A 72 81.929 -6.380 -1.044 1.00 0.00 C ATOM 0 H PHE A 72 82.398 -9.545 4.860 1.00 0.00 H new ATOM 0 HA PHE A 72 83.759 -7.818 3.110 1.00 0.00 H new ATOM 0 HB2 PHE A 72 81.959 -9.530 2.561 1.00 0.00 H new ATOM 0 HB3 PHE A 72 80.766 -8.387 3.146 1.00 0.00 H new ATOM 0 HD1 PHE A 72 80.384 -6.246 1.984 1.00 0.00 H new ATOM 0 HD2 PHE A 72 83.248 -9.091 0.530 1.00 0.00 H new ATOM 0 HE1 PHE A 72 80.485 -5.036 -0.175 1.00 0.00 H new ATOM 0 HE2 PHE A 72 83.356 -7.883 -1.630 1.00 0.00 H new ATOM 0 HZ PHE A 72 81.976 -5.852 -1.985 1.00 0.00 H new ATOM 1159 N GLN A 73 81.481 -6.383 4.999 1.00 0.00 N ATOM 1160 CA GLN A 73 80.979 -5.072 5.478 1.00 0.00 C ATOM 1161 C GLN A 73 82.083 -4.302 6.220 1.00 0.00 C ATOM 1162 O GLN A 73 82.196 -3.106 6.071 1.00 0.00 O ATOM 1163 CB GLN A 73 79.793 -5.309 6.419 1.00 0.00 C ATOM 1164 CG GLN A 73 79.244 -3.971 6.926 1.00 0.00 C ATOM 1165 CD GLN A 73 78.027 -4.227 7.816 1.00 0.00 C ATOM 1166 OE1 GLN A 73 78.042 -5.113 8.648 1.00 0.00 O ATOM 1167 NE2 GLN A 73 76.966 -3.482 7.677 1.00 0.00 N ATOM 0 H GLN A 73 81.088 -7.193 5.479 1.00 0.00 H new ATOM 0 HA GLN A 73 80.666 -4.476 4.621 1.00 0.00 H new ATOM 0 HB2 GLN A 73 79.009 -5.858 5.897 1.00 0.00 H new ATOM 0 HB3 GLN A 73 80.106 -5.925 7.262 1.00 0.00 H new ATOM 0 HG2 GLN A 73 80.013 -3.439 7.486 1.00 0.00 H new ATOM 0 HG3 GLN A 73 78.966 -3.337 6.084 1.00 0.00 H new ATOM 0 HE21 GLN A 73 76.953 -2.738 6.979 1.00 0.00 H new ATOM 0 HE22 GLN A 73 76.149 -3.643 8.266 1.00 0.00 H new ATOM 1176 N GLU A 74 82.896 -4.950 7.026 1.00 0.00 N ATOM 1177 CA GLU A 74 83.946 -4.190 7.753 1.00 0.00 C ATOM 1178 C GLU A 74 84.953 -3.623 6.763 1.00 0.00 C ATOM 1179 O GLU A 74 85.404 -2.503 6.899 1.00 0.00 O ATOM 1180 CB GLU A 74 84.652 -5.110 8.746 1.00 0.00 C ATOM 1181 CG GLU A 74 83.701 -5.465 9.894 1.00 0.00 C ATOM 1182 CD GLU A 74 83.419 -4.219 10.737 1.00 0.00 C ATOM 1183 OE1 GLU A 74 84.232 -3.310 10.709 1.00 0.00 O ATOM 1184 OE2 GLU A 74 82.391 -4.195 11.395 1.00 0.00 O ATOM 0 H GLU A 74 82.873 -5.954 7.204 1.00 0.00 H new ATOM 0 HA GLU A 74 83.482 -3.367 8.296 1.00 0.00 H new ATOM 0 HB2 GLU A 74 84.983 -6.018 8.242 1.00 0.00 H new ATOM 0 HB3 GLU A 74 85.543 -4.620 9.139 1.00 0.00 H new ATOM 0 HG2 GLU A 74 82.768 -5.865 9.496 1.00 0.00 H new ATOM 0 HG3 GLU A 74 84.142 -6.244 10.516 1.00 0.00 H new ATOM 1191 N TYR A 75 85.308 -4.372 5.763 1.00 0.00 N ATOM 1192 CA TYR A 75 86.286 -3.843 4.782 1.00 0.00 C ATOM 1193 C TYR A 75 85.684 -2.580 4.159 1.00 0.00 C ATOM 1194 O TYR A 75 86.356 -1.592 3.937 1.00 0.00 O ATOM 1195 CB TYR A 75 86.546 -4.895 3.692 1.00 0.00 C ATOM 1196 CG TYR A 75 87.200 -4.252 2.481 1.00 0.00 C ATOM 1197 CD1 TYR A 75 88.363 -3.483 2.633 1.00 0.00 C ATOM 1198 CD2 TYR A 75 86.635 -4.419 1.208 1.00 0.00 C ATOM 1199 CE1 TYR A 75 88.959 -2.887 1.516 1.00 0.00 C ATOM 1200 CE2 TYR A 75 87.232 -3.821 0.092 1.00 0.00 C ATOM 1201 CZ TYR A 75 88.393 -3.056 0.246 1.00 0.00 C ATOM 1202 OH TYR A 75 88.981 -2.467 -0.855 1.00 0.00 O ATOM 0 H TYR A 75 84.968 -5.317 5.583 1.00 0.00 H new ATOM 0 HA TYR A 75 87.233 -3.611 5.269 1.00 0.00 H new ATOM 0 HB2 TYR A 75 87.188 -5.683 4.084 1.00 0.00 H new ATOM 0 HB3 TYR A 75 85.607 -5.365 3.400 1.00 0.00 H new ATOM 0 HD1 TYR A 75 88.799 -3.351 3.612 1.00 0.00 H new ATOM 0 HD2 TYR A 75 85.739 -5.009 1.089 1.00 0.00 H new ATOM 0 HE1 TYR A 75 89.856 -2.297 1.633 1.00 0.00 H new ATOM 0 HE2 TYR A 75 86.796 -3.950 -0.888 1.00 0.00 H new ATOM 0 HH TYR A 75 88.463 -2.684 -1.658 1.00 0.00 H new ATOM 1212 N CYS A 76 84.411 -2.617 3.891 1.00 0.00 N ATOM 1213 CA CYS A 76 83.721 -1.448 3.300 1.00 0.00 C ATOM 1214 C CYS A 76 83.658 -0.338 4.343 1.00 0.00 C ATOM 1215 O CYS A 76 83.820 0.823 4.034 1.00 0.00 O ATOM 1216 CB CYS A 76 82.307 -1.846 2.880 1.00 0.00 C ATOM 1217 SG CYS A 76 82.403 -3.174 1.654 1.00 0.00 S ATOM 0 H CYS A 76 83.812 -3.425 4.061 1.00 0.00 H new ATOM 0 HA CYS A 76 84.265 -1.098 2.422 1.00 0.00 H new ATOM 0 HB2 CYS A 76 81.736 -2.176 3.748 1.00 0.00 H new ATOM 0 HB3 CYS A 76 81.783 -0.986 2.462 1.00 0.00 H new ATOM 0 HG CYS A 76 82.728 -4.286 2.243 1.00 0.00 H new ATOM 1223 N VAL A 77 83.441 -0.680 5.588 1.00 0.00 N ATOM 1224 CA VAL A 77 83.399 0.384 6.622 1.00 0.00 C ATOM 1225 C VAL A 77 84.753 1.079 6.604 1.00 0.00 C ATOM 1226 O VAL A 77 84.844 2.289 6.672 1.00 0.00 O ATOM 1227 CB VAL A 77 83.151 -0.238 8.002 1.00 0.00 C ATOM 1228 CG1 VAL A 77 83.372 0.818 9.089 1.00 0.00 C ATOM 1229 CG2 VAL A 77 81.707 -0.754 8.083 1.00 0.00 C ATOM 0 H VAL A 77 83.294 -1.632 5.924 1.00 0.00 H new ATOM 0 HA VAL A 77 82.595 1.092 6.419 1.00 0.00 H new ATOM 0 HB VAL A 77 83.843 -1.066 8.152 1.00 0.00 H new ATOM 0 HG11 VAL A 77 83.195 0.374 10.069 1.00 0.00 H new ATOM 0 HG12 VAL A 77 84.397 1.185 9.036 1.00 0.00 H new ATOM 0 HG13 VAL A 77 82.681 1.647 8.936 1.00 0.00 H new ATOM 0 HG21 VAL A 77 81.533 -1.196 9.064 1.00 0.00 H new ATOM 0 HG22 VAL A 77 81.015 0.075 7.930 1.00 0.00 H new ATOM 0 HG23 VAL A 77 81.546 -1.508 7.312 1.00 0.00 H new ATOM 1239 N PHE A 78 85.808 0.323 6.474 1.00 0.00 N ATOM 1240 CA PHE A 78 87.152 0.946 6.409 1.00 0.00 C ATOM 1241 C PHE A 78 87.269 1.719 5.095 1.00 0.00 C ATOM 1242 O PHE A 78 87.783 2.818 5.058 1.00 0.00 O ATOM 1243 CB PHE A 78 88.233 -0.139 6.456 1.00 0.00 C ATOM 1244 CG PHE A 78 88.389 -0.653 7.870 1.00 0.00 C ATOM 1245 CD1 PHE A 78 88.873 0.201 8.869 1.00 0.00 C ATOM 1246 CD2 PHE A 78 88.056 -1.978 8.185 1.00 0.00 C ATOM 1247 CE1 PHE A 78 89.024 -0.267 10.179 1.00 0.00 C ATOM 1248 CE2 PHE A 78 88.206 -2.445 9.496 1.00 0.00 C ATOM 1249 CZ PHE A 78 88.690 -1.590 10.494 1.00 0.00 C ATOM 0 H PHE A 78 85.794 -0.695 6.410 1.00 0.00 H new ATOM 0 HA PHE A 78 87.286 1.618 7.256 1.00 0.00 H new ATOM 0 HB2 PHE A 78 87.966 -0.959 5.790 1.00 0.00 H new ATOM 0 HB3 PHE A 78 89.181 0.265 6.100 1.00 0.00 H new ATOM 0 HD1 PHE A 78 89.130 1.222 8.628 1.00 0.00 H new ATOM 0 HD2 PHE A 78 87.684 -2.639 7.416 1.00 0.00 H new ATOM 0 HE1 PHE A 78 89.398 0.393 10.948 1.00 0.00 H new ATOM 0 HE2 PHE A 78 87.948 -3.465 9.738 1.00 0.00 H new ATOM 0 HZ PHE A 78 88.806 -1.951 11.505 1.00 0.00 H new ATOM 1259 N LEU A 79 86.791 1.159 4.011 1.00 0.00 N ATOM 1260 CA LEU A 79 86.882 1.885 2.709 1.00 0.00 C ATOM 1261 C LEU A 79 85.927 3.083 2.731 1.00 0.00 C ATOM 1262 O LEU A 79 86.213 4.137 2.196 1.00 0.00 O ATOM 1263 CB LEU A 79 86.517 0.940 1.561 1.00 0.00 C ATOM 1264 CG LEU A 79 86.770 1.620 0.206 1.00 0.00 C ATOM 1265 CD1 LEU A 79 88.283 1.839 -0.018 1.00 0.00 C ATOM 1266 CD2 LEU A 79 86.208 0.722 -0.905 1.00 0.00 C ATOM 0 H LEU A 79 86.347 0.242 3.972 1.00 0.00 H new ATOM 0 HA LEU A 79 87.901 2.240 2.558 1.00 0.00 H new ATOM 0 HB2 LEU A 79 87.107 0.026 1.632 1.00 0.00 H new ATOM 0 HB3 LEU A 79 85.469 0.650 1.639 1.00 0.00 H new ATOM 0 HG LEU A 79 86.278 2.592 0.192 1.00 0.00 H new ATOM 0 HD11 LEU A 79 88.442 2.321 -0.982 1.00 0.00 H new ATOM 0 HD12 LEU A 79 88.680 2.473 0.775 1.00 0.00 H new ATOM 0 HD13 LEU A 79 88.796 0.877 -0.005 1.00 0.00 H new ATOM 0 HD21 LEU A 79 86.380 1.191 -1.874 1.00 0.00 H new ATOM 0 HD22 LEU A 79 86.707 -0.247 -0.877 1.00 0.00 H new ATOM 0 HD23 LEU A 79 85.137 0.583 -0.754 1.00 0.00 H new ATOM 1278 N SER A 80 84.792 2.918 3.352 1.00 0.00 N ATOM 1279 CA SER A 80 83.795 4.022 3.429 1.00 0.00 C ATOM 1280 C SER A 80 84.356 5.106 4.332 1.00 0.00 C ATOM 1281 O SER A 80 84.274 6.283 4.042 1.00 0.00 O ATOM 1282 CB SER A 80 82.489 3.491 4.021 1.00 0.00 C ATOM 1283 OG SER A 80 81.493 4.503 3.950 1.00 0.00 O ATOM 0 H SER A 80 84.510 2.054 3.815 1.00 0.00 H new ATOM 0 HA SER A 80 83.598 4.422 2.435 1.00 0.00 H new ATOM 0 HB2 SER A 80 82.163 2.605 3.475 1.00 0.00 H new ATOM 0 HB3 SER A 80 82.643 3.189 5.057 1.00 0.00 H new ATOM 0 HG SER A 80 80.914 4.338 3.177 1.00 0.00 H new ATOM 1289 N CYS A 81 84.960 4.709 5.413 1.00 0.00 N ATOM 1290 CA CYS A 81 85.563 5.705 6.324 1.00 0.00 C ATOM 1291 C CYS A 81 86.610 6.461 5.525 1.00 0.00 C ATOM 1292 O CYS A 81 86.768 7.659 5.652 1.00 0.00 O ATOM 1293 CB CYS A 81 86.222 4.995 7.509 1.00 0.00 C ATOM 1294 SG CYS A 81 87.182 6.190 8.473 1.00 0.00 S ATOM 0 H CYS A 81 85.060 3.736 5.702 1.00 0.00 H new ATOM 0 HA CYS A 81 84.806 6.385 6.715 1.00 0.00 H new ATOM 0 HB2 CYS A 81 85.461 4.532 8.138 1.00 0.00 H new ATOM 0 HB3 CYS A 81 86.871 4.195 7.152 1.00 0.00 H new ATOM 0 HG CYS A 81 87.029 5.947 9.741 1.00 0.00 H new ATOM 1300 N ILE A 82 87.313 5.764 4.673 1.00 0.00 N ATOM 1301 CA ILE A 82 88.336 6.452 3.836 1.00 0.00 C ATOM 1302 C ILE A 82 87.623 7.339 2.821 1.00 0.00 C ATOM 1303 O ILE A 82 88.041 8.446 2.546 1.00 0.00 O ATOM 1304 CB ILE A 82 89.216 5.422 3.122 1.00 0.00 C ATOM 1305 CG1 ILE A 82 90.111 4.732 4.152 1.00 0.00 C ATOM 1306 CG2 ILE A 82 90.090 6.119 2.070 1.00 0.00 C ATOM 1307 CD1 ILE A 82 90.810 3.539 3.502 1.00 0.00 C ATOM 0 H ILE A 82 87.225 4.759 4.522 1.00 0.00 H new ATOM 0 HA ILE A 82 88.979 7.065 4.468 1.00 0.00 H new ATOM 0 HB ILE A 82 88.584 4.686 2.626 1.00 0.00 H new ATOM 0 HG12 ILE A 82 90.850 5.435 4.536 1.00 0.00 H new ATOM 0 HG13 ILE A 82 89.515 4.399 5.002 1.00 0.00 H new ATOM 0 HG21 ILE A 82 90.713 5.380 1.567 1.00 0.00 H new ATOM 0 HG22 ILE A 82 89.453 6.615 1.338 1.00 0.00 H new ATOM 0 HG23 ILE A 82 90.726 6.858 2.557 1.00 0.00 H new ATOM 0 HD11 ILE A 82 91.448 3.047 4.236 1.00 0.00 H new ATOM 0 HD12 ILE A 82 90.063 2.833 3.139 1.00 0.00 H new ATOM 0 HD13 ILE A 82 91.418 3.885 2.666 1.00 0.00 H new ATOM 1319 N ALA A 83 86.545 6.870 2.262 1.00 0.00 N ATOM 1320 CA ALA A 83 85.812 7.703 1.278 1.00 0.00 C ATOM 1321 C ALA A 83 85.332 8.980 1.965 1.00 0.00 C ATOM 1322 O ALA A 83 85.524 10.066 1.474 1.00 0.00 O ATOM 1323 CB ALA A 83 84.610 6.934 0.745 1.00 0.00 C ATOM 0 H ALA A 83 86.143 5.950 2.444 1.00 0.00 H new ATOM 0 HA ALA A 83 86.474 7.953 0.449 1.00 0.00 H new ATOM 0 HB1 ALA A 83 84.075 7.550 0.023 1.00 0.00 H new ATOM 0 HB2 ALA A 83 84.949 6.019 0.260 1.00 0.00 H new ATOM 0 HB3 ALA A 83 83.944 6.682 1.570 1.00 0.00 H new ATOM 1329 N MET A 84 84.715 8.858 3.110 1.00 0.00 N ATOM 1330 CA MET A 84 84.236 10.074 3.826 1.00 0.00 C ATOM 1331 C MET A 84 85.447 10.897 4.243 1.00 0.00 C ATOM 1332 O MET A 84 85.411 12.111 4.266 1.00 0.00 O ATOM 1333 CB MET A 84 83.415 9.664 5.050 1.00 0.00 C ATOM 1334 CG MET A 84 82.092 9.055 4.579 1.00 0.00 C ATOM 1335 SD MET A 84 81.106 8.561 6.014 1.00 0.00 S ATOM 1336 CE MET A 84 82.188 7.226 6.588 1.00 0.00 C ATOM 0 H MET A 84 84.523 7.972 3.578 1.00 0.00 H new ATOM 0 HA MET A 84 83.599 10.671 3.174 1.00 0.00 H new ATOM 0 HB2 MET A 84 83.969 8.943 5.651 1.00 0.00 H new ATOM 0 HB3 MET A 84 83.226 10.530 5.685 1.00 0.00 H new ATOM 0 HG2 MET A 84 81.541 9.778 3.978 1.00 0.00 H new ATOM 0 HG3 MET A 84 82.284 8.191 3.942 1.00 0.00 H new ATOM 0 HE1 MET A 84 81.612 6.525 7.192 1.00 0.00 H new ATOM 0 HE2 MET A 84 82.609 6.704 5.729 1.00 0.00 H new ATOM 0 HE3 MET A 84 82.995 7.645 7.189 1.00 0.00 H new ATOM 1346 N MET A 85 86.532 10.247 4.541 1.00 0.00 N ATOM 1347 CA MET A 85 87.746 11.003 4.918 1.00 0.00 C ATOM 1348 C MET A 85 88.101 11.892 3.729 1.00 0.00 C ATOM 1349 O MET A 85 88.625 12.978 3.887 1.00 0.00 O ATOM 1350 CB MET A 85 88.892 10.030 5.218 1.00 0.00 C ATOM 1351 CG MET A 85 90.110 10.811 5.722 1.00 0.00 C ATOM 1352 SD MET A 85 89.740 11.556 7.334 1.00 0.00 S ATOM 1353 CE MET A 85 89.526 10.025 8.278 1.00 0.00 C ATOM 0 H MET A 85 86.628 9.232 4.539 1.00 0.00 H new ATOM 0 HA MET A 85 87.576 11.604 5.812 1.00 0.00 H new ATOM 0 HB2 MET A 85 88.578 9.303 5.967 1.00 0.00 H new ATOM 0 HB3 MET A 85 89.152 9.471 4.319 1.00 0.00 H new ATOM 0 HG2 MET A 85 90.970 10.146 5.807 1.00 0.00 H new ATOM 0 HG3 MET A 85 90.377 11.587 5.005 1.00 0.00 H new ATOM 0 HE1 MET A 85 90.024 10.120 9.243 1.00 0.00 H new ATOM 0 HE2 MET A 85 88.463 9.840 8.435 1.00 0.00 H new ATOM 0 HE3 MET A 85 89.962 9.193 7.725 1.00 0.00 H new ATOM 1363 N CYS A 86 87.793 11.449 2.531 1.00 0.00 N ATOM 1364 CA CYS A 86 88.090 12.290 1.334 1.00 0.00 C ATOM 1365 C CYS A 86 87.437 11.688 0.087 1.00 0.00 C ATOM 1366 O CYS A 86 88.105 11.153 -0.776 1.00 0.00 O ATOM 1367 CB CYS A 86 89.602 12.383 1.125 1.00 0.00 C ATOM 1368 SG CYS A 86 89.955 13.605 -0.164 1.00 0.00 S ATOM 0 H CYS A 86 87.353 10.550 2.335 1.00 0.00 H new ATOM 0 HA CYS A 86 87.685 13.288 1.500 1.00 0.00 H new ATOM 0 HB2 CYS A 86 90.092 12.668 2.056 1.00 0.00 H new ATOM 0 HB3 CYS A 86 90.002 11.410 0.839 1.00 0.00 H new ATOM 0 HG CYS A 86 91.240 13.688 -0.343 1.00 0.00 H new ATOM 1374 N ASN A 87 86.139 11.772 -0.017 1.00 0.00 N ATOM 1375 CA ASN A 87 85.449 11.205 -1.212 1.00 0.00 C ATOM 1376 C ASN A 87 85.695 12.108 -2.425 1.00 0.00 C ATOM 1377 O ASN A 87 85.938 11.638 -3.520 1.00 0.00 O ATOM 1378 CB ASN A 87 83.941 11.108 -0.945 1.00 0.00 C ATOM 1379 CG ASN A 87 83.358 12.504 -0.700 1.00 0.00 C ATOM 1380 OD1 ASN A 87 84.050 13.383 -0.028 1.00 0.00 O flip ATOM 1381 ND2 ASN A 87 82.256 12.796 -1.121 1.00 0.00 N flip ATOM 0 H ASN A 87 85.526 12.208 0.672 1.00 0.00 H new ATOM 0 HA ASN A 87 85.844 10.209 -1.413 1.00 0.00 H new ATOM 0 HB2 ASN A 87 83.443 10.641 -1.795 1.00 0.00 H new ATOM 0 HB3 ASN A 87 83.757 10.472 -0.079 1.00 0.00 H new ATOM 0 HD21 ASN A 87 81.713 12.111 -1.647 1.00 0.00 H new ATOM 0 HD22 ASN A 87 81.874 13.726 -0.949 1.00 0.00 H new ATOM 1388 N GLU A 88 85.636 13.400 -2.238 1.00 0.00 N ATOM 1389 CA GLU A 88 85.866 14.336 -3.377 1.00 0.00 C ATOM 1390 C GLU A 88 86.056 15.758 -2.839 1.00 0.00 C ATOM 1391 O GLU A 88 86.842 16.528 -3.354 1.00 0.00 O ATOM 1392 CB GLU A 88 84.662 14.288 -4.327 1.00 0.00 C ATOM 1393 CG GLU A 88 83.407 14.788 -3.603 1.00 0.00 C ATOM 1394 CD GLU A 88 82.184 14.589 -4.502 1.00 0.00 C ATOM 1395 OE1 GLU A 88 82.369 14.447 -5.700 1.00 0.00 O ATOM 1396 OE2 GLU A 88 81.083 14.578 -3.976 1.00 0.00 O ATOM 0 H GLU A 88 85.438 13.848 -1.343 1.00 0.00 H new ATOM 0 HA GLU A 88 86.762 14.040 -3.922 1.00 0.00 H new ATOM 0 HB2 GLU A 88 84.856 14.904 -5.205 1.00 0.00 H new ATOM 0 HB3 GLU A 88 84.507 13.269 -4.681 1.00 0.00 H new ATOM 0 HG2 GLU A 88 83.275 14.246 -2.666 1.00 0.00 H new ATOM 0 HG3 GLU A 88 83.517 15.842 -3.349 1.00 0.00 H new ATOM 1403 N PHE A 89 85.342 16.110 -1.804 1.00 0.00 N ATOM 1404 CA PHE A 89 85.477 17.480 -1.231 1.00 0.00 C ATOM 1405 C PHE A 89 86.870 17.648 -0.624 1.00 0.00 C ATOM 1406 O PHE A 89 87.412 16.744 -0.019 1.00 0.00 O ATOM 1407 CB PHE A 89 84.416 17.694 -0.151 1.00 0.00 C ATOM 1408 CG PHE A 89 83.054 17.754 -0.796 1.00 0.00 C ATOM 1409 CD1 PHE A 89 82.539 18.980 -1.235 1.00 0.00 C ATOM 1410 CD2 PHE A 89 82.303 16.584 -0.951 1.00 0.00 C ATOM 1411 CE1 PHE A 89 81.273 19.035 -1.829 1.00 0.00 C ATOM 1412 CE2 PHE A 89 81.037 16.638 -1.546 1.00 0.00 C ATOM 1413 CZ PHE A 89 80.521 17.863 -1.985 1.00 0.00 C ATOM 0 H PHE A 89 84.670 15.507 -1.330 1.00 0.00 H new ATOM 0 HA PHE A 89 85.337 18.216 -2.023 1.00 0.00 H new ATOM 0 HB2 PHE A 89 84.452 16.883 0.576 1.00 0.00 H new ATOM 0 HB3 PHE A 89 84.615 18.618 0.393 1.00 0.00 H new ATOM 0 HD1 PHE A 89 83.119 19.883 -1.115 1.00 0.00 H new ATOM 0 HD2 PHE A 89 82.700 15.639 -0.612 1.00 0.00 H new ATOM 0 HE1 PHE A 89 80.876 19.981 -2.167 1.00 0.00 H new ATOM 0 HE2 PHE A 89 80.458 15.734 -1.666 1.00 0.00 H new ATOM 0 HZ PHE A 89 79.544 17.905 -2.444 1.00 0.00 H new ATOM 1423 N PHE A 90 87.454 18.802 -0.789 1.00 0.00 N ATOM 1424 CA PHE A 90 88.814 19.045 -0.235 1.00 0.00 C ATOM 1425 C PHE A 90 88.716 19.428 1.243 1.00 0.00 C ATOM 1426 O PHE A 90 89.711 19.513 1.936 1.00 0.00 O ATOM 1427 CB PHE A 90 89.478 20.185 -1.010 1.00 0.00 C ATOM 1428 CG PHE A 90 88.555 21.379 -1.022 1.00 0.00 C ATOM 1429 CD1 PHE A 90 88.630 22.336 -0.002 1.00 0.00 C ATOM 1430 CD2 PHE A 90 87.624 21.528 -2.056 1.00 0.00 C ATOM 1431 CE1 PHE A 90 87.770 23.442 -0.018 1.00 0.00 C ATOM 1432 CE2 PHE A 90 86.764 22.632 -2.072 1.00 0.00 C ATOM 1433 CZ PHE A 90 86.836 23.589 -1.052 1.00 0.00 C ATOM 0 H PHE A 90 87.044 19.592 -1.287 1.00 0.00 H new ATOM 0 HA PHE A 90 89.408 18.136 -0.330 1.00 0.00 H new ATOM 0 HB2 PHE A 90 90.429 20.450 -0.548 1.00 0.00 H new ATOM 0 HB3 PHE A 90 89.697 19.869 -2.030 1.00 0.00 H new ATOM 0 HD1 PHE A 90 89.349 22.222 0.795 1.00 0.00 H new ATOM 0 HD2 PHE A 90 87.569 20.790 -2.843 1.00 0.00 H new ATOM 0 HE1 PHE A 90 87.827 24.182 0.767 1.00 0.00 H new ATOM 0 HE2 PHE A 90 86.045 22.746 -2.870 1.00 0.00 H new ATOM 0 HZ PHE A 90 86.172 24.440 -1.062 1.00 0.00 H new ATOM 1443 N GLU A 91 87.533 19.673 1.737 1.00 0.00 N ATOM 1444 CA GLU A 91 87.404 20.062 3.171 1.00 0.00 C ATOM 1445 C GLU A 91 88.045 18.983 4.051 1.00 0.00 C ATOM 1446 O GLU A 91 87.690 17.822 3.994 1.00 0.00 O ATOM 1447 CB GLU A 91 85.922 20.209 3.539 1.00 0.00 C ATOM 1448 CG GLU A 91 85.324 21.458 2.872 1.00 0.00 C ATOM 1449 CD GLU A 91 84.971 21.155 1.413 1.00 0.00 C ATOM 1450 OE1 GLU A 91 85.886 21.035 0.615 1.00 0.00 O ATOM 1451 OE2 GLU A 91 83.792 21.044 1.120 1.00 0.00 O ATOM 0 H GLU A 91 86.658 19.622 1.216 1.00 0.00 H new ATOM 0 HA GLU A 91 87.910 21.014 3.333 1.00 0.00 H new ATOM 0 HB2 GLU A 91 85.373 19.322 3.223 1.00 0.00 H new ATOM 0 HB3 GLU A 91 85.815 20.281 4.621 1.00 0.00 H new ATOM 0 HG2 GLU A 91 84.432 21.777 3.412 1.00 0.00 H new ATOM 0 HG3 GLU A 91 86.036 22.282 2.919 1.00 0.00 H new ATOM 1458 N GLY A 92 88.994 19.367 4.866 1.00 0.00 N ATOM 1459 CA GLY A 92 89.678 18.385 5.760 1.00 0.00 C ATOM 1460 C GLY A 92 88.926 18.272 7.089 1.00 0.00 C ATOM 1461 O GLY A 92 89.418 17.695 8.040 1.00 0.00 O ATOM 0 H GLY A 92 89.327 20.327 4.951 1.00 0.00 H new ATOM 0 HA2 GLY A 92 89.724 17.410 5.275 1.00 0.00 H new ATOM 0 HA3 GLY A 92 90.706 18.700 5.940 1.00 0.00 H new ATOM 1465 N PHE A 93 87.747 18.825 7.176 1.00 0.00 N ATOM 1466 CA PHE A 93 86.993 18.747 8.460 1.00 0.00 C ATOM 1467 C PHE A 93 86.529 17.296 8.696 1.00 0.00 C ATOM 1468 O PHE A 93 86.310 16.563 7.751 1.00 0.00 O ATOM 1469 CB PHE A 93 85.775 19.678 8.389 1.00 0.00 C ATOM 1470 CG PHE A 93 86.221 21.111 8.589 1.00 0.00 C ATOM 1471 CD1 PHE A 93 86.353 21.627 9.884 1.00 0.00 C ATOM 1472 CD2 PHE A 93 86.505 21.919 7.483 1.00 0.00 C ATOM 1473 CE1 PHE A 93 86.767 22.951 10.072 1.00 0.00 C ATOM 1474 CE2 PHE A 93 86.919 23.242 7.670 1.00 0.00 C ATOM 1475 CZ PHE A 93 87.050 23.759 8.963 1.00 0.00 C ATOM 0 H PHE A 93 87.276 19.323 6.421 1.00 0.00 H new ATOM 0 HA PHE A 93 87.636 19.055 9.284 1.00 0.00 H new ATOM 0 HB2 PHE A 93 85.279 19.572 7.424 1.00 0.00 H new ATOM 0 HB3 PHE A 93 85.048 19.402 9.153 1.00 0.00 H new ATOM 0 HD1 PHE A 93 86.135 21.003 10.738 1.00 0.00 H new ATOM 0 HD2 PHE A 93 86.405 21.521 6.484 1.00 0.00 H new ATOM 0 HE1 PHE A 93 86.868 23.349 11.071 1.00 0.00 H new ATOM 0 HE2 PHE A 93 87.138 23.865 6.815 1.00 0.00 H new ATOM 0 HZ PHE A 93 87.369 24.781 9.106 1.00 0.00 H new ATOM 1485 N PRO A 94 86.385 16.863 9.938 1.00 0.00 N ATOM 1486 CA PRO A 94 85.945 15.462 10.217 1.00 0.00 C ATOM 1487 C PRO A 94 84.502 15.193 9.769 1.00 0.00 C ATOM 1488 O PRO A 94 83.560 15.513 10.468 1.00 0.00 O ATOM 1489 CB PRO A 94 86.075 15.373 11.749 1.00 0.00 C ATOM 1490 CG PRO A 94 86.175 16.807 12.292 1.00 0.00 C ATOM 1491 CD PRO A 94 86.642 17.712 11.142 1.00 0.00 C ATOM 0 HA PRO A 94 86.535 14.723 9.675 1.00 0.00 H new ATOM 0 HB2 PRO A 94 85.213 14.861 12.177 1.00 0.00 H new ATOM 0 HB3 PRO A 94 86.958 14.797 12.025 1.00 0.00 H new ATOM 0 HG2 PRO A 94 85.209 17.140 12.672 1.00 0.00 H new ATOM 0 HG3 PRO A 94 86.878 16.853 13.124 1.00 0.00 H new ATOM 0 HD2 PRO A 94 86.081 18.646 11.107 1.00 0.00 H new ATOM 0 HD3 PRO A 94 87.695 17.976 11.235 1.00 0.00 H new ATOM 1499 N ASP A 95 84.330 14.594 8.620 1.00 0.00 N ATOM 1500 CA ASP A 95 82.955 14.278 8.120 1.00 0.00 C ATOM 1501 C ASP A 95 82.737 12.763 8.174 1.00 0.00 C ATOM 1502 O ASP A 95 81.825 12.238 7.566 1.00 0.00 O ATOM 1503 CB ASP A 95 82.819 14.753 6.672 1.00 0.00 C ATOM 1504 CG ASP A 95 83.788 13.970 5.785 1.00 0.00 C ATOM 1505 OD1 ASP A 95 84.732 13.413 6.320 1.00 0.00 O ATOM 1506 OD2 ASP A 95 83.569 13.939 4.585 1.00 0.00 O ATOM 0 H ASP A 95 85.088 14.307 8.000 1.00 0.00 H new ATOM 0 HA ASP A 95 82.215 14.782 8.742 1.00 0.00 H new ATOM 0 HB2 ASP A 95 81.795 14.610 6.326 1.00 0.00 H new ATOM 0 HB3 ASP A 95 83.031 15.820 6.607 1.00 0.00 H new ATOM 1511 N LYS A 96 83.570 12.053 8.892 1.00 0.00 N ATOM 1512 CA LYS A 96 83.404 10.574 8.971 1.00 0.00 C ATOM 1513 C LYS A 96 82.212 10.236 9.873 1.00 0.00 C ATOM 1514 O LYS A 96 81.070 10.370 9.482 1.00 0.00 O ATOM 1515 CB LYS A 96 84.686 9.932 9.527 1.00 0.00 C ATOM 1516 CG LYS A 96 85.289 10.807 10.632 1.00 0.00 C ATOM 1517 CD LYS A 96 86.396 10.022 11.342 1.00 0.00 C ATOM 1518 CE LYS A 96 87.105 10.919 12.358 1.00 0.00 C ATOM 1519 NZ LYS A 96 88.231 10.163 12.980 1.00 0.00 N ATOM 0 H LYS A 96 84.353 12.433 9.424 1.00 0.00 H new ATOM 0 HA LYS A 96 83.218 10.179 7.972 1.00 0.00 H new ATOM 0 HB2 LYS A 96 84.462 8.941 9.921 1.00 0.00 H new ATOM 0 HB3 LYS A 96 85.411 9.799 8.724 1.00 0.00 H new ATOM 0 HG2 LYS A 96 85.693 11.726 10.206 1.00 0.00 H new ATOM 0 HG3 LYS A 96 84.517 11.098 11.345 1.00 0.00 H new ATOM 0 HD2 LYS A 96 85.972 9.153 11.845 1.00 0.00 H new ATOM 0 HD3 LYS A 96 87.114 9.648 10.612 1.00 0.00 H new ATOM 0 HE2 LYS A 96 87.481 11.817 11.868 1.00 0.00 H new ATOM 0 HE3 LYS A 96 86.403 11.245 13.125 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 88.716 10.769 13.672 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 87.859 9.319 13.460 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 88.904 9.873 12.242 1.00 0.00 H new ATOM 1653 N ALA B 2 97.814 2.274 -13.183 1.00 0.00 N ATOM 1654 CA ALA B 2 97.261 2.838 -11.915 1.00 0.00 C ATOM 1655 C ALA B 2 96.261 1.846 -11.321 1.00 0.00 C ATOM 1656 O ALA B 2 95.774 0.963 -11.999 1.00 0.00 O ATOM 1657 CB ALA B 2 96.555 4.166 -12.206 1.00 0.00 C ATOM 0 HA ALA B 2 98.072 3.012 -11.207 1.00 0.00 H new ATOM 0 HB1 ALA B 2 96.153 4.575 -11.279 1.00 0.00 H new ATOM 0 HB2 ALA B 2 97.268 4.871 -12.634 1.00 0.00 H new ATOM 0 HB3 ALA B 2 95.742 3.999 -12.912 1.00 0.00 H new ATOM 1663 N CYS B 3 95.953 1.977 -10.062 1.00 0.00 N ATOM 1664 CA CYS B 3 94.986 1.037 -9.433 1.00 0.00 C ATOM 1665 C CYS B 3 93.550 1.461 -9.816 1.00 0.00 C ATOM 1666 O CYS B 3 93.184 2.600 -9.604 1.00 0.00 O ATOM 1667 CB CYS B 3 95.142 1.113 -7.913 1.00 0.00 C ATOM 1668 SG CYS B 3 96.794 0.538 -7.448 1.00 0.00 S ATOM 0 H CYS B 3 96.329 2.694 -9.442 1.00 0.00 H new ATOM 0 HA CYS B 3 95.175 0.020 -9.777 1.00 0.00 H new ATOM 0 HB2 CYS B 3 94.992 2.137 -7.572 1.00 0.00 H new ATOM 0 HB3 CYS B 3 94.382 0.501 -7.427 1.00 0.00 H new ATOM 0 HG CYS B 3 96.971 0.713 -6.172 1.00 0.00 H new ATOM 1674 N PRO B 4 92.723 0.586 -10.368 1.00 0.00 N ATOM 1675 CA PRO B 4 91.332 0.985 -10.738 1.00 0.00 C ATOM 1676 C PRO B 4 90.439 1.159 -9.504 1.00 0.00 C ATOM 1677 O PRO B 4 89.360 1.713 -9.577 1.00 0.00 O ATOM 1678 CB PRO B 4 90.871 -0.201 -11.596 1.00 0.00 C ATOM 1679 CG PRO B 4 91.777 -1.392 -11.255 1.00 0.00 C ATOM 1680 CD PRO B 4 93.086 -0.834 -10.671 1.00 0.00 C ATOM 0 HA PRO B 4 91.282 1.946 -11.250 1.00 0.00 H new ATOM 0 HB2 PRO B 4 89.828 -0.441 -11.391 1.00 0.00 H new ATOM 0 HB3 PRO B 4 90.939 0.042 -12.656 1.00 0.00 H new ATOM 0 HG2 PRO B 4 91.288 -2.051 -10.537 1.00 0.00 H new ATOM 0 HG3 PRO B 4 91.979 -1.986 -12.146 1.00 0.00 H new ATOM 0 HD2 PRO B 4 93.394 -1.374 -9.776 1.00 0.00 H new ATOM 0 HD3 PRO B 4 93.909 -0.900 -11.383 1.00 0.00 H new ATOM 1688 N LEU B 5 90.886 0.690 -8.375 1.00 0.00 N ATOM 1689 CA LEU B 5 90.070 0.830 -7.142 1.00 0.00 C ATOM 1690 C LEU B 5 89.849 2.318 -6.895 1.00 0.00 C ATOM 1691 O LEU B 5 88.783 2.751 -6.508 1.00 0.00 O ATOM 1692 CB LEU B 5 90.810 0.201 -5.958 1.00 0.00 C ATOM 1693 CG LEU B 5 89.975 0.338 -4.675 1.00 0.00 C ATOM 1694 CD1 LEU B 5 88.636 -0.406 -4.830 1.00 0.00 C ATOM 1695 CD2 LEU B 5 90.760 -0.260 -3.504 1.00 0.00 C ATOM 0 H LEU B 5 91.781 0.216 -8.254 1.00 0.00 H new ATOM 0 HA LEU B 5 89.112 0.322 -7.255 1.00 0.00 H new ATOM 0 HB2 LEU B 5 91.007 -0.852 -6.161 1.00 0.00 H new ATOM 0 HB3 LEU B 5 91.777 0.687 -5.825 1.00 0.00 H new ATOM 0 HG LEU B 5 89.771 1.392 -4.488 1.00 0.00 H new ATOM 0 HD11 LEU B 5 88.054 -0.302 -3.915 1.00 0.00 H new ATOM 0 HD12 LEU B 5 88.079 0.018 -5.665 1.00 0.00 H new ATOM 0 HD13 LEU B 5 88.827 -1.462 -5.020 1.00 0.00 H new ATOM 0 HD21 LEU B 5 90.175 -0.167 -2.589 1.00 0.00 H new ATOM 0 HD22 LEU B 5 90.961 -1.313 -3.701 1.00 0.00 H new ATOM 0 HD23 LEU B 5 91.703 0.274 -3.388 1.00 0.00 H new ATOM 1707 N GLU B 6 90.864 3.102 -7.122 1.00 0.00 N ATOM 1708 CA GLU B 6 90.745 4.566 -6.911 1.00 0.00 C ATOM 1709 C GLU B 6 89.643 5.126 -7.816 1.00 0.00 C ATOM 1710 O GLU B 6 88.779 5.860 -7.381 1.00 0.00 O ATOM 1711 CB GLU B 6 92.074 5.217 -7.295 1.00 0.00 C ATOM 1712 CG GLU B 6 93.147 4.847 -6.269 1.00 0.00 C ATOM 1713 CD GLU B 6 94.485 5.468 -6.679 1.00 0.00 C ATOM 1714 OE1 GLU B 6 94.549 6.033 -7.759 1.00 0.00 O ATOM 1715 OE2 GLU B 6 95.422 5.361 -5.907 1.00 0.00 O ATOM 0 H GLU B 6 91.778 2.786 -7.447 1.00 0.00 H new ATOM 0 HA GLU B 6 90.501 4.773 -5.869 1.00 0.00 H new ATOM 0 HB2 GLU B 6 92.378 4.886 -8.288 1.00 0.00 H new ATOM 0 HB3 GLU B 6 91.959 6.300 -7.341 1.00 0.00 H new ATOM 0 HG2 GLU B 6 92.857 5.203 -5.280 1.00 0.00 H new ATOM 0 HG3 GLU B 6 93.243 3.763 -6.202 1.00 0.00 H new ATOM 1722 N LYS B 7 89.669 4.780 -9.073 1.00 0.00 N ATOM 1723 CA LYS B 7 88.629 5.280 -10.013 1.00 0.00 C ATOM 1724 C LYS B 7 87.302 4.607 -9.694 1.00 0.00 C ATOM 1725 O LYS B 7 86.270 5.241 -9.636 1.00 0.00 O ATOM 1726 CB LYS B 7 89.040 4.944 -11.444 1.00 0.00 C ATOM 1727 CG LYS B 7 87.979 5.456 -12.420 1.00 0.00 C ATOM 1728 CD LYS B 7 88.490 5.306 -13.859 1.00 0.00 C ATOM 1729 CE LYS B 7 88.704 3.821 -14.185 1.00 0.00 C ATOM 1730 NZ LYS B 7 88.716 3.626 -15.664 1.00 0.00 N ATOM 0 H LYS B 7 90.370 4.169 -9.491 1.00 0.00 H new ATOM 0 HA LYS B 7 88.525 6.360 -9.909 1.00 0.00 H new ATOM 0 HB2 LYS B 7 90.005 5.397 -11.671 1.00 0.00 H new ATOM 0 HB3 LYS B 7 89.160 3.866 -11.555 1.00 0.00 H new ATOM 0 HG2 LYS B 7 87.052 4.897 -12.292 1.00 0.00 H new ATOM 0 HG3 LYS B 7 87.752 6.501 -12.211 1.00 0.00 H new ATOM 0 HD2 LYS B 7 87.773 5.741 -14.556 1.00 0.00 H new ATOM 0 HD3 LYS B 7 89.425 5.853 -13.981 1.00 0.00 H new ATOM 0 HE2 LYS B 7 89.645 3.477 -13.756 1.00 0.00 H new ATOM 0 HE3 LYS B 7 87.911 3.223 -13.736 1.00 0.00 H new ATOM 0 HZ1 LYS B 7 88.861 2.619 -15.880 1.00 0.00 H new ATOM 0 HZ2 LYS B 7 87.808 3.938 -16.063 1.00 0.00 H new ATOM 0 HZ3 LYS B 7 89.488 4.184 -16.082 1.00 0.00 H new ATOM 1744 N ALA B 8 87.318 3.323 -9.465 1.00 0.00 N ATOM 1745 CA ALA B 8 86.049 2.639 -9.128 1.00 0.00 C ATOM 1746 C ALA B 8 85.527 3.289 -7.862 1.00 0.00 C ATOM 1747 O ALA B 8 84.357 3.580 -7.726 1.00 0.00 O ATOM 1748 CB ALA B 8 86.284 1.148 -8.915 1.00 0.00 C ATOM 0 H ALA B 8 88.146 2.728 -9.497 1.00 0.00 H new ATOM 0 HA ALA B 8 85.326 2.734 -9.938 1.00 0.00 H new ATOM 0 HB1 ALA B 8 85.340 0.662 -8.668 1.00 0.00 H new ATOM 0 HB2 ALA B 8 86.690 0.710 -9.827 1.00 0.00 H new ATOM 0 HB3 ALA B 8 86.990 1.004 -8.098 1.00 0.00 H new ATOM 1754 N LEU B 9 86.408 3.587 -6.950 1.00 0.00 N ATOM 1755 CA LEU B 9 85.965 4.289 -5.728 1.00 0.00 C ATOM 1756 C LEU B 9 85.359 5.603 -6.200 1.00 0.00 C ATOM 1757 O LEU B 9 84.335 6.043 -5.719 1.00 0.00 O ATOM 1758 CB LEU B 9 87.159 4.558 -4.804 1.00 0.00 C ATOM 1759 CG LEU B 9 86.694 5.287 -3.535 1.00 0.00 C ATOM 1760 CD1 LEU B 9 85.701 4.419 -2.746 1.00 0.00 C ATOM 1761 CD2 LEU B 9 87.918 5.594 -2.667 1.00 0.00 C ATOM 0 H LEU B 9 87.404 3.375 -7.001 1.00 0.00 H new ATOM 0 HA LEU B 9 85.247 3.694 -5.164 1.00 0.00 H new ATOM 0 HB2 LEU B 9 87.640 3.617 -4.536 1.00 0.00 H new ATOM 0 HB3 LEU B 9 87.904 5.159 -5.326 1.00 0.00 H new ATOM 0 HG LEU B 9 86.191 6.213 -3.815 1.00 0.00 H new ATOM 0 HD11 LEU B 9 85.383 4.953 -1.850 1.00 0.00 H new ATOM 0 HD12 LEU B 9 84.832 4.204 -3.368 1.00 0.00 H new ATOM 0 HD13 LEU B 9 86.183 3.484 -2.459 1.00 0.00 H new ATOM 0 HD21 LEU B 9 87.601 6.112 -1.762 1.00 0.00 H new ATOM 0 HD22 LEU B 9 88.415 4.662 -2.397 1.00 0.00 H new ATOM 0 HD23 LEU B 9 88.610 6.226 -3.224 1.00 0.00 H new ATOM 1773 N ASP B 10 85.981 6.213 -7.178 1.00 0.00 N ATOM 1774 CA ASP B 10 85.435 7.480 -7.729 1.00 0.00 C ATOM 1775 C ASP B 10 84.129 7.170 -8.457 1.00 0.00 C ATOM 1776 O ASP B 10 83.207 7.951 -8.439 1.00 0.00 O ATOM 1777 CB ASP B 10 86.439 8.113 -8.699 1.00 0.00 C ATOM 1778 CG ASP B 10 86.030 9.559 -8.985 1.00 0.00 C ATOM 1779 OD1 ASP B 10 84.852 9.854 -8.876 1.00 0.00 O ATOM 1780 OD2 ASP B 10 86.904 10.345 -9.311 1.00 0.00 O ATOM 0 H ASP B 10 86.842 5.885 -7.615 1.00 0.00 H new ATOM 0 HA ASP B 10 85.251 8.185 -6.919 1.00 0.00 H new ATOM 0 HB2 ASP B 10 87.441 8.085 -8.271 1.00 0.00 H new ATOM 0 HB3 ASP B 10 86.473 7.543 -9.627 1.00 0.00 H new ATOM 1785 N VAL B 11 84.032 6.031 -9.095 1.00 0.00 N ATOM 1786 CA VAL B 11 82.762 5.701 -9.807 1.00 0.00 C ATOM 1787 C VAL B 11 81.623 5.679 -8.787 1.00 0.00 C ATOM 1788 O VAL B 11 80.542 6.172 -9.038 1.00 0.00 O ATOM 1789 CB VAL B 11 82.874 4.321 -10.467 1.00 0.00 C ATOM 1790 CG1 VAL B 11 81.505 3.873 -10.982 1.00 0.00 C ATOM 1791 CG2 VAL B 11 83.865 4.381 -11.635 1.00 0.00 C ATOM 0 H VAL B 11 84.766 5.325 -9.153 1.00 0.00 H new ATOM 0 HA VAL B 11 82.569 6.448 -10.577 1.00 0.00 H new ATOM 0 HB VAL B 11 83.230 3.605 -9.726 1.00 0.00 H new ATOM 0 HG11 VAL B 11 81.595 2.892 -11.449 1.00 0.00 H new ATOM 0 HG12 VAL B 11 80.804 3.816 -10.149 1.00 0.00 H new ATOM 0 HG13 VAL B 11 81.139 4.592 -11.715 1.00 0.00 H new ATOM 0 HG21 VAL B 11 83.940 3.398 -12.099 1.00 0.00 H new ATOM 0 HG22 VAL B 11 83.516 5.105 -12.372 1.00 0.00 H new ATOM 0 HG23 VAL B 11 84.845 4.683 -11.266 1.00 0.00 H new ATOM 1801 N MET B 12 81.858 5.118 -7.631 1.00 0.00 N ATOM 1802 CA MET B 12 80.783 5.081 -6.598 1.00 0.00 C ATOM 1803 C MET B 12 80.389 6.518 -6.264 1.00 0.00 C ATOM 1804 O MET B 12 79.231 6.848 -6.116 1.00 0.00 O ATOM 1805 CB MET B 12 81.314 4.400 -5.333 1.00 0.00 C ATOM 1806 CG MET B 12 81.519 2.904 -5.591 1.00 0.00 C ATOM 1807 SD MET B 12 82.612 2.203 -4.324 1.00 0.00 S ATOM 1808 CE MET B 12 81.842 2.975 -2.879 1.00 0.00 C ATOM 0 H MET B 12 82.741 4.687 -7.359 1.00 0.00 H new ATOM 0 HA MET B 12 79.922 4.527 -6.972 1.00 0.00 H new ATOM 0 HB2 MET B 12 82.256 4.858 -5.031 1.00 0.00 H new ATOM 0 HB3 MET B 12 80.613 4.543 -4.511 1.00 0.00 H new ATOM 0 HG2 MET B 12 80.558 2.389 -5.580 1.00 0.00 H new ATOM 0 HG3 MET B 12 81.951 2.752 -6.580 1.00 0.00 H new ATOM 0 HE1 MET B 12 82.144 2.442 -1.977 1.00 0.00 H new ATOM 0 HE2 MET B 12 82.160 4.015 -2.810 1.00 0.00 H new ATOM 0 HE3 MET B 12 80.757 2.933 -2.979 1.00 0.00 H new ATOM 1818 N VAL B 13 81.364 7.369 -6.135 1.00 0.00 N ATOM 1819 CA VAL B 13 81.099 8.797 -5.805 1.00 0.00 C ATOM 1820 C VAL B 13 80.656 9.573 -7.052 1.00 0.00 C ATOM 1821 O VAL B 13 79.795 10.428 -6.988 1.00 0.00 O ATOM 1822 CB VAL B 13 82.380 9.402 -5.248 1.00 0.00 C ATOM 1823 CG1 VAL B 13 82.134 10.858 -4.860 1.00 0.00 C ATOM 1824 CG2 VAL B 13 82.801 8.594 -4.022 1.00 0.00 C ATOM 0 H VAL B 13 82.350 7.133 -6.246 1.00 0.00 H new ATOM 0 HA VAL B 13 80.296 8.858 -5.070 1.00 0.00 H new ATOM 0 HB VAL B 13 83.170 9.372 -5.999 1.00 0.00 H new ATOM 0 HG11 VAL B 13 83.053 11.289 -4.462 1.00 0.00 H new ATOM 0 HG12 VAL B 13 81.821 11.421 -5.739 1.00 0.00 H new ATOM 0 HG13 VAL B 13 81.352 10.905 -4.102 1.00 0.00 H new ATOM 0 HG21 VAL B 13 83.718 9.012 -3.608 1.00 0.00 H new ATOM 0 HG22 VAL B 13 82.012 8.635 -3.271 1.00 0.00 H new ATOM 0 HG23 VAL B 13 82.973 7.557 -4.311 1.00 0.00 H new ATOM 1834 N SER B 14 81.252 9.301 -8.181 1.00 0.00 N ATOM 1835 CA SER B 14 80.883 10.043 -9.421 1.00 0.00 C ATOM 1836 C SER B 14 79.401 9.828 -9.725 1.00 0.00 C ATOM 1837 O SER B 14 78.664 10.771 -9.940 1.00 0.00 O ATOM 1838 CB SER B 14 81.723 9.523 -10.588 1.00 0.00 C ATOM 1839 OG SER B 14 81.507 10.348 -11.727 1.00 0.00 O ATOM 0 H SER B 14 81.980 8.596 -8.299 1.00 0.00 H new ATOM 0 HA SER B 14 81.071 11.107 -9.279 1.00 0.00 H new ATOM 0 HB2 SER B 14 82.779 9.524 -10.319 1.00 0.00 H new ATOM 0 HB3 SER B 14 81.452 8.492 -10.815 1.00 0.00 H new ATOM 0 HG SER B 14 82.045 10.018 -12.477 1.00 0.00 H new ATOM 1845 N THR B 15 78.945 8.607 -9.732 1.00 0.00 N ATOM 1846 CA THR B 15 77.499 8.376 -10.006 1.00 0.00 C ATOM 1847 C THR B 15 76.674 9.102 -8.936 1.00 0.00 C ATOM 1848 O THR B 15 75.674 9.728 -9.219 1.00 0.00 O ATOM 1849 CB THR B 15 77.211 6.866 -9.994 1.00 0.00 C ATOM 1850 OG1 THR B 15 76.040 6.609 -10.754 1.00 0.00 O ATOM 1851 CG2 THR B 15 77.017 6.349 -8.562 1.00 0.00 C ATOM 0 H THR B 15 79.502 7.769 -9.562 1.00 0.00 H new ATOM 0 HA THR B 15 77.228 8.766 -10.987 1.00 0.00 H new ATOM 0 HB THR B 15 78.065 6.347 -10.430 1.00 0.00 H new ATOM 0 HG1 THR B 15 75.466 5.980 -10.268 1.00 0.00 H new ATOM 0 HG21 THR B 15 76.815 5.278 -8.586 1.00 0.00 H new ATOM 0 HG22 THR B 15 77.921 6.535 -7.982 1.00 0.00 H new ATOM 0 HG23 THR B 15 76.177 6.866 -8.099 1.00 0.00 H new ATOM 1859 N PHE B 16 77.110 9.017 -7.709 1.00 0.00 N ATOM 1860 CA PHE B 16 76.389 9.689 -6.583 1.00 0.00 C ATOM 1861 C PHE B 16 76.343 11.194 -6.845 1.00 0.00 C ATOM 1862 O PHE B 16 75.354 11.855 -6.595 1.00 0.00 O ATOM 1863 CB PHE B 16 77.159 9.433 -5.280 1.00 0.00 C ATOM 1864 CG PHE B 16 76.453 10.082 -4.108 1.00 0.00 C ATOM 1865 CD1 PHE B 16 76.619 11.451 -3.847 1.00 0.00 C ATOM 1866 CD2 PHE B 16 75.647 9.305 -3.267 1.00 0.00 C ATOM 1867 CE1 PHE B 16 75.977 12.036 -2.747 1.00 0.00 C ATOM 1868 CE2 PHE B 16 75.006 9.891 -2.171 1.00 0.00 C ATOM 1869 CZ PHE B 16 75.170 11.256 -1.909 1.00 0.00 C ATOM 0 H PHE B 16 77.947 8.504 -7.432 1.00 0.00 H new ATOM 0 HA PHE B 16 75.375 9.297 -6.503 1.00 0.00 H new ATOM 0 HB2 PHE B 16 77.249 8.360 -5.109 1.00 0.00 H new ATOM 0 HB3 PHE B 16 78.171 9.828 -5.366 1.00 0.00 H new ATOM 0 HD1 PHE B 16 77.241 12.053 -4.493 1.00 0.00 H new ATOM 0 HD2 PHE B 16 75.520 8.251 -3.465 1.00 0.00 H new ATOM 0 HE1 PHE B 16 76.105 13.089 -2.545 1.00 0.00 H new ATOM 0 HE2 PHE B 16 74.383 9.289 -1.526 1.00 0.00 H new ATOM 0 HZ PHE B 16 74.675 11.707 -1.062 1.00 0.00 H new ATOM 1879 N HIS B 17 77.419 11.734 -7.340 1.00 0.00 N ATOM 1880 CA HIS B 17 77.477 13.195 -7.620 1.00 0.00 C ATOM 1881 C HIS B 17 76.527 13.542 -8.763 1.00 0.00 C ATOM 1882 O HIS B 17 76.025 14.645 -8.847 1.00 0.00 O ATOM 1883 CB HIS B 17 78.906 13.578 -8.008 1.00 0.00 C ATOM 1884 CG HIS B 17 79.066 15.072 -7.945 1.00 0.00 C ATOM 1885 ND1 HIS B 17 78.859 15.886 -9.050 1.00 0.00 N ATOM 1886 CD2 HIS B 17 79.417 15.914 -6.919 1.00 0.00 C ATOM 1887 CE1 HIS B 17 79.086 17.157 -8.666 1.00 0.00 C ATOM 1888 NE2 HIS B 17 79.429 17.226 -7.378 1.00 0.00 N ATOM 0 H HIS B 17 78.271 11.220 -7.565 1.00 0.00 H new ATOM 0 HA HIS B 17 77.178 13.746 -6.728 1.00 0.00 H new ATOM 0 HB2 HIS B 17 79.617 13.098 -7.335 1.00 0.00 H new ATOM 0 HB3 HIS B 17 79.128 13.221 -9.014 1.00 0.00 H new ATOM 0 HD2 HIS B 17 79.648 15.605 -5.910 1.00 0.00 H new ATOM 0 HE1 HIS B 17 79.001 18.013 -9.319 1.00 0.00 H new ATOM 0 HE2 HIS B 17 79.653 18.065 -6.843 1.00 0.00 H new ATOM 1897 N LYS B 18 76.260 12.616 -9.641 1.00 0.00 N ATOM 1898 CA LYS B 18 75.329 12.923 -10.756 1.00 0.00 C ATOM 1899 C LYS B 18 73.993 13.307 -10.127 1.00 0.00 C ATOM 1900 O LYS B 18 73.337 14.239 -10.547 1.00 0.00 O ATOM 1901 CB LYS B 18 75.166 11.695 -11.659 1.00 0.00 C ATOM 1902 CG LYS B 18 74.242 12.038 -12.834 1.00 0.00 C ATOM 1903 CD LYS B 18 74.351 10.956 -13.919 1.00 0.00 C ATOM 1904 CE LYS B 18 73.740 9.645 -13.417 1.00 0.00 C ATOM 1905 NZ LYS B 18 73.558 8.712 -14.566 1.00 0.00 N ATOM 0 H LYS B 18 76.643 11.670 -9.634 1.00 0.00 H new ATOM 0 HA LYS B 18 75.711 13.736 -11.373 1.00 0.00 H new ATOM 0 HB2 LYS B 18 76.139 11.373 -12.031 1.00 0.00 H new ATOM 0 HB3 LYS B 18 74.752 10.864 -11.088 1.00 0.00 H new ATOM 0 HG2 LYS B 18 73.212 12.115 -12.487 1.00 0.00 H new ATOM 0 HG3 LYS B 18 74.512 13.009 -13.249 1.00 0.00 H new ATOM 0 HD2 LYS B 18 73.837 11.283 -14.823 1.00 0.00 H new ATOM 0 HD3 LYS B 18 75.397 10.801 -14.185 1.00 0.00 H new ATOM 0 HE2 LYS B 18 74.388 9.193 -12.666 1.00 0.00 H new ATOM 0 HE3 LYS B 18 72.781 9.838 -12.936 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 73.143 7.821 -14.227 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 72.924 9.145 -15.267 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 74.480 8.519 -15.006 1.00 0.00 H new ATOM 1919 N TYR B 19 73.608 12.614 -9.089 1.00 0.00 N ATOM 1920 CA TYR B 19 72.337 12.957 -8.388 1.00 0.00 C ATOM 1921 C TYR B 19 72.541 14.286 -7.669 1.00 0.00 C ATOM 1922 O TYR B 19 71.645 15.098 -7.570 1.00 0.00 O ATOM 1923 CB TYR B 19 72.000 11.856 -7.381 1.00 0.00 C ATOM 1924 CG TYR B 19 71.615 10.617 -8.149 1.00 0.00 C ATOM 1925 CD1 TYR B 19 70.287 10.411 -8.538 1.00 0.00 C ATOM 1926 CD2 TYR B 19 72.596 9.686 -8.493 1.00 0.00 C ATOM 1927 CE1 TYR B 19 69.942 9.274 -9.279 1.00 0.00 C ATOM 1928 CE2 TYR B 19 72.256 8.546 -9.228 1.00 0.00 C ATOM 1929 CZ TYR B 19 70.927 8.341 -9.624 1.00 0.00 C ATOM 1930 OH TYR B 19 70.590 7.224 -10.360 1.00 0.00 O ATOM 0 H TYR B 19 74.120 11.824 -8.696 1.00 0.00 H new ATOM 0 HA TYR B 19 71.514 13.041 -9.097 1.00 0.00 H new ATOM 0 HB2 TYR B 19 72.857 11.654 -6.738 1.00 0.00 H new ATOM 0 HB3 TYR B 19 71.182 12.171 -6.733 1.00 0.00 H new ATOM 0 HD1 TYR B 19 69.528 11.129 -8.267 1.00 0.00 H new ATOM 0 HD2 TYR B 19 73.620 9.846 -8.191 1.00 0.00 H new ATOM 0 HE1 TYR B 19 68.918 9.117 -9.584 1.00 0.00 H new ATOM 0 HE2 TYR B 19 73.016 7.825 -9.490 1.00 0.00 H new ATOM 0 HH TYR B 19 71.355 6.950 -10.907 1.00 0.00 H new ATOM 1940 N SER B 20 73.723 14.511 -7.165 1.00 0.00 N ATOM 1941 CA SER B 20 74.001 15.785 -6.449 1.00 0.00 C ATOM 1942 C SER B 20 72.932 15.997 -5.384 1.00 0.00 C ATOM 1943 O SER B 20 72.832 17.052 -4.789 1.00 0.00 O ATOM 1944 CB SER B 20 73.973 16.947 -7.439 1.00 0.00 C ATOM 1945 OG SER B 20 75.101 16.858 -8.299 1.00 0.00 O ATOM 0 H SER B 20 74.510 13.864 -7.219 1.00 0.00 H new ATOM 0 HA SER B 20 74.985 15.737 -5.982 1.00 0.00 H new ATOM 0 HB2 SER B 20 73.053 16.920 -8.023 1.00 0.00 H new ATOM 0 HB3 SER B 20 73.983 17.896 -6.904 1.00 0.00 H new ATOM 0 HG SER B 20 75.613 16.051 -8.084 1.00 0.00 H new ATOM 1951 N GLY B 21 72.134 14.999 -5.140 1.00 0.00 N ATOM 1952 CA GLY B 21 71.068 15.138 -4.106 1.00 0.00 C ATOM 1953 C GLY B 21 69.951 16.038 -4.633 1.00 0.00 C ATOM 1954 O GLY B 21 69.627 17.051 -4.052 1.00 0.00 O ATOM 0 H GLY B 21 72.171 14.094 -5.609 1.00 0.00 H new ATOM 0 HA2 GLY B 21 70.667 14.157 -3.850 1.00 0.00 H new ATOM 0 HA3 GLY B 21 71.487 15.560 -3.193 1.00 0.00 H new ATOM 1958 N LYS B 22 69.361 15.678 -5.728 1.00 0.00 N ATOM 1959 CA LYS B 22 68.261 16.511 -6.294 1.00 0.00 C ATOM 1960 C LYS B 22 67.126 16.602 -5.263 1.00 0.00 C ATOM 1961 O LYS B 22 66.502 17.631 -5.098 1.00 0.00 O ATOM 1962 CB LYS B 22 67.732 15.862 -7.603 1.00 0.00 C ATOM 1963 CG LYS B 22 68.377 14.485 -7.813 1.00 0.00 C ATOM 1964 CD LYS B 22 67.671 13.740 -8.948 1.00 0.00 C ATOM 1965 CE LYS B 22 67.878 14.476 -10.270 1.00 0.00 C ATOM 1966 NZ LYS B 22 67.530 13.566 -11.400 1.00 0.00 N ATOM 0 H LYS B 22 69.589 14.840 -6.263 1.00 0.00 H new ATOM 0 HA LYS B 22 68.633 17.510 -6.521 1.00 0.00 H new ATOM 0 HB2 LYS B 22 66.648 15.760 -7.554 1.00 0.00 H new ATOM 0 HB3 LYS B 22 67.953 16.508 -8.453 1.00 0.00 H new ATOM 0 HG2 LYS B 22 69.435 14.603 -8.048 1.00 0.00 H new ATOM 0 HG3 LYS B 22 68.317 13.903 -6.893 1.00 0.00 H new ATOM 0 HD2 LYS B 22 68.060 12.725 -9.024 1.00 0.00 H new ATOM 0 HD3 LYS B 22 66.606 13.658 -8.732 1.00 0.00 H new ATOM 0 HE2 LYS B 22 67.256 15.370 -10.303 1.00 0.00 H new ATOM 0 HE3 LYS B 22 68.913 14.805 -10.358 1.00 0.00 H new ATOM 0 HZ1 LYS B 22 67.670 14.064 -12.302 1.00 0.00 H new ATOM 0 HZ2 LYS B 22 68.142 12.726 -11.370 1.00 0.00 H new ATOM 0 HZ3 LYS B 22 66.536 13.273 -11.316 1.00 0.00 H new ATOM 1980 N GLU B 23 66.841 15.520 -4.594 1.00 0.00 N ATOM 1981 CA GLU B 23 65.729 15.518 -3.593 1.00 0.00 C ATOM 1982 C GLU B 23 66.238 15.900 -2.203 1.00 0.00 C ATOM 1983 O GLU B 23 65.478 15.947 -1.256 1.00 0.00 O ATOM 1984 CB GLU B 23 65.139 14.113 -3.523 1.00 0.00 C ATOM 1985 CG GLU B 23 64.617 13.737 -4.899 1.00 0.00 C ATOM 1986 CD GLU B 23 64.018 12.329 -4.859 1.00 0.00 C ATOM 1987 OE1 GLU B 23 64.117 11.696 -3.821 1.00 0.00 O ATOM 1988 OE2 GLU B 23 63.472 11.910 -5.864 1.00 0.00 O ATOM 0 H GLU B 23 67.331 14.631 -4.695 1.00 0.00 H new ATOM 0 HA GLU B 23 64.980 16.246 -3.904 1.00 0.00 H new ATOM 0 HB2 GLU B 23 65.897 13.400 -3.198 1.00 0.00 H new ATOM 0 HB3 GLU B 23 64.333 14.077 -2.790 1.00 0.00 H new ATOM 0 HG2 GLU B 23 63.862 14.454 -5.220 1.00 0.00 H new ATOM 0 HG3 GLU B 23 65.426 13.778 -5.629 1.00 0.00 H new ATOM 1995 N GLY B 24 67.506 16.159 -2.049 1.00 0.00 N ATOM 1996 CA GLY B 24 68.007 16.515 -0.690 1.00 0.00 C ATOM 1997 C GLY B 24 69.398 17.158 -0.766 1.00 0.00 C ATOM 1998 O GLY B 24 69.845 17.576 -1.810 1.00 0.00 O ATOM 0 H GLY B 24 68.207 16.141 -2.789 1.00 0.00 H new ATOM 0 HA2 GLY B 24 67.310 17.203 -0.211 1.00 0.00 H new ATOM 0 HA3 GLY B 24 68.050 15.620 -0.069 1.00 0.00 H new ATOM 2002 N ASP B 25 70.086 17.242 0.344 1.00 0.00 N ATOM 2003 CA ASP B 25 71.448 17.856 0.336 1.00 0.00 C ATOM 2004 C ASP B 25 72.380 17.026 -0.539 1.00 0.00 C ATOM 2005 O ASP B 25 72.292 15.816 -0.590 1.00 0.00 O ATOM 2006 CB ASP B 25 71.994 17.922 1.765 1.00 0.00 C ATOM 2007 CG ASP B 25 71.215 18.973 2.556 1.00 0.00 C ATOM 2008 OD1 ASP B 25 70.612 19.831 1.931 1.00 0.00 O ATOM 2009 OD2 ASP B 25 71.235 18.907 3.774 1.00 0.00 O ATOM 0 H ASP B 25 69.764 16.913 1.254 1.00 0.00 H new ATOM 0 HA ASP B 25 71.386 18.867 -0.068 1.00 0.00 H new ATOM 0 HB2 ASP B 25 71.904 16.948 2.246 1.00 0.00 H new ATOM 0 HB3 ASP B 25 73.054 18.174 1.750 1.00 0.00 H new ATOM 2014 N LYS B 26 73.269 17.677 -1.237 1.00 0.00 N ATOM 2015 CA LYS B 26 74.208 16.938 -2.121 1.00 0.00 C ATOM 2016 C LYS B 26 75.175 16.139 -1.264 1.00 0.00 C ATOM 2017 O LYS B 26 75.914 15.306 -1.755 1.00 0.00 O ATOM 2018 CB LYS B 26 74.977 17.928 -3.002 1.00 0.00 C ATOM 2019 CG LYS B 26 75.787 18.889 -2.128 1.00 0.00 C ATOM 2020 CD LYS B 26 76.474 19.926 -3.019 1.00 0.00 C ATOM 2021 CE LYS B 26 77.271 20.899 -2.151 1.00 0.00 C ATOM 2022 NZ LYS B 26 76.328 21.843 -1.485 1.00 0.00 N ATOM 0 H LYS B 26 73.384 18.690 -1.232 1.00 0.00 H new ATOM 0 HA LYS B 26 73.650 16.258 -2.764 1.00 0.00 H new ATOM 0 HB2 LYS B 26 75.642 17.387 -3.675 1.00 0.00 H new ATOM 0 HB3 LYS B 26 74.281 18.489 -3.625 1.00 0.00 H new ATOM 0 HG2 LYS B 26 75.133 19.385 -1.411 1.00 0.00 H new ATOM 0 HG3 LYS B 26 76.531 18.337 -1.553 1.00 0.00 H new ATOM 0 HD2 LYS B 26 77.136 19.429 -3.728 1.00 0.00 H new ATOM 0 HD3 LYS B 26 75.730 20.469 -3.603 1.00 0.00 H new ATOM 0 HE2 LYS B 26 77.846 20.352 -1.404 1.00 0.00 H new ATOM 0 HE3 LYS B 26 77.986 21.450 -2.763 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 76.864 22.627 -1.060 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 75.661 22.221 -2.188 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 75.801 21.341 -0.742 1.00 0.00 H new ATOM 2036 N PHE B 27 75.170 16.377 0.018 1.00 0.00 N ATOM 2037 CA PHE B 27 76.084 15.618 0.925 1.00 0.00 C ATOM 2038 C PHE B 27 75.287 14.487 1.580 1.00 0.00 C ATOM 2039 O PHE B 27 75.806 13.718 2.364 1.00 0.00 O ATOM 2040 CB PHE B 27 76.630 16.564 2.010 1.00 0.00 C ATOM 2041 CG PHE B 27 77.905 15.992 2.599 1.00 0.00 C ATOM 2042 CD1 PHE B 27 79.140 16.310 2.021 1.00 0.00 C ATOM 2043 CD2 PHE B 27 77.852 15.141 3.712 1.00 0.00 C ATOM 2044 CE1 PHE B 27 80.321 15.781 2.554 1.00 0.00 C ATOM 2045 CE2 PHE B 27 79.037 14.611 4.244 1.00 0.00 C ATOM 2046 CZ PHE B 27 80.270 14.932 3.664 1.00 0.00 C ATOM 0 H PHE B 27 74.574 17.064 0.479 1.00 0.00 H new ATOM 0 HA PHE B 27 76.920 15.206 0.360 1.00 0.00 H new ATOM 0 HB2 PHE B 27 76.826 17.547 1.582 1.00 0.00 H new ATOM 0 HB3 PHE B 27 75.886 16.700 2.795 1.00 0.00 H new ATOM 0 HD1 PHE B 27 79.181 16.964 1.163 1.00 0.00 H new ATOM 0 HD2 PHE B 27 76.900 14.894 4.159 1.00 0.00 H new ATOM 0 HE1 PHE B 27 81.273 16.029 2.108 1.00 0.00 H new ATOM 0 HE2 PHE B 27 78.998 13.955 5.101 1.00 0.00 H new ATOM 0 HZ PHE B 27 81.182 14.524 4.074 1.00 0.00 H new ATOM 2056 N LYS B 28 74.018 14.390 1.265 1.00 0.00 N ATOM 2057 CA LYS B 28 73.167 13.317 1.870 1.00 0.00 C ATOM 2058 C LYS B 28 72.178 12.813 0.820 1.00 0.00 C ATOM 2059 O LYS B 28 71.912 13.478 -0.161 1.00 0.00 O ATOM 2060 CB LYS B 28 72.384 13.890 3.053 1.00 0.00 C ATOM 2061 CG LYS B 28 73.361 14.417 4.104 1.00 0.00 C ATOM 2062 CD LYS B 28 72.587 14.992 5.290 1.00 0.00 C ATOM 2063 CE LYS B 28 73.578 15.532 6.319 1.00 0.00 C ATOM 2064 NZ LYS B 28 72.846 15.925 7.554 1.00 0.00 N ATOM 0 H LYS B 28 73.534 15.008 0.614 1.00 0.00 H new ATOM 0 HA LYS B 28 73.801 12.499 2.212 1.00 0.00 H new ATOM 0 HB2 LYS B 28 71.729 14.693 2.715 1.00 0.00 H new ATOM 0 HB3 LYS B 28 71.746 13.120 3.488 1.00 0.00 H new ATOM 0 HG2 LYS B 28 74.015 13.613 4.441 1.00 0.00 H new ATOM 0 HG3 LYS B 28 73.999 15.186 3.668 1.00 0.00 H new ATOM 0 HD2 LYS B 28 71.922 15.788 4.955 1.00 0.00 H new ATOM 0 HD3 LYS B 28 71.961 14.221 5.739 1.00 0.00 H new ATOM 0 HE2 LYS B 28 74.326 14.774 6.552 1.00 0.00 H new ATOM 0 HE3 LYS B 28 74.111 16.391 5.911 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 73.520 16.293 8.255 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 72.149 16.662 7.325 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 72.357 15.095 7.946 1.00 0.00 H new ATOM 2078 N LEU B 29 71.625 11.644 1.024 1.00 0.00 N ATOM 2079 CA LEU B 29 70.636 11.085 0.047 1.00 0.00 C ATOM 2080 C LEU B 29 69.415 10.599 0.819 1.00 0.00 C ATOM 2081 O LEU B 29 69.471 10.385 2.012 1.00 0.00 O ATOM 2082 CB LEU B 29 71.286 9.923 -0.742 1.00 0.00 C ATOM 2083 CG LEU B 29 70.898 9.990 -2.228 1.00 0.00 C ATOM 2084 CD1 LEU B 29 71.754 11.041 -2.952 1.00 0.00 C ATOM 2085 CD2 LEU B 29 71.114 8.614 -2.878 1.00 0.00 C ATOM 0 H LEU B 29 71.816 11.048 1.829 1.00 0.00 H new ATOM 0 HA LEU B 29 70.329 11.850 -0.666 1.00 0.00 H new ATOM 0 HB2 LEU B 29 72.370 9.971 -0.642 1.00 0.00 H new ATOM 0 HB3 LEU B 29 70.969 8.969 -0.321 1.00 0.00 H new ATOM 0 HG LEU B 29 69.848 10.272 -2.308 1.00 0.00 H new ATOM 0 HD11 LEU B 29 71.470 11.080 -4.004 1.00 0.00 H new ATOM 0 HD12 LEU B 29 71.593 12.018 -2.497 1.00 0.00 H new ATOM 0 HD13 LEU B 29 72.807 10.772 -2.870 1.00 0.00 H new ATOM 0 HD21 LEU B 29 70.839 8.662 -3.932 1.00 0.00 H new ATOM 0 HD22 LEU B 29 72.163 8.330 -2.790 1.00 0.00 H new ATOM 0 HD23 LEU B 29 70.494 7.872 -2.374 1.00 0.00 H new ATOM 2097 N ASN B 30 68.313 10.436 0.142 1.00 0.00 N ATOM 2098 CA ASN B 30 67.071 9.963 0.815 1.00 0.00 C ATOM 2099 C ASN B 30 66.877 8.478 0.499 1.00 0.00 C ATOM 2100 O ASN B 30 67.100 8.035 -0.609 1.00 0.00 O ATOM 2101 CB ASN B 30 65.878 10.762 0.289 1.00 0.00 C ATOM 2102 CG ASN B 30 66.053 12.235 0.664 1.00 0.00 C ATOM 2103 OD1 ASN B 30 66.418 12.546 1.877 1.00 0.00 O flip ATOM 2104 ND2 ASN B 30 65.856 13.111 -0.155 1.00 0.00 N flip ATOM 0 H ASN B 30 68.219 10.612 -0.858 1.00 0.00 H new ATOM 0 HA ASN B 30 67.150 10.103 1.893 1.00 0.00 H new ATOM 0 HB2 ASN B 30 65.803 10.656 -0.793 1.00 0.00 H new ATOM 0 HB3 ASN B 30 64.951 10.375 0.712 1.00 0.00 H new ATOM 0 HD21 ASN B 30 65.571 12.868 -1.104 1.00 0.00 H new ATOM 0 HD22 ASN B 30 65.976 14.090 0.106 1.00 0.00 H new ATOM 2111 N LYS B 31 66.469 7.708 1.465 1.00 0.00 N ATOM 2112 CA LYS B 31 66.267 6.253 1.228 1.00 0.00 C ATOM 2113 C LYS B 31 65.322 6.069 0.043 1.00 0.00 C ATOM 2114 O LYS B 31 65.367 5.084 -0.647 1.00 0.00 O ATOM 2115 CB LYS B 31 65.670 5.607 2.479 1.00 0.00 C ATOM 2116 CG LYS B 31 66.716 5.611 3.596 1.00 0.00 C ATOM 2117 CD LYS B 31 66.130 4.970 4.852 1.00 0.00 C ATOM 2118 CE LYS B 31 67.181 4.978 5.965 1.00 0.00 C ATOM 2119 NZ LYS B 31 68.299 4.065 5.597 1.00 0.00 N ATOM 0 H LYS B 31 66.266 8.024 2.413 1.00 0.00 H new ATOM 0 HA LYS B 31 67.223 5.777 1.008 1.00 0.00 H new ATOM 0 HB2 LYS B 31 64.781 6.152 2.795 1.00 0.00 H new ATOM 0 HB3 LYS B 31 65.357 4.586 2.261 1.00 0.00 H new ATOM 0 HG2 LYS B 31 67.604 5.065 3.278 1.00 0.00 H new ATOM 0 HG3 LYS B 31 67.030 6.633 3.810 1.00 0.00 H new ATOM 0 HD2 LYS B 31 65.242 5.515 5.171 1.00 0.00 H new ATOM 0 HD3 LYS B 31 65.817 3.948 4.640 1.00 0.00 H new ATOM 0 HE2 LYS B 31 67.558 5.989 6.117 1.00 0.00 H new ATOM 0 HE3 LYS B 31 66.732 4.660 6.906 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 68.398 3.327 6.323 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 68.097 3.622 4.678 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 69.184 4.608 5.533 1.00 0.00 H new ATOM 2133 N SER B 32 64.483 7.023 -0.222 1.00 0.00 N ATOM 2134 CA SER B 32 63.577 6.888 -1.393 1.00 0.00 C ATOM 2135 C SER B 32 64.455 6.753 -2.618 1.00 0.00 C ATOM 2136 O SER B 32 64.197 5.961 -3.503 1.00 0.00 O ATOM 2137 CB SER B 32 62.695 8.118 -1.538 1.00 0.00 C ATOM 2138 OG SER B 32 61.794 8.186 -0.440 1.00 0.00 O ATOM 0 H SER B 32 64.383 7.885 0.315 1.00 0.00 H new ATOM 0 HA SER B 32 62.926 6.023 -1.268 1.00 0.00 H new ATOM 0 HB2 SER B 32 63.310 9.017 -1.574 1.00 0.00 H new ATOM 0 HB3 SER B 32 62.140 8.073 -2.475 1.00 0.00 H new ATOM 0 HG SER B 32 61.226 8.979 -0.531 1.00 0.00 H new ATOM 2144 N GLU B 33 65.517 7.503 -2.661 1.00 0.00 N ATOM 2145 CA GLU B 33 66.432 7.388 -3.815 1.00 0.00 C ATOM 2146 C GLU B 33 66.953 5.974 -3.830 1.00 0.00 C ATOM 2147 O GLU B 33 67.351 5.478 -4.849 1.00 0.00 O ATOM 2148 CB GLU B 33 67.575 8.402 -3.721 1.00 0.00 C ATOM 2149 CG GLU B 33 67.010 9.812 -3.927 1.00 0.00 C ATOM 2150 CD GLU B 33 68.152 10.799 -4.169 1.00 0.00 C ATOM 2151 OE1 GLU B 33 69.222 10.355 -4.553 1.00 0.00 O ATOM 2152 OE2 GLU B 33 67.940 11.981 -3.960 1.00 0.00 O ATOM 0 H GLU B 33 65.786 8.184 -1.951 1.00 0.00 H new ATOM 0 HA GLU B 33 65.905 7.609 -4.743 1.00 0.00 H new ATOM 0 HB2 GLU B 33 68.063 8.330 -2.749 1.00 0.00 H new ATOM 0 HB3 GLU B 33 68.333 8.186 -4.474 1.00 0.00 H new ATOM 0 HG2 GLU B 33 66.326 9.819 -4.775 1.00 0.00 H new ATOM 0 HG3 GLU B 33 66.435 10.115 -3.052 1.00 0.00 H new ATOM 2159 N LEU B 34 66.915 5.283 -2.726 1.00 0.00 N ATOM 2160 CA LEU B 34 67.379 3.871 -2.783 1.00 0.00 C ATOM 2161 C LEU B 34 66.476 3.180 -3.789 1.00 0.00 C ATOM 2162 O LEU B 34 66.906 2.369 -4.577 1.00 0.00 O ATOM 2163 CB LEU B 34 67.244 3.158 -1.420 1.00 0.00 C ATOM 2164 CG LEU B 34 67.808 1.715 -1.499 1.00 0.00 C ATOM 2165 CD1 LEU B 34 69.321 1.728 -1.267 1.00 0.00 C ATOM 2166 CD2 LEU B 34 67.137 0.825 -0.433 1.00 0.00 C ATOM 0 H LEU B 34 66.595 5.619 -1.818 1.00 0.00 H new ATOM 0 HA LEU B 34 68.433 3.837 -3.057 1.00 0.00 H new ATOM 0 HB2 LEU B 34 67.778 3.721 -0.655 1.00 0.00 H new ATOM 0 HB3 LEU B 34 66.196 3.129 -1.121 1.00 0.00 H new ATOM 0 HG LEU B 34 67.597 1.314 -2.490 1.00 0.00 H new ATOM 0 HD11 LEU B 34 69.707 0.710 -1.325 1.00 0.00 H new ATOM 0 HD12 LEU B 34 69.801 2.342 -2.030 1.00 0.00 H new ATOM 0 HD13 LEU B 34 69.534 2.142 -0.281 1.00 0.00 H new ATOM 0 HD21 LEU B 34 67.540 -0.186 -0.497 1.00 0.00 H new ATOM 0 HD22 LEU B 34 67.335 1.233 0.558 1.00 0.00 H new ATOM 0 HD23 LEU B 34 66.061 0.798 -0.606 1.00 0.00 H new ATOM 2178 N LYS B 35 65.215 3.500 -3.770 1.00 0.00 N ATOM 2179 CA LYS B 35 64.300 2.855 -4.734 1.00 0.00 C ATOM 2180 C LYS B 35 64.610 3.355 -6.147 1.00 0.00 C ATOM 2181 O LYS B 35 64.821 2.581 -7.054 1.00 0.00 O ATOM 2182 CB LYS B 35 62.858 3.208 -4.360 1.00 0.00 C ATOM 2183 CG LYS B 35 61.878 2.495 -5.292 1.00 0.00 C ATOM 2184 CD LYS B 35 60.448 2.882 -4.906 1.00 0.00 C ATOM 2185 CE LYS B 35 59.461 2.175 -5.833 1.00 0.00 C ATOM 2186 NZ LYS B 35 59.371 0.738 -5.454 1.00 0.00 N ATOM 0 H LYS B 35 64.786 4.173 -3.135 1.00 0.00 H new ATOM 0 HA LYS B 35 64.431 1.773 -4.705 1.00 0.00 H new ATOM 0 HB2 LYS B 35 62.662 2.921 -3.327 1.00 0.00 H new ATOM 0 HB3 LYS B 35 62.712 4.286 -4.424 1.00 0.00 H new ATOM 0 HG2 LYS B 35 62.076 2.771 -6.328 1.00 0.00 H new ATOM 0 HG3 LYS B 35 62.008 1.415 -5.219 1.00 0.00 H new ATOM 0 HD2 LYS B 35 60.252 2.606 -3.870 1.00 0.00 H new ATOM 0 HD3 LYS B 35 60.320 3.962 -4.977 1.00 0.00 H new ATOM 0 HE2 LYS B 35 58.479 2.643 -5.763 1.00 0.00 H new ATOM 0 HE3 LYS B 35 59.786 2.270 -6.869 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 58.562 0.301 -5.939 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 60.246 0.250 -5.732 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 59.242 0.658 -4.425 1.00 0.00 H new ATOM 2200 N GLU B 36 64.634 4.645 -6.335 1.00 0.00 N ATOM 2201 CA GLU B 36 64.920 5.209 -7.688 1.00 0.00 C ATOM 2202 C GLU B 36 66.379 4.983 -8.089 1.00 0.00 C ATOM 2203 O GLU B 36 66.677 4.692 -9.231 1.00 0.00 O ATOM 2204 CB GLU B 36 64.612 6.710 -7.680 1.00 0.00 C ATOM 2205 CG GLU B 36 64.946 7.317 -9.041 1.00 0.00 C ATOM 2206 CD GLU B 36 64.410 8.747 -9.110 1.00 0.00 C ATOM 2207 OE1 GLU B 36 63.828 9.189 -8.133 1.00 0.00 O ATOM 2208 OE2 GLU B 36 64.594 9.378 -10.137 1.00 0.00 O ATOM 0 H GLU B 36 64.467 5.339 -5.606 1.00 0.00 H new ATOM 0 HA GLU B 36 64.290 4.699 -8.417 1.00 0.00 H new ATOM 0 HB2 GLU B 36 63.559 6.873 -7.448 1.00 0.00 H new ATOM 0 HB3 GLU B 36 65.191 7.205 -6.900 1.00 0.00 H new ATOM 0 HG2 GLU B 36 66.025 7.314 -9.197 1.00 0.00 H new ATOM 0 HG3 GLU B 36 64.508 6.715 -9.837 1.00 0.00 H new ATOM 2215 N LEU B 37 67.292 5.131 -7.176 1.00 0.00 N ATOM 2216 CA LEU B 37 68.722 4.939 -7.518 1.00 0.00 C ATOM 2217 C LEU B 37 68.937 3.501 -7.950 1.00 0.00 C ATOM 2218 O LEU B 37 69.741 3.214 -8.817 1.00 0.00 O ATOM 2219 CB LEU B 37 69.594 5.243 -6.287 1.00 0.00 C ATOM 2220 CG LEU B 37 71.089 5.072 -6.612 1.00 0.00 C ATOM 2221 CD1 LEU B 37 71.540 6.143 -7.612 1.00 0.00 C ATOM 2222 CD2 LEU B 37 71.897 5.214 -5.316 1.00 0.00 C ATOM 0 H LEU B 37 67.108 5.378 -6.204 1.00 0.00 H new ATOM 0 HA LEU B 37 69.000 5.613 -8.328 1.00 0.00 H new ATOM 0 HB2 LEU B 37 69.407 6.262 -5.947 1.00 0.00 H new ATOM 0 HB3 LEU B 37 69.318 4.578 -5.469 1.00 0.00 H new ATOM 0 HG LEU B 37 71.253 4.088 -7.052 1.00 0.00 H new ATOM 0 HD11 LEU B 37 72.599 6.011 -7.834 1.00 0.00 H new ATOM 0 HD12 LEU B 37 70.962 6.048 -8.532 1.00 0.00 H new ATOM 0 HD13 LEU B 37 71.380 7.132 -7.183 1.00 0.00 H new ATOM 0 HD21 LEU B 37 72.958 5.095 -5.534 1.00 0.00 H new ATOM 0 HD22 LEU B 37 71.724 6.200 -4.885 1.00 0.00 H new ATOM 0 HD23 LEU B 37 71.584 4.448 -4.606 1.00 0.00 H new ATOM 2234 N LEU B 38 68.264 2.586 -7.321 1.00 0.00 N ATOM 2235 CA LEU B 38 68.491 1.153 -7.680 1.00 0.00 C ATOM 2236 C LEU B 38 68.062 0.857 -9.120 1.00 0.00 C ATOM 2237 O LEU B 38 68.792 0.231 -9.864 1.00 0.00 O ATOM 2238 CB LEU B 38 67.730 0.253 -6.690 1.00 0.00 C ATOM 2239 CG LEU B 38 68.652 -0.188 -5.527 1.00 0.00 C ATOM 2240 CD1 LEU B 38 69.526 -1.376 -5.985 1.00 0.00 C ATOM 2241 CD2 LEU B 38 69.551 0.981 -5.039 1.00 0.00 C ATOM 0 H LEU B 38 67.577 2.756 -6.586 1.00 0.00 H new ATOM 0 HA LEU B 38 69.559 0.945 -7.614 1.00 0.00 H new ATOM 0 HB2 LEU B 38 66.868 0.789 -6.293 1.00 0.00 H new ATOM 0 HB3 LEU B 38 67.348 -0.625 -7.210 1.00 0.00 H new ATOM 0 HG LEU B 38 68.025 -0.494 -4.690 1.00 0.00 H new ATOM 0 HD11 LEU B 38 70.175 -1.687 -5.167 1.00 0.00 H new ATOM 0 HD12 LEU B 38 68.885 -2.208 -6.276 1.00 0.00 H new ATOM 0 HD13 LEU B 38 70.135 -1.073 -6.836 1.00 0.00 H new ATOM 0 HD21 LEU B 38 70.185 0.636 -4.222 1.00 0.00 H new ATOM 0 HD22 LEU B 38 70.176 1.327 -5.862 1.00 0.00 H new ATOM 0 HD23 LEU B 38 68.924 1.801 -4.690 1.00 0.00 H new ATOM 2253 N THR B 39 66.902 1.267 -9.528 1.00 0.00 N ATOM 2254 CA THR B 39 66.490 0.954 -10.928 1.00 0.00 C ATOM 2255 C THR B 39 67.300 1.813 -11.898 1.00 0.00 C ATOM 2256 O THR B 39 67.566 1.424 -13.018 1.00 0.00 O ATOM 2257 CB THR B 39 64.988 1.235 -11.129 1.00 0.00 C ATOM 2258 OG1 THR B 39 64.814 2.512 -11.731 1.00 0.00 O ATOM 2259 CG2 THR B 39 64.272 1.220 -9.783 1.00 0.00 C ATOM 0 H THR B 39 66.229 1.795 -8.972 1.00 0.00 H new ATOM 0 HA THR B 39 66.677 -0.103 -11.119 1.00 0.00 H new ATOM 0 HB THR B 39 64.569 0.463 -11.775 1.00 0.00 H new ATOM 0 HG1 THR B 39 63.858 2.686 -11.859 1.00 0.00 H new ATOM 0 HG21 THR B 39 63.211 1.419 -9.933 1.00 0.00 H new ATOM 0 HG22 THR B 39 64.395 0.243 -9.316 1.00 0.00 H new ATOM 0 HG23 THR B 39 64.697 1.987 -9.136 1.00 0.00 H new ATOM 2267 N ARG B 40 67.681 2.985 -11.478 1.00 0.00 N ATOM 2268 CA ARG B 40 68.455 3.884 -12.373 1.00 0.00 C ATOM 2269 C ARG B 40 69.858 3.329 -12.589 1.00 0.00 C ATOM 2270 O ARG B 40 70.399 3.402 -13.674 1.00 0.00 O ATOM 2271 CB ARG B 40 68.568 5.276 -11.748 1.00 0.00 C ATOM 2272 CG ARG B 40 67.205 5.986 -11.754 1.00 0.00 C ATOM 2273 CD ARG B 40 66.905 6.589 -13.133 1.00 0.00 C ATOM 2274 NE ARG B 40 65.785 7.584 -13.010 1.00 0.00 N ATOM 2275 CZ ARG B 40 64.624 7.253 -12.508 1.00 0.00 C ATOM 2276 NH1 ARG B 40 64.325 6.001 -12.297 1.00 0.00 N ATOM 2277 NH2 ARG B 40 63.733 8.180 -12.272 1.00 0.00 N ATOM 0 H ARG B 40 67.488 3.360 -10.549 1.00 0.00 H new ATOM 0 HA ARG B 40 67.934 3.949 -13.328 1.00 0.00 H new ATOM 0 HB2 ARG B 40 68.936 5.192 -10.725 1.00 0.00 H new ATOM 0 HB3 ARG B 40 69.296 5.870 -12.301 1.00 0.00 H new ATOM 0 HG2 ARG B 40 66.421 5.278 -11.484 1.00 0.00 H new ATOM 0 HG3 ARG B 40 67.197 6.773 -11.000 1.00 0.00 H new ATOM 0 HD2 ARG B 40 67.796 7.075 -13.531 1.00 0.00 H new ATOM 0 HD3 ARG B 40 66.631 5.801 -13.835 1.00 0.00 H new ATOM 0 HE ARG B 40 65.935 8.542 -13.326 1.00 0.00 H new ATOM 0 HH11 ARG B 40 65.000 5.270 -12.524 1.00 0.00 H new ATOM 0 HH12 ARG B 40 63.417 5.753 -11.905 1.00 0.00 H new ATOM 0 HH21 ARG B 40 63.945 9.156 -12.479 1.00 0.00 H new ATOM 0 HH22 ARG B 40 62.826 7.927 -11.880 1.00 0.00 H new ATOM 2291 N GLU B 41 70.465 2.799 -11.558 1.00 0.00 N ATOM 2292 CA GLU B 41 71.854 2.266 -11.698 1.00 0.00 C ATOM 2293 C GLU B 41 71.835 0.755 -11.801 1.00 0.00 C ATOM 2294 O GLU B 41 72.768 0.164 -12.308 1.00 0.00 O ATOM 2295 CB GLU B 41 72.671 2.698 -10.480 1.00 0.00 C ATOM 2296 CG GLU B 41 72.917 4.208 -10.543 1.00 0.00 C ATOM 2297 CD GLU B 41 73.722 4.648 -9.318 1.00 0.00 C ATOM 2298 OE1 GLU B 41 73.862 3.848 -8.408 1.00 0.00 O ATOM 2299 OE2 GLU B 41 74.171 5.782 -9.305 1.00 0.00 O ATOM 0 H GLU B 41 70.059 2.712 -10.626 1.00 0.00 H new ATOM 0 HA GLU B 41 72.305 2.662 -12.608 1.00 0.00 H new ATOM 0 HB2 GLU B 41 72.140 2.443 -9.563 1.00 0.00 H new ATOM 0 HB3 GLU B 41 73.621 2.164 -10.457 1.00 0.00 H new ATOM 0 HG2 GLU B 41 73.457 4.461 -11.456 1.00 0.00 H new ATOM 0 HG3 GLU B 41 71.967 4.741 -10.577 1.00 0.00 H new ATOM 2306 N LEU B 42 70.788 0.115 -11.352 1.00 0.00 N ATOM 2307 CA LEU B 42 70.744 -1.377 -11.458 1.00 0.00 C ATOM 2308 C LEU B 42 69.331 -1.844 -11.838 1.00 0.00 C ATOM 2309 O LEU B 42 68.601 -2.342 -11.004 1.00 0.00 O ATOM 2310 CB LEU B 42 71.139 -2.024 -10.120 1.00 0.00 C ATOM 2311 CG LEU B 42 72.463 -1.429 -9.580 1.00 0.00 C ATOM 2312 CD1 LEU B 42 72.179 -0.219 -8.669 1.00 0.00 C ATOM 2313 CD2 LEU B 42 73.225 -2.497 -8.775 1.00 0.00 C ATOM 0 H LEU B 42 69.972 0.550 -10.922 1.00 0.00 H new ATOM 0 HA LEU B 42 71.450 -1.680 -12.231 1.00 0.00 H new ATOM 0 HB2 LEU B 42 70.344 -1.871 -9.390 1.00 0.00 H new ATOM 0 HB3 LEU B 42 71.248 -3.101 -10.252 1.00 0.00 H new ATOM 0 HG LEU B 42 73.066 -1.105 -10.428 1.00 0.00 H new ATOM 0 HD11 LEU B 42 73.121 0.186 -8.299 1.00 0.00 H new ATOM 0 HD12 LEU B 42 71.652 0.548 -9.237 1.00 0.00 H new ATOM 0 HD13 LEU B 42 71.563 -0.534 -7.827 1.00 0.00 H new ATOM 0 HD21 LEU B 42 74.156 -2.073 -8.398 1.00 0.00 H new ATOM 0 HD22 LEU B 42 72.611 -2.828 -7.937 1.00 0.00 H new ATOM 0 HD23 LEU B 42 73.449 -3.347 -9.419 1.00 0.00 H new ATOM 2325 N PRO B 43 68.939 -1.692 -13.081 1.00 0.00 N ATOM 2326 CA PRO B 43 67.583 -2.128 -13.516 1.00 0.00 C ATOM 2327 C PRO B 43 67.476 -3.657 -13.697 1.00 0.00 C ATOM 2328 O PRO B 43 67.059 -4.368 -12.804 1.00 0.00 O ATOM 2329 CB PRO B 43 67.422 -1.381 -14.855 1.00 0.00 C ATOM 2330 CG PRO B 43 68.817 -0.895 -15.306 1.00 0.00 C ATOM 2331 CD PRO B 43 69.800 -1.076 -14.130 1.00 0.00 C ATOM 0 HA PRO B 43 66.807 -1.903 -12.785 1.00 0.00 H new ATOM 0 HB2 PRO B 43 66.987 -2.039 -15.607 1.00 0.00 H new ATOM 0 HB3 PRO B 43 66.744 -0.536 -14.740 1.00 0.00 H new ATOM 0 HG2 PRO B 43 69.154 -1.463 -16.173 1.00 0.00 H new ATOM 0 HG3 PRO B 43 68.775 0.152 -15.607 1.00 0.00 H new ATOM 0 HD2 PRO B 43 70.638 -1.720 -14.397 1.00 0.00 H new ATOM 0 HD3 PRO B 43 70.221 -0.125 -13.803 1.00 0.00 H new ATOM 2339 N SER B 44 67.832 -4.159 -14.852 1.00 0.00 N ATOM 2340 CA SER B 44 67.736 -5.628 -15.103 1.00 0.00 C ATOM 2341 C SER B 44 68.861 -6.379 -14.382 1.00 0.00 C ATOM 2342 O SER B 44 68.803 -7.577 -14.212 1.00 0.00 O ATOM 2343 CB SER B 44 67.836 -5.893 -16.606 1.00 0.00 C ATOM 2344 OG SER B 44 66.740 -5.273 -17.267 1.00 0.00 O ATOM 0 H SER B 44 68.187 -3.611 -15.636 1.00 0.00 H new ATOM 0 HA SER B 44 66.779 -5.983 -14.721 1.00 0.00 H new ATOM 0 HB2 SER B 44 68.777 -5.503 -16.994 1.00 0.00 H new ATOM 0 HB3 SER B 44 67.832 -6.966 -16.799 1.00 0.00 H new ATOM 0 HG SER B 44 66.802 -5.440 -18.231 1.00 0.00 H new ATOM 2350 N PHE B 45 69.893 -5.693 -13.976 1.00 0.00 N ATOM 2351 CA PHE B 45 71.025 -6.383 -13.283 1.00 0.00 C ATOM 2352 C PHE B 45 70.677 -6.628 -11.812 1.00 0.00 C ATOM 2353 O PHE B 45 71.374 -7.329 -11.105 1.00 0.00 O ATOM 2354 CB PHE B 45 72.256 -5.491 -13.336 1.00 0.00 C ATOM 2355 CG PHE B 45 72.784 -5.419 -14.750 1.00 0.00 C ATOM 2356 CD1 PHE B 45 73.689 -6.385 -15.208 1.00 0.00 C ATOM 2357 CD2 PHE B 45 72.377 -4.384 -15.598 1.00 0.00 C ATOM 2358 CE1 PHE B 45 74.184 -6.314 -16.515 1.00 0.00 C ATOM 2359 CE2 PHE B 45 72.872 -4.314 -16.905 1.00 0.00 C ATOM 2360 CZ PHE B 45 73.776 -5.279 -17.364 1.00 0.00 C ATOM 0 H PHE B 45 70.005 -4.686 -14.092 1.00 0.00 H new ATOM 0 HA PHE B 45 71.212 -7.335 -13.779 1.00 0.00 H new ATOM 0 HB2 PHE B 45 72.006 -4.491 -12.982 1.00 0.00 H new ATOM 0 HB3 PHE B 45 73.027 -5.881 -12.671 1.00 0.00 H new ATOM 0 HD1 PHE B 45 74.004 -7.184 -14.553 1.00 0.00 H new ATOM 0 HD2 PHE B 45 71.680 -3.638 -15.244 1.00 0.00 H new ATOM 0 HE1 PHE B 45 74.882 -7.059 -16.869 1.00 0.00 H new ATOM 0 HE2 PHE B 45 72.556 -3.515 -17.560 1.00 0.00 H new ATOM 0 HZ PHE B 45 74.158 -5.225 -18.373 1.00 0.00 H new ATOM 2370 N LEU B 46 69.615 -6.042 -11.348 1.00 0.00 N ATOM 2371 CA LEU B 46 69.205 -6.211 -9.914 1.00 0.00 C ATOM 2372 C LEU B 46 67.692 -6.316 -9.876 1.00 0.00 C ATOM 2373 O LEU B 46 67.125 -7.163 -9.214 1.00 0.00 O ATOM 2374 CB LEU B 46 69.682 -4.991 -9.110 1.00 0.00 C ATOM 2375 CG LEU B 46 69.165 -5.044 -7.646 1.00 0.00 C ATOM 2376 CD1 LEU B 46 70.266 -4.565 -6.685 1.00 0.00 C ATOM 2377 CD2 LEU B 46 67.936 -4.130 -7.484 1.00 0.00 C ATOM 0 H LEU B 46 69.000 -5.444 -11.900 1.00 0.00 H new ATOM 0 HA LEU B 46 69.648 -7.107 -9.478 1.00 0.00 H new ATOM 0 HB2 LEU B 46 70.771 -4.954 -9.112 1.00 0.00 H new ATOM 0 HB3 LEU B 46 69.331 -4.077 -9.589 1.00 0.00 H new ATOM 0 HG LEU B 46 68.890 -6.073 -7.413 1.00 0.00 H new ATOM 0 HD11 LEU B 46 69.897 -4.605 -5.660 1.00 0.00 H new ATOM 0 HD12 LEU B 46 71.139 -5.210 -6.781 1.00 0.00 H new ATOM 0 HD13 LEU B 46 70.543 -3.540 -6.931 1.00 0.00 H new ATOM 0 HD21 LEU B 46 67.582 -4.175 -6.454 1.00 0.00 H new ATOM 0 HD22 LEU B 46 68.211 -3.104 -7.729 1.00 0.00 H new ATOM 0 HD23 LEU B 46 67.144 -4.463 -8.155 1.00 0.00 H new ATOM 2389 N GLY B 47 67.039 -5.495 -10.642 1.00 0.00 N ATOM 2390 CA GLY B 47 65.560 -5.564 -10.733 1.00 0.00 C ATOM 2391 C GLY B 47 65.269 -6.604 -11.801 1.00 0.00 C ATOM 2392 O GLY B 47 64.266 -6.570 -12.484 1.00 0.00 O ATOM 0 H GLY B 47 67.472 -4.771 -11.215 1.00 0.00 H new ATOM 0 HA2 GLY B 47 65.121 -5.849 -9.777 1.00 0.00 H new ATOM 0 HA3 GLY B 47 65.137 -4.596 -11.002 1.00 0.00 H new ATOM 2396 N LYS B 48 66.195 -7.513 -11.964 1.00 0.00 N ATOM 2397 CA LYS B 48 66.067 -8.564 -13.002 1.00 0.00 C ATOM 2398 C LYS B 48 64.735 -9.318 -12.852 1.00 0.00 C ATOM 2399 O LYS B 48 64.455 -10.242 -13.589 1.00 0.00 O ATOM 2400 CB LYS B 48 67.243 -9.547 -12.856 1.00 0.00 C ATOM 2401 CG LYS B 48 67.528 -10.240 -14.195 1.00 0.00 C ATOM 2402 CD LYS B 48 68.865 -10.980 -14.114 1.00 0.00 C ATOM 2403 CE LYS B 48 68.752 -12.176 -13.167 1.00 0.00 C ATOM 2404 NZ LYS B 48 69.889 -13.102 -13.426 1.00 0.00 N ATOM 0 H LYS B 48 67.048 -7.567 -11.408 1.00 0.00 H new ATOM 0 HA LYS B 48 66.085 -8.100 -13.988 1.00 0.00 H new ATOM 0 HB2 LYS B 48 68.132 -9.014 -12.519 1.00 0.00 H new ATOM 0 HB3 LYS B 48 67.010 -10.292 -12.095 1.00 0.00 H new ATOM 0 HG2 LYS B 48 66.727 -10.940 -14.432 1.00 0.00 H new ATOM 0 HG3 LYS B 48 67.556 -9.504 -14.999 1.00 0.00 H new ATOM 0 HD2 LYS B 48 69.161 -11.320 -15.106 1.00 0.00 H new ATOM 0 HD3 LYS B 48 69.643 -10.302 -13.764 1.00 0.00 H new ATOM 0 HE2 LYS B 48 68.768 -11.839 -12.130 1.00 0.00 H new ATOM 0 HE3 LYS B 48 67.804 -12.691 -13.320 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 69.823 -13.920 -12.787 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 69.853 -13.429 -14.413 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 70.787 -12.604 -13.259 1.00 0.00 H new ATOM 2418 N ARG B 49 63.928 -8.940 -11.895 1.00 0.00 N ATOM 2419 CA ARG B 49 62.620 -9.627 -11.668 1.00 0.00 C ATOM 2420 C ARG B 49 62.874 -11.033 -11.116 1.00 0.00 C ATOM 2421 O ARG B 49 62.070 -11.929 -11.267 1.00 0.00 O ATOM 2422 CB ARG B 49 61.818 -9.718 -12.979 1.00 0.00 C ATOM 2423 CG ARG B 49 60.331 -9.908 -12.660 1.00 0.00 C ATOM 2424 CD ARG B 49 59.546 -10.015 -13.966 1.00 0.00 C ATOM 2425 NE ARG B 49 58.082 -9.839 -13.696 1.00 0.00 N ATOM 2426 CZ ARG B 49 57.446 -10.599 -12.845 1.00 0.00 C ATOM 2427 NH1 ARG B 49 58.020 -11.660 -12.351 1.00 0.00 N ATOM 2428 NH2 ARG B 49 56.211 -10.323 -12.529 1.00 0.00 N ATOM 0 H ARG B 49 64.122 -8.173 -11.251 1.00 0.00 H new ATOM 0 HA ARG B 49 62.039 -9.049 -10.949 1.00 0.00 H new ATOM 0 HB2 ARG B 49 61.961 -8.812 -13.568 1.00 0.00 H new ATOM 0 HB3 ARG B 49 62.180 -10.551 -13.582 1.00 0.00 H new ATOM 0 HG2 ARG B 49 60.187 -10.807 -12.061 1.00 0.00 H new ATOM 0 HG3 ARG B 49 59.964 -9.069 -12.069 1.00 0.00 H new ATOM 0 HD2 ARG B 49 59.889 -9.257 -14.670 1.00 0.00 H new ATOM 0 HD3 ARG B 49 59.725 -10.985 -14.430 1.00 0.00 H new ATOM 0 HE ARG B 49 57.570 -9.108 -14.189 1.00 0.00 H new ATOM 0 HH11 ARG B 49 58.971 -11.901 -12.629 1.00 0.00 H new ATOM 0 HH12 ARG B 49 57.518 -12.249 -11.687 1.00 0.00 H new ATOM 0 HH21 ARG B 49 55.746 -9.517 -12.946 1.00 0.00 H new ATOM 0 HH22 ARG B 49 55.710 -10.914 -11.865 1.00 0.00 H new ATOM 2442 N THR B 50 63.985 -11.229 -10.460 1.00 0.00 N ATOM 2443 CA THR B 50 64.280 -12.571 -9.880 1.00 0.00 C ATOM 2444 C THR B 50 63.574 -12.672 -8.527 1.00 0.00 C ATOM 2445 O THR B 50 62.437 -12.266 -8.386 1.00 0.00 O ATOM 2446 CB THR B 50 65.791 -12.734 -9.690 1.00 0.00 C ATOM 2447 OG1 THR B 50 66.048 -13.929 -8.966 1.00 0.00 O ATOM 2448 CG2 THR B 50 66.348 -11.538 -8.914 1.00 0.00 C ATOM 0 H THR B 50 64.700 -10.520 -10.300 1.00 0.00 H new ATOM 0 HA THR B 50 63.927 -13.356 -10.549 1.00 0.00 H new ATOM 0 HB THR B 50 66.274 -12.785 -10.666 1.00 0.00 H new ATOM 0 HG1 THR B 50 66.761 -13.769 -8.313 1.00 0.00 H new ATOM 0 HG21 THR B 50 67.423 -11.659 -8.782 1.00 0.00 H new ATOM 0 HG22 THR B 50 66.152 -10.621 -9.469 1.00 0.00 H new ATOM 0 HG23 THR B 50 65.866 -11.481 -7.938 1.00 0.00 H new ATOM 2456 N ASP B 51 64.229 -13.188 -7.523 1.00 0.00 N ATOM 2457 CA ASP B 51 63.569 -13.276 -6.189 1.00 0.00 C ATOM 2458 C ASP B 51 63.674 -11.907 -5.517 1.00 0.00 C ATOM 2459 O ASP B 51 64.665 -11.583 -4.894 1.00 0.00 O ATOM 2460 CB ASP B 51 64.275 -14.329 -5.331 1.00 0.00 C ATOM 2461 CG ASP B 51 63.498 -14.527 -4.028 1.00 0.00 C ATOM 2462 OD1 ASP B 51 62.733 -13.645 -3.678 1.00 0.00 O ATOM 2463 OD2 ASP B 51 63.686 -15.556 -3.401 1.00 0.00 O ATOM 0 H ASP B 51 65.182 -13.549 -7.567 1.00 0.00 H new ATOM 0 HA ASP B 51 62.524 -13.563 -6.302 1.00 0.00 H new ATOM 0 HB2 ASP B 51 64.342 -15.272 -5.874 1.00 0.00 H new ATOM 0 HB3 ASP B 51 65.295 -14.013 -5.114 1.00 0.00 H new ATOM 2468 N GLU B 52 62.666 -11.090 -5.661 1.00 0.00 N ATOM 2469 CA GLU B 52 62.711 -9.725 -5.060 1.00 0.00 C ATOM 2470 C GLU B 52 62.356 -9.772 -3.570 1.00 0.00 C ATOM 2471 O GLU B 52 62.480 -8.791 -2.868 1.00 0.00 O ATOM 2472 CB GLU B 52 61.729 -8.809 -5.794 1.00 0.00 C ATOM 2473 CG GLU B 52 62.195 -8.624 -7.239 1.00 0.00 C ATOM 2474 CD GLU B 52 61.216 -7.709 -7.978 1.00 0.00 C ATOM 2475 OE1 GLU B 52 60.175 -7.414 -7.416 1.00 0.00 O ATOM 2476 OE2 GLU B 52 61.522 -7.326 -9.095 1.00 0.00 O ATOM 0 H GLU B 52 61.810 -11.309 -6.171 1.00 0.00 H new ATOM 0 HA GLU B 52 63.724 -9.336 -5.161 1.00 0.00 H new ATOM 0 HB2 GLU B 52 60.728 -9.240 -5.775 1.00 0.00 H new ATOM 0 HB3 GLU B 52 61.670 -7.843 -5.292 1.00 0.00 H new ATOM 0 HG2 GLU B 52 63.196 -8.193 -7.257 1.00 0.00 H new ATOM 0 HG3 GLU B 52 62.255 -9.590 -7.740 1.00 0.00 H new ATOM 2483 N ALA B 53 61.900 -10.890 -3.080 1.00 0.00 N ATOM 2484 CA ALA B 53 61.526 -10.961 -1.638 1.00 0.00 C ATOM 2485 C ALA B 53 62.660 -10.400 -0.772 1.00 0.00 C ATOM 2486 O ALA B 53 62.467 -9.475 -0.016 1.00 0.00 O ATOM 2487 CB ALA B 53 61.261 -12.417 -1.251 1.00 0.00 C ATOM 0 H ALA B 53 61.770 -11.752 -3.609 1.00 0.00 H new ATOM 0 HA ALA B 53 60.626 -10.368 -1.474 1.00 0.00 H new ATOM 0 HB1 ALA B 53 60.988 -12.469 -0.197 1.00 0.00 H new ATOM 0 HB2 ALA B 53 60.446 -12.812 -1.857 1.00 0.00 H new ATOM 0 HB3 ALA B 53 62.160 -13.008 -1.422 1.00 0.00 H new ATOM 2493 N ALA B 54 63.840 -10.945 -0.862 1.00 0.00 N ATOM 2494 CA ALA B 54 64.957 -10.414 -0.025 1.00 0.00 C ATOM 2495 C ALA B 54 65.227 -8.958 -0.397 1.00 0.00 C ATOM 2496 O ALA B 54 65.384 -8.111 0.455 1.00 0.00 O ATOM 2497 CB ALA B 54 66.207 -11.252 -0.252 1.00 0.00 C ATOM 0 H ALA B 54 64.081 -11.727 -1.471 1.00 0.00 H new ATOM 0 HA ALA B 54 64.681 -10.466 1.028 1.00 0.00 H new ATOM 0 HB1 ALA B 54 67.021 -10.863 0.359 1.00 0.00 H new ATOM 0 HB2 ALA B 54 66.007 -12.287 0.026 1.00 0.00 H new ATOM 0 HB3 ALA B 54 66.489 -11.207 -1.304 1.00 0.00 H new ATOM 2503 N PHE B 55 65.264 -8.642 -1.655 1.00 0.00 N ATOM 2504 CA PHE B 55 65.495 -7.226 -2.028 1.00 0.00 C ATOM 2505 C PHE B 55 64.365 -6.409 -1.424 1.00 0.00 C ATOM 2506 O PHE B 55 64.560 -5.325 -0.908 1.00 0.00 O ATOM 2507 CB PHE B 55 65.451 -7.080 -3.539 1.00 0.00 C ATOM 2508 CG PHE B 55 66.716 -7.643 -4.138 1.00 0.00 C ATOM 2509 CD1 PHE B 55 67.833 -6.819 -4.318 1.00 0.00 C ATOM 2510 CD2 PHE B 55 66.773 -8.992 -4.509 1.00 0.00 C ATOM 2511 CE1 PHE B 55 69.007 -7.345 -4.871 1.00 0.00 C ATOM 2512 CE2 PHE B 55 67.947 -9.515 -5.062 1.00 0.00 C ATOM 2513 CZ PHE B 55 69.063 -8.691 -5.243 1.00 0.00 C ATOM 0 H PHE B 55 65.146 -9.292 -2.432 1.00 0.00 H new ATOM 0 HA PHE B 55 66.467 -6.890 -1.666 1.00 0.00 H new ATOM 0 HB2 PHE B 55 64.583 -7.603 -3.940 1.00 0.00 H new ATOM 0 HB3 PHE B 55 65.344 -6.030 -3.810 1.00 0.00 H new ATOM 0 HD1 PHE B 55 67.789 -5.779 -4.031 1.00 0.00 H new ATOM 0 HD2 PHE B 55 65.912 -9.628 -4.368 1.00 0.00 H new ATOM 0 HE1 PHE B 55 69.870 -6.710 -5.010 1.00 0.00 H new ATOM 0 HE2 PHE B 55 67.992 -10.555 -5.349 1.00 0.00 H new ATOM 0 HZ PHE B 55 69.969 -9.095 -5.671 1.00 0.00 H new ATOM 2523 N GLN B 56 63.180 -6.944 -1.473 1.00 0.00 N ATOM 2524 CA GLN B 56 62.017 -6.232 -0.892 1.00 0.00 C ATOM 2525 C GLN B 56 62.265 -6.032 0.595 1.00 0.00 C ATOM 2526 O GLN B 56 61.833 -5.066 1.176 1.00 0.00 O ATOM 2527 CB GLN B 56 60.739 -7.040 -1.122 1.00 0.00 C ATOM 2528 CG GLN B 56 59.543 -6.306 -0.514 1.00 0.00 C ATOM 2529 CD GLN B 56 58.253 -7.006 -0.939 1.00 0.00 C ATOM 2530 OE1 GLN B 56 58.247 -7.782 -1.875 1.00 0.00 O ATOM 2531 NE2 GLN B 56 57.155 -6.775 -0.276 1.00 0.00 N ATOM 0 H GLN B 56 62.968 -7.849 -1.893 1.00 0.00 H new ATOM 0 HA GLN B 56 61.893 -5.262 -1.374 1.00 0.00 H new ATOM 0 HB2 GLN B 56 60.580 -7.190 -2.190 1.00 0.00 H new ATOM 0 HB3 GLN B 56 60.837 -8.028 -0.673 1.00 0.00 H new ATOM 0 HG2 GLN B 56 59.623 -6.294 0.573 1.00 0.00 H new ATOM 0 HG3 GLN B 56 59.533 -5.267 -0.844 1.00 0.00 H new ATOM 0 HE21 GLN B 56 57.161 -6.124 0.509 1.00 0.00 H new ATOM 0 HE22 GLN B 56 56.290 -7.245 -0.542 1.00 0.00 H new ATOM 2540 N LYS B 57 62.975 -6.932 1.211 1.00 0.00 N ATOM 2541 CA LYS B 57 63.272 -6.769 2.667 1.00 0.00 C ATOM 2542 C LYS B 57 64.240 -5.616 2.810 1.00 0.00 C ATOM 2543 O LYS B 57 64.140 -4.799 3.704 1.00 0.00 O ATOM 2544 CB LYS B 57 63.920 -8.027 3.249 1.00 0.00 C ATOM 2545 CG LYS B 57 62.906 -9.168 3.287 1.00 0.00 C ATOM 2546 CD LYS B 57 63.583 -10.435 3.829 1.00 0.00 C ATOM 2547 CE LYS B 57 62.799 -11.671 3.389 1.00 0.00 C ATOM 2548 NZ LYS B 57 61.337 -11.410 3.526 1.00 0.00 N ATOM 0 H LYS B 57 63.362 -7.770 0.777 1.00 0.00 H new ATOM 0 HA LYS B 57 62.341 -6.587 3.204 1.00 0.00 H new ATOM 0 HB2 LYS B 57 64.781 -8.315 2.646 1.00 0.00 H new ATOM 0 HB3 LYS B 57 64.289 -7.824 4.254 1.00 0.00 H new ATOM 0 HG2 LYS B 57 62.060 -8.896 3.918 1.00 0.00 H new ATOM 0 HG3 LYS B 57 62.512 -9.352 2.288 1.00 0.00 H new ATOM 0 HD2 LYS B 57 64.608 -10.495 3.464 1.00 0.00 H new ATOM 0 HD3 LYS B 57 63.634 -10.394 4.917 1.00 0.00 H new ATOM 0 HE2 LYS B 57 63.039 -11.918 2.355 1.00 0.00 H new ATOM 0 HE3 LYS B 57 63.084 -12.530 3.996 1.00 0.00 H new ATOM 0 HZ1 LYS B 57 60.826 -12.314 3.578 1.00 0.00 H new ATOM 0 HZ2 LYS B 57 61.162 -10.863 4.393 1.00 0.00 H new ATOM 0 HZ3 LYS B 57 61.002 -10.870 2.703 1.00 0.00 H new ATOM 2562 N LEU B 58 65.175 -5.540 1.913 1.00 0.00 N ATOM 2563 CA LEU B 58 66.150 -4.431 1.970 1.00 0.00 C ATOM 2564 C LEU B 58 65.362 -3.168 1.675 1.00 0.00 C ATOM 2565 O LEU B 58 65.530 -2.146 2.303 1.00 0.00 O ATOM 2566 CB LEU B 58 67.247 -4.652 0.921 1.00 0.00 C ATOM 2567 CG LEU B 58 68.327 -3.567 1.048 1.00 0.00 C ATOM 2568 CD1 LEU B 58 69.048 -3.691 2.406 1.00 0.00 C ATOM 2569 CD2 LEU B 58 69.343 -3.732 -0.091 1.00 0.00 C ATOM 0 H LEU B 58 65.304 -6.198 1.144 1.00 0.00 H new ATOM 0 HA LEU B 58 66.641 -4.365 2.941 1.00 0.00 H new ATOM 0 HB2 LEU B 58 67.694 -5.637 1.053 1.00 0.00 H new ATOM 0 HB3 LEU B 58 66.814 -4.630 -0.079 1.00 0.00 H new ATOM 0 HG LEU B 58 67.859 -2.585 0.987 1.00 0.00 H new ATOM 0 HD11 LEU B 58 69.811 -2.917 2.485 1.00 0.00 H new ATOM 0 HD12 LEU B 58 68.326 -3.572 3.214 1.00 0.00 H new ATOM 0 HD13 LEU B 58 69.517 -4.672 2.481 1.00 0.00 H new ATOM 0 HD21 LEU B 58 70.112 -2.965 -0.006 1.00 0.00 H new ATOM 0 HD22 LEU B 58 69.805 -4.717 -0.027 1.00 0.00 H new ATOM 0 HD23 LEU B 58 68.834 -3.632 -1.050 1.00 0.00 H new ATOM 2581 N MET B 59 64.457 -3.259 0.744 1.00 0.00 N ATOM 2582 CA MET B 59 63.598 -2.092 0.434 1.00 0.00 C ATOM 2583 C MET B 59 62.629 -1.908 1.594 1.00 0.00 C ATOM 2584 O MET B 59 62.277 -0.805 1.957 1.00 0.00 O ATOM 2585 CB MET B 59 62.816 -2.331 -0.861 1.00 0.00 C ATOM 2586 CG MET B 59 62.133 -1.032 -1.294 1.00 0.00 C ATOM 2587 SD MET B 59 61.023 -1.363 -2.691 1.00 0.00 S ATOM 2588 CE MET B 59 62.283 -1.646 -3.963 1.00 0.00 C ATOM 0 H MET B 59 64.277 -4.093 0.185 1.00 0.00 H new ATOM 0 HA MET B 59 64.212 -1.202 0.298 1.00 0.00 H new ATOM 0 HB2 MET B 59 63.488 -2.679 -1.645 1.00 0.00 H new ATOM 0 HB3 MET B 59 62.071 -3.112 -0.709 1.00 0.00 H new ATOM 0 HG2 MET B 59 61.570 -0.610 -0.461 1.00 0.00 H new ATOM 0 HG3 MET B 59 62.882 -0.293 -1.579 1.00 0.00 H new ATOM 0 HE1 MET B 59 61.827 -1.569 -4.950 1.00 0.00 H new ATOM 0 HE2 MET B 59 63.071 -0.899 -3.868 1.00 0.00 H new ATOM 0 HE3 MET B 59 62.710 -2.641 -3.837 1.00 0.00 H new ATOM 2598 N SER B 60 62.199 -2.990 2.187 1.00 0.00 N ATOM 2599 CA SER B 60 61.259 -2.870 3.332 1.00 0.00 C ATOM 2600 C SER B 60 61.901 -1.962 4.369 1.00 0.00 C ATOM 2601 O SER B 60 61.233 -1.253 5.095 1.00 0.00 O ATOM 2602 CB SER B 60 60.998 -4.242 3.955 1.00 0.00 C ATOM 2603 OG SER B 60 59.991 -4.120 4.951 1.00 0.00 O ATOM 0 H SER B 60 62.457 -3.942 1.929 1.00 0.00 H new ATOM 0 HA SER B 60 60.309 -2.461 2.989 1.00 0.00 H new ATOM 0 HB2 SER B 60 60.683 -4.949 3.188 1.00 0.00 H new ATOM 0 HB3 SER B 60 61.915 -4.635 4.394 1.00 0.00 H new ATOM 0 HG SER B 60 59.819 -4.998 5.352 1.00 0.00 H new ATOM 2609 N ASN B 61 63.206 -1.967 4.428 1.00 0.00 N ATOM 2610 CA ASN B 61 63.897 -1.083 5.407 1.00 0.00 C ATOM 2611 C ASN B 61 63.688 0.353 4.942 1.00 0.00 C ATOM 2612 O ASN B 61 63.418 1.236 5.721 1.00 0.00 O ATOM 2613 CB ASN B 61 65.393 -1.416 5.478 1.00 0.00 C ATOM 2614 CG ASN B 61 65.585 -2.782 6.139 1.00 0.00 C ATOM 2615 OD1 ASN B 61 66.199 -3.664 5.572 1.00 0.00 O ATOM 2616 ND2 ASN B 61 65.084 -2.995 7.324 1.00 0.00 N ATOM 0 H ASN B 61 63.817 -2.540 3.846 1.00 0.00 H new ATOM 0 HA ASN B 61 63.489 -1.227 6.407 1.00 0.00 H new ATOM 0 HB2 ASN B 61 65.822 -1.422 4.476 1.00 0.00 H new ATOM 0 HB3 ASN B 61 65.920 -0.649 6.046 1.00 0.00 H new ATOM 0 HD21 ASN B 61 65.208 -3.902 7.775 1.00 0.00 H new ATOM 0 HD22 ASN B 61 64.569 -2.255 7.800 1.00 0.00 H new ATOM 2623 N LEU B 62 63.759 0.591 3.664 1.00 0.00 N ATOM 2624 CA LEU B 62 63.499 1.966 3.171 1.00 0.00 C ATOM 2625 C LEU B 62 62.073 2.298 3.622 1.00 0.00 C ATOM 2626 O LEU B 62 61.743 3.418 3.958 1.00 0.00 O ATOM 2627 CB LEU B 62 63.664 1.992 1.625 1.00 0.00 C ATOM 2628 CG LEU B 62 62.569 2.828 0.921 1.00 0.00 C ATOM 2629 CD1 LEU B 62 62.540 4.283 1.459 1.00 0.00 C ATOM 2630 CD2 LEU B 62 62.839 2.832 -0.602 1.00 0.00 C ATOM 0 H LEU B 62 63.983 -0.100 2.948 1.00 0.00 H new ATOM 0 HA LEU B 62 64.194 2.708 3.564 1.00 0.00 H new ATOM 0 HB2 LEU B 62 64.643 2.400 1.375 1.00 0.00 H new ATOM 0 HB3 LEU B 62 63.637 0.971 1.244 1.00 0.00 H new ATOM 0 HG LEU B 62 61.598 2.378 1.127 1.00 0.00 H new ATOM 0 HD11 LEU B 62 61.760 4.845 0.945 1.00 0.00 H new ATOM 0 HD12 LEU B 62 62.333 4.271 2.529 1.00 0.00 H new ATOM 0 HD13 LEU B 62 63.506 4.756 1.281 1.00 0.00 H new ATOM 0 HD21 LEU B 62 62.071 3.419 -1.106 1.00 0.00 H new ATOM 0 HD22 LEU B 62 63.818 3.270 -0.797 1.00 0.00 H new ATOM 0 HD23 LEU B 62 62.818 1.809 -0.978 1.00 0.00 H new ATOM 2642 N ASP B 63 61.241 1.297 3.684 1.00 0.00 N ATOM 2643 CA ASP B 63 59.850 1.505 4.161 1.00 0.00 C ATOM 2644 C ASP B 63 59.863 1.411 5.687 1.00 0.00 C ATOM 2645 O ASP B 63 58.831 1.346 6.327 1.00 0.00 O ATOM 2646 CB ASP B 63 58.932 0.423 3.592 1.00 0.00 C ATOM 2647 CG ASP B 63 58.867 0.558 2.070 1.00 0.00 C ATOM 2648 OD1 ASP B 63 59.258 1.601 1.571 1.00 0.00 O ATOM 2649 OD2 ASP B 63 58.433 -0.385 1.429 1.00 0.00 O ATOM 0 H ASP B 63 61.468 0.338 3.422 1.00 0.00 H new ATOM 0 HA ASP B 63 59.481 2.478 3.835 1.00 0.00 H new ATOM 0 HB2 ASP B 63 59.304 -0.565 3.865 1.00 0.00 H new ATOM 0 HB3 ASP B 63 57.934 0.517 4.019 1.00 0.00 H new ATOM 2654 N SER B 64 61.037 1.394 6.273 1.00 0.00 N ATOM 2655 CA SER B 64 61.135 1.292 7.758 1.00 0.00 C ATOM 2656 C SER B 64 60.361 2.451 8.384 1.00 0.00 C ATOM 2657 O SER B 64 60.058 2.445 9.561 1.00 0.00 O ATOM 2658 CB SER B 64 62.596 1.400 8.203 1.00 0.00 C ATOM 2659 OG SER B 64 62.646 1.510 9.618 1.00 0.00 O ATOM 0 H SER B 64 61.930 1.447 5.784 1.00 0.00 H new ATOM 0 HA SER B 64 60.726 0.332 8.074 1.00 0.00 H new ATOM 0 HB2 SER B 64 63.154 0.524 7.874 1.00 0.00 H new ATOM 0 HB3 SER B 64 63.066 2.269 7.742 1.00 0.00 H new ATOM 0 HG SER B 64 61.790 1.853 9.950 1.00 0.00 H new ATOM 2665 N ASN B 65 60.068 3.459 7.603 1.00 0.00 N ATOM 2666 CA ASN B 65 59.338 4.647 8.132 1.00 0.00 C ATOM 2667 C ASN B 65 60.137 5.239 9.295 1.00 0.00 C ATOM 2668 O ASN B 65 59.588 5.750 10.250 1.00 0.00 O ATOM 2669 CB ASN B 65 57.934 4.240 8.600 1.00 0.00 C ATOM 2670 CG ASN B 65 57.151 3.668 7.417 1.00 0.00 C ATOM 2671 OD1 ASN B 65 56.659 2.559 7.477 1.00 0.00 O ATOM 2672 ND2 ASN B 65 57.014 4.384 6.335 1.00 0.00 N ATOM 0 H ASN B 65 60.306 3.509 6.612 1.00 0.00 H new ATOM 0 HA ASN B 65 59.231 5.394 7.346 1.00 0.00 H new ATOM 0 HB2 ASN B 65 58.005 3.499 9.396 1.00 0.00 H new ATOM 0 HB3 ASN B 65 57.412 5.103 9.013 1.00 0.00 H new ATOM 0 HD21 ASN B 65 56.494 4.012 5.540 1.00 0.00 H new ATOM 0 HD22 ASN B 65 57.427 5.315 6.284 1.00 0.00 H new ATOM 2679 N ARG B 66 61.439 5.176 9.204 1.00 0.00 N ATOM 2680 CA ARG B 66 62.309 5.731 10.280 1.00 0.00 C ATOM 2681 C ARG B 66 63.637 6.171 9.653 1.00 0.00 C ATOM 2682 O ARG B 66 64.195 5.476 8.828 1.00 0.00 O ATOM 2683 CB ARG B 66 62.568 4.647 11.328 1.00 0.00 C ATOM 2684 CG ARG B 66 63.330 5.245 12.511 1.00 0.00 C ATOM 2685 CD ARG B 66 63.584 4.156 13.555 1.00 0.00 C ATOM 2686 NE ARG B 66 64.241 4.757 14.752 1.00 0.00 N ATOM 2687 CZ ARG B 66 64.285 4.089 15.875 1.00 0.00 C ATOM 2688 NH1 ARG B 66 63.743 2.904 15.953 1.00 0.00 N ATOM 2689 NH2 ARG B 66 64.870 4.608 16.921 1.00 0.00 N ATOM 0 H ARG B 66 61.942 4.759 8.421 1.00 0.00 H new ATOM 0 HA ARG B 66 61.824 6.582 10.758 1.00 0.00 H new ATOM 0 HB2 ARG B 66 61.623 4.224 11.668 1.00 0.00 H new ATOM 0 HB3 ARG B 66 63.142 3.832 10.888 1.00 0.00 H new ATOM 0 HG2 ARG B 66 64.276 5.667 12.172 1.00 0.00 H new ATOM 0 HG3 ARG B 66 62.757 6.060 12.952 1.00 0.00 H new ATOM 0 HD2 ARG B 66 62.643 3.685 13.841 1.00 0.00 H new ATOM 0 HD3 ARG B 66 64.216 3.374 13.134 1.00 0.00 H new ATOM 0 HE ARG B 66 64.655 5.687 14.694 1.00 0.00 H new ATOM 0 HH11 ARG B 66 63.285 2.498 15.137 1.00 0.00 H new ATOM 0 HH12 ARG B 66 63.778 2.384 16.830 1.00 0.00 H new ATOM 0 HH21 ARG B 66 65.293 5.534 16.862 1.00 0.00 H new ATOM 0 HH22 ARG B 66 64.904 4.087 17.797 1.00 0.00 H new ATOM 2703 N ASP B 67 64.155 7.314 10.020 1.00 0.00 N ATOM 2704 CA ASP B 67 65.445 7.759 9.412 1.00 0.00 C ATOM 2705 C ASP B 67 65.322 7.685 7.886 1.00 0.00 C ATOM 2706 O ASP B 67 65.672 6.700 7.272 1.00 0.00 O ATOM 2707 CB ASP B 67 66.578 6.845 9.885 1.00 0.00 C ATOM 2708 CG ASP B 67 67.919 7.415 9.418 1.00 0.00 C ATOM 2709 OD1 ASP B 67 67.911 8.209 8.492 1.00 0.00 O ATOM 2710 OD2 ASP B 67 68.929 7.048 9.993 1.00 0.00 O ATOM 0 H ASP B 67 63.748 7.951 10.705 1.00 0.00 H new ATOM 0 HA ASP B 67 65.666 8.782 9.715 1.00 0.00 H new ATOM 0 HB2 ASP B 67 66.564 6.763 10.972 1.00 0.00 H new ATOM 0 HB3 ASP B 67 66.439 5.840 9.487 1.00 0.00 H new ATOM 2715 N ASN B 68 64.795 8.714 7.276 1.00 0.00 N ATOM 2716 CA ASN B 68 64.609 8.710 5.790 1.00 0.00 C ATOM 2717 C ASN B 68 65.841 9.276 5.072 1.00 0.00 C ATOM 2718 O ASN B 68 65.788 9.554 3.890 1.00 0.00 O ATOM 2719 CB ASN B 68 63.390 9.569 5.442 1.00 0.00 C ATOM 2720 CG ASN B 68 63.647 11.020 5.855 1.00 0.00 C ATOM 2721 OD1 ASN B 68 64.621 11.312 6.520 1.00 0.00 O ATOM 2722 ND2 ASN B 68 62.806 11.949 5.486 1.00 0.00 N ATOM 0 H ASN B 68 64.482 9.564 7.745 1.00 0.00 H new ATOM 0 HA ASN B 68 64.464 7.681 5.462 1.00 0.00 H new ATOM 0 HB2 ASN B 68 63.189 9.515 4.372 1.00 0.00 H new ATOM 0 HB3 ASN B 68 62.506 9.187 5.952 1.00 0.00 H new ATOM 0 HD21 ASN B 68 62.967 12.919 5.756 1.00 0.00 H new ATOM 0 HD22 ASN B 68 61.988 11.704 4.928 1.00 0.00 H new ATOM 2729 N GLU B 69 66.944 9.458 5.763 1.00 0.00 N ATOM 2730 CA GLU B 69 68.174 10.020 5.101 1.00 0.00 C ATOM 2731 C GLU B 69 69.260 8.942 4.982 1.00 0.00 C ATOM 2732 O GLU B 69 69.348 8.030 5.781 1.00 0.00 O ATOM 2733 CB GLU B 69 68.716 11.190 5.932 1.00 0.00 C ATOM 2734 CG GLU B 69 69.655 12.046 5.075 1.00 0.00 C ATOM 2735 CD GLU B 69 68.845 12.802 4.020 1.00 0.00 C ATOM 2736 OE1 GLU B 69 67.636 12.879 4.170 1.00 0.00 O ATOM 2737 OE2 GLU B 69 69.447 13.292 3.077 1.00 0.00 O ATOM 0 H GLU B 69 67.048 9.243 6.755 1.00 0.00 H new ATOM 0 HA GLU B 69 67.905 10.366 4.103 1.00 0.00 H new ATOM 0 HB2 GLU B 69 67.891 11.798 6.302 1.00 0.00 H new ATOM 0 HB3 GLU B 69 69.249 10.812 6.805 1.00 0.00 H new ATOM 0 HG2 GLU B 69 70.197 12.751 5.705 1.00 0.00 H new ATOM 0 HG3 GLU B 69 70.399 11.413 4.591 1.00 0.00 H new ATOM 2744 N VAL B 70 70.083 9.061 3.978 1.00 0.00 N ATOM 2745 CA VAL B 70 71.189 8.082 3.742 1.00 0.00 C ATOM 2746 C VAL B 70 72.521 8.809 3.874 1.00 0.00 C ATOM 2747 O VAL B 70 72.866 9.642 3.060 1.00 0.00 O ATOM 2748 CB VAL B 70 71.054 7.566 2.315 1.00 0.00 C ATOM 2749 CG1 VAL B 70 71.907 6.325 2.110 1.00 0.00 C ATOM 2750 CG2 VAL B 70 69.594 7.231 2.028 1.00 0.00 C ATOM 0 H VAL B 70 70.036 9.814 3.292 1.00 0.00 H new ATOM 0 HA VAL B 70 71.141 7.262 4.458 1.00 0.00 H new ATOM 0 HB VAL B 70 71.396 8.343 1.631 1.00 0.00 H new ATOM 0 HG11 VAL B 70 71.796 5.973 1.084 1.00 0.00 H new ATOM 0 HG12 VAL B 70 72.953 6.567 2.300 1.00 0.00 H new ATOM 0 HG13 VAL B 70 71.585 5.544 2.799 1.00 0.00 H new ATOM 0 HG21 VAL B 70 69.499 6.862 1.007 1.00 0.00 H new ATOM 0 HG22 VAL B 70 69.253 6.464 2.724 1.00 0.00 H new ATOM 0 HG23 VAL B 70 68.985 8.127 2.148 1.00 0.00 H new ATOM 2760 N ASP B 71 73.289 8.477 4.861 1.00 0.00 N ATOM 2761 CA ASP B 71 74.614 9.129 4.997 1.00 0.00 C ATOM 2762 C ASP B 71 75.531 8.443 3.999 1.00 0.00 C ATOM 2763 O ASP B 71 75.184 7.417 3.450 1.00 0.00 O ATOM 2764 CB ASP B 71 75.160 8.941 6.416 1.00 0.00 C ATOM 2765 CG ASP B 71 74.335 9.773 7.400 1.00 0.00 C ATOM 2766 OD1 ASP B 71 73.673 10.697 6.955 1.00 0.00 O ATOM 2767 OD2 ASP B 71 74.378 9.470 8.581 1.00 0.00 O ATOM 0 H ASP B 71 73.062 7.787 5.577 1.00 0.00 H new ATOM 0 HA ASP B 71 74.544 10.200 4.809 1.00 0.00 H new ATOM 0 HB2 ASP B 71 75.122 7.888 6.694 1.00 0.00 H new ATOM 0 HB3 ASP B 71 76.206 9.244 6.457 1.00 0.00 H new ATOM 2772 N PHE B 72 76.689 8.968 3.745 1.00 0.00 N ATOM 2773 CA PHE B 72 77.573 8.291 2.775 1.00 0.00 C ATOM 2774 C PHE B 72 77.726 6.840 3.219 1.00 0.00 C ATOM 2775 O PHE B 72 77.759 5.925 2.420 1.00 0.00 O ATOM 2776 CB PHE B 72 78.939 8.967 2.766 1.00 0.00 C ATOM 2777 CG PHE B 72 79.744 8.389 1.639 1.00 0.00 C ATOM 2778 CD1 PHE B 72 80.524 7.248 1.847 1.00 0.00 C ATOM 2779 CD2 PHE B 72 79.693 8.984 0.377 1.00 0.00 C ATOM 2780 CE1 PHE B 72 81.259 6.705 0.790 1.00 0.00 C ATOM 2781 CE2 PHE B 72 80.423 8.442 -0.679 1.00 0.00 C ATOM 2782 CZ PHE B 72 81.209 7.301 -0.476 1.00 0.00 C ATOM 0 H PHE B 72 77.056 9.824 4.161 1.00 0.00 H new ATOM 0 HA PHE B 72 77.149 8.344 1.772 1.00 0.00 H new ATOM 0 HB2 PHE B 72 78.829 10.044 2.640 1.00 0.00 H new ATOM 0 HB3 PHE B 72 79.448 8.808 3.717 1.00 0.00 H new ATOM 0 HD1 PHE B 72 80.559 6.787 2.823 1.00 0.00 H new ATOM 0 HD2 PHE B 72 79.088 9.864 0.219 1.00 0.00 H new ATOM 0 HE1 PHE B 72 81.866 5.826 0.949 1.00 0.00 H new ATOM 0 HE2 PHE B 72 80.383 8.902 -1.655 1.00 0.00 H new ATOM 0 HZ PHE B 72 81.775 6.882 -1.294 1.00 0.00 H new ATOM 2792 N GLN B 73 77.817 6.637 4.501 1.00 0.00 N ATOM 2793 CA GLN B 73 77.965 5.263 5.040 1.00 0.00 C ATOM 2794 C GLN B 73 76.669 4.459 4.850 1.00 0.00 C ATOM 2795 O GLN B 73 76.717 3.290 4.530 1.00 0.00 O ATOM 2796 CB GLN B 73 78.301 5.355 6.533 1.00 0.00 C ATOM 2797 CG GLN B 73 78.466 3.952 7.124 1.00 0.00 C ATOM 2798 CD GLN B 73 78.854 4.071 8.599 1.00 0.00 C ATOM 2799 OE1 GLN B 73 78.288 4.863 9.327 1.00 0.00 O ATOM 2800 NE2 GLN B 73 79.802 3.311 9.075 1.00 0.00 N ATOM 0 H GLN B 73 77.795 7.374 5.205 1.00 0.00 H new ATOM 0 HA GLN B 73 78.764 4.752 4.503 1.00 0.00 H new ATOM 0 HB2 GLN B 73 79.218 5.927 6.672 1.00 0.00 H new ATOM 0 HB3 GLN B 73 77.510 5.889 7.059 1.00 0.00 H new ATOM 0 HG2 GLN B 73 77.537 3.391 7.024 1.00 0.00 H new ATOM 0 HG3 GLN B 73 79.232 3.402 6.577 1.00 0.00 H new ATOM 0 HE21 GLN B 73 80.277 2.646 8.465 1.00 0.00 H new ATOM 0 HE22 GLN B 73 80.068 3.382 10.057 1.00 0.00 H new ATOM 2809 N GLU B 74 75.508 5.044 5.045 1.00 0.00 N ATOM 2810 CA GLU B 74 74.264 4.248 4.874 1.00 0.00 C ATOM 2811 C GLU B 74 74.113 3.826 3.420 1.00 0.00 C ATOM 2812 O GLU B 74 73.717 2.715 3.128 1.00 0.00 O ATOM 2813 CB GLU B 74 73.057 5.080 5.301 1.00 0.00 C ATOM 2814 CG GLU B 74 73.071 5.274 6.821 1.00 0.00 C ATOM 2815 CD GLU B 74 72.821 3.932 7.515 1.00 0.00 C ATOM 2816 OE1 GLU B 74 72.235 3.065 6.892 1.00 0.00 O ATOM 2817 OE2 GLU B 74 73.224 3.796 8.658 1.00 0.00 O ATOM 0 H GLU B 74 75.376 6.020 5.310 1.00 0.00 H new ATOM 0 HA GLU B 74 74.323 3.356 5.497 1.00 0.00 H new ATOM 0 HB2 GLU B 74 73.077 6.049 4.801 1.00 0.00 H new ATOM 0 HB3 GLU B 74 72.136 4.583 4.997 1.00 0.00 H new ATOM 0 HG2 GLU B 74 74.030 5.684 7.136 1.00 0.00 H new ATOM 0 HG3 GLU B 74 72.306 5.993 7.113 1.00 0.00 H new ATOM 2824 N TYR B 75 74.426 4.690 2.502 1.00 0.00 N ATOM 2825 CA TYR B 75 74.290 4.304 1.077 1.00 0.00 C ATOM 2826 C TYR B 75 75.198 3.095 0.831 1.00 0.00 C ATOM 2827 O TYR B 75 74.847 2.162 0.136 1.00 0.00 O ATOM 2828 CB TYR B 75 74.717 5.477 0.179 1.00 0.00 C ATOM 2829 CG TYR B 75 74.983 4.994 -1.237 1.00 0.00 C ATOM 2830 CD1 TYR B 75 74.009 4.255 -1.923 1.00 0.00 C ATOM 2831 CD2 TYR B 75 76.208 5.280 -1.859 1.00 0.00 C ATOM 2832 CE1 TYR B 75 74.260 3.806 -3.227 1.00 0.00 C ATOM 2833 CE2 TYR B 75 76.458 4.828 -3.161 1.00 0.00 C ATOM 2834 CZ TYR B 75 75.483 4.091 -3.845 1.00 0.00 C ATOM 2835 OH TYR B 75 75.730 3.643 -5.128 1.00 0.00 O ATOM 0 H TYR B 75 74.766 5.636 2.674 1.00 0.00 H new ATOM 0 HA TYR B 75 73.255 4.052 0.844 1.00 0.00 H new ATOM 0 HB2 TYR B 75 73.937 6.238 0.169 1.00 0.00 H new ATOM 0 HB3 TYR B 75 75.614 5.945 0.584 1.00 0.00 H new ATOM 0 HD1 TYR B 75 73.066 4.032 -1.447 1.00 0.00 H new ATOM 0 HD2 TYR B 75 76.960 5.850 -1.333 1.00 0.00 H new ATOM 0 HE1 TYR B 75 73.508 3.239 -3.756 1.00 0.00 H new ATOM 0 HE2 TYR B 75 77.402 5.048 -3.637 1.00 0.00 H new ATOM 0 HH TYR B 75 76.625 3.928 -5.407 1.00 0.00 H new ATOM 2845 N CYS B 76 76.360 3.115 1.415 1.00 0.00 N ATOM 2846 CA CYS B 76 77.312 1.990 1.257 1.00 0.00 C ATOM 2847 C CYS B 76 76.758 0.775 1.991 1.00 0.00 C ATOM 2848 O CYS B 76 76.868 -0.339 1.525 1.00 0.00 O ATOM 2849 CB CYS B 76 78.671 2.377 1.841 1.00 0.00 C ATOM 2850 SG CYS B 76 79.285 3.854 0.993 1.00 0.00 S ATOM 0 H CYS B 76 76.694 3.877 2.005 1.00 0.00 H new ATOM 0 HA CYS B 76 77.439 1.756 0.200 1.00 0.00 H new ATOM 0 HB2 CYS B 76 78.579 2.569 2.910 1.00 0.00 H new ATOM 0 HB3 CYS B 76 79.378 1.556 1.724 1.00 0.00 H new ATOM 0 HG CYS B 76 78.595 4.889 1.370 1.00 0.00 H new ATOM 2856 N VAL B 77 76.140 0.974 3.128 1.00 0.00 N ATOM 2857 CA VAL B 77 75.571 -0.195 3.844 1.00 0.00 C ATOM 2858 C VAL B 77 74.550 -0.836 2.916 1.00 0.00 C ATOM 2859 O VAL B 77 74.479 -2.043 2.788 1.00 0.00 O ATOM 2860 CB VAL B 77 74.884 0.268 5.134 1.00 0.00 C ATOM 2861 CG1 VAL B 77 74.077 -0.892 5.732 1.00 0.00 C ATOM 2862 CG2 VAL B 77 75.943 0.732 6.148 1.00 0.00 C ATOM 0 H VAL B 77 76.009 1.879 3.580 1.00 0.00 H new ATOM 0 HA VAL B 77 76.353 -0.906 4.111 1.00 0.00 H new ATOM 0 HB VAL B 77 74.214 1.097 4.906 1.00 0.00 H new ATOM 0 HG11 VAL B 77 73.589 -0.561 6.649 1.00 0.00 H new ATOM 0 HG12 VAL B 77 73.322 -1.217 5.016 1.00 0.00 H new ATOM 0 HG13 VAL B 77 74.746 -1.723 5.956 1.00 0.00 H new ATOM 0 HG21 VAL B 77 75.451 1.060 7.064 1.00 0.00 H new ATOM 0 HG22 VAL B 77 76.617 -0.094 6.374 1.00 0.00 H new ATOM 0 HG23 VAL B 77 76.513 1.559 5.726 1.00 0.00 H new ATOM 2872 N PHE B 78 73.777 -0.033 2.238 1.00 0.00 N ATOM 2873 CA PHE B 78 72.789 -0.599 1.290 1.00 0.00 C ATOM 2874 C PHE B 78 73.543 -1.219 0.114 1.00 0.00 C ATOM 2875 O PHE B 78 73.205 -2.285 -0.354 1.00 0.00 O ATOM 2876 CB PHE B 78 71.869 0.513 0.770 1.00 0.00 C ATOM 2877 CG PHE B 78 70.850 0.876 1.828 1.00 0.00 C ATOM 2878 CD1 PHE B 78 69.886 -0.063 2.213 1.00 0.00 C ATOM 2879 CD2 PHE B 78 70.863 2.146 2.418 1.00 0.00 C ATOM 2880 CE1 PHE B 78 68.935 0.266 3.186 1.00 0.00 C ATOM 2881 CE2 PHE B 78 69.912 2.476 3.391 1.00 0.00 C ATOM 2882 CZ PHE B 78 68.948 1.536 3.776 1.00 0.00 C ATOM 0 H PHE B 78 73.790 0.985 2.302 1.00 0.00 H new ATOM 0 HA PHE B 78 72.186 -1.354 1.794 1.00 0.00 H new ATOM 0 HB2 PHE B 78 72.459 1.390 0.505 1.00 0.00 H new ATOM 0 HB3 PHE B 78 71.362 0.183 -0.137 1.00 0.00 H new ATOM 0 HD1 PHE B 78 69.876 -1.043 1.759 1.00 0.00 H new ATOM 0 HD2 PHE B 78 71.607 2.871 2.122 1.00 0.00 H new ATOM 0 HE1 PHE B 78 68.191 -0.459 3.482 1.00 0.00 H new ATOM 0 HE2 PHE B 78 69.922 3.456 3.845 1.00 0.00 H new ATOM 0 HZ PHE B 78 68.215 1.790 4.527 1.00 0.00 H new ATOM 2892 N LEU B 79 74.569 -0.565 -0.369 1.00 0.00 N ATOM 2893 CA LEU B 79 75.333 -1.143 -1.515 1.00 0.00 C ATOM 2894 C LEU B 79 76.114 -2.369 -1.033 1.00 0.00 C ATOM 2895 O LEU B 79 76.262 -3.348 -1.737 1.00 0.00 O ATOM 2896 CB LEU B 79 76.297 -0.096 -2.076 1.00 0.00 C ATOM 2897 CG LEU B 79 76.960 -0.610 -3.364 1.00 0.00 C ATOM 2898 CD1 LEU B 79 75.920 -0.736 -4.497 1.00 0.00 C ATOM 2899 CD2 LEU B 79 78.058 0.381 -3.775 1.00 0.00 C ATOM 0 H LEU B 79 74.907 0.333 -0.024 1.00 0.00 H new ATOM 0 HA LEU B 79 74.641 -1.441 -2.302 1.00 0.00 H new ATOM 0 HB2 LEU B 79 75.759 0.829 -2.281 1.00 0.00 H new ATOM 0 HB3 LEU B 79 77.061 0.137 -1.335 1.00 0.00 H new ATOM 0 HG LEU B 79 77.388 -1.596 -3.184 1.00 0.00 H new ATOM 0 HD11 LEU B 79 76.409 -1.101 -5.400 1.00 0.00 H new ATOM 0 HD12 LEU B 79 75.140 -1.436 -4.198 1.00 0.00 H new ATOM 0 HD13 LEU B 79 75.476 0.240 -4.694 1.00 0.00 H new ATOM 0 HD21 LEU B 79 78.540 0.032 -4.688 1.00 0.00 H new ATOM 0 HD22 LEU B 79 77.616 1.362 -3.950 1.00 0.00 H new ATOM 0 HD23 LEU B 79 78.799 0.454 -2.979 1.00 0.00 H new ATOM 2911 N SER B 80 76.611 -2.312 0.170 1.00 0.00 N ATOM 2912 CA SER B 80 77.386 -3.452 0.732 1.00 0.00 C ATOM 2913 C SER B 80 76.432 -4.607 0.967 1.00 0.00 C ATOM 2914 O SER B 80 76.725 -5.747 0.669 1.00 0.00 O ATOM 2915 CB SER B 80 78.016 -3.035 2.061 1.00 0.00 C ATOM 2916 OG SER B 80 78.888 -4.064 2.508 1.00 0.00 O ATOM 0 H SER B 80 76.512 -1.513 0.796 1.00 0.00 H new ATOM 0 HA SER B 80 78.175 -3.748 0.040 1.00 0.00 H new ATOM 0 HB2 SER B 80 78.567 -2.102 1.939 1.00 0.00 H new ATOM 0 HB3 SER B 80 77.239 -2.852 2.804 1.00 0.00 H new ATOM 0 HG SER B 80 79.811 -3.838 2.268 1.00 0.00 H new ATOM 2922 N CYS B 81 75.272 -4.308 1.473 1.00 0.00 N ATOM 2923 CA CYS B 81 74.272 -5.373 1.700 1.00 0.00 C ATOM 2924 C CYS B 81 73.980 -6.002 0.350 1.00 0.00 C ATOM 2925 O CYS B 81 73.825 -7.201 0.226 1.00 0.00 O ATOM 2926 CB CYS B 81 72.990 -4.768 2.272 1.00 0.00 C ATOM 2927 SG CYS B 81 71.699 -6.034 2.331 1.00 0.00 S ATOM 0 H CYS B 81 74.976 -3.369 1.739 1.00 0.00 H new ATOM 0 HA CYS B 81 74.647 -6.114 2.406 1.00 0.00 H new ATOM 0 HB2 CYS B 81 73.175 -4.376 3.272 1.00 0.00 H new ATOM 0 HB3 CYS B 81 72.664 -3.930 1.656 1.00 0.00 H new ATOM 0 HG CYS B 81 70.995 -5.886 3.414 1.00 0.00 H new ATOM 2933 N ILE B 82 73.929 -5.195 -0.675 1.00 0.00 N ATOM 2934 CA ILE B 82 73.676 -5.756 -2.031 1.00 0.00 C ATOM 2935 C ILE B 82 74.903 -6.552 -2.471 1.00 0.00 C ATOM 2936 O ILE B 82 74.793 -7.613 -3.050 1.00 0.00 O ATOM 2937 CB ILE B 82 73.389 -4.624 -3.023 1.00 0.00 C ATOM 2938 CG1 ILE B 82 72.021 -4.011 -2.699 1.00 0.00 C ATOM 2939 CG2 ILE B 82 73.394 -5.169 -4.457 1.00 0.00 C ATOM 2940 CD1 ILE B 82 71.820 -2.724 -3.502 1.00 0.00 C ATOM 0 H ILE B 82 74.050 -4.183 -0.633 1.00 0.00 H new ATOM 0 HA ILE B 82 72.807 -6.413 -2.003 1.00 0.00 H new ATOM 0 HB ILE B 82 74.161 -3.859 -2.939 1.00 0.00 H new ATOM 0 HG12 ILE B 82 71.230 -4.723 -2.934 1.00 0.00 H new ATOM 0 HG13 ILE B 82 71.952 -3.798 -1.632 1.00 0.00 H new ATOM 0 HG21 ILE B 82 73.189 -4.358 -5.155 1.00 0.00 H new ATOM 0 HG22 ILE B 82 74.370 -5.601 -4.679 1.00 0.00 H new ATOM 0 HG23 ILE B 82 72.626 -5.936 -4.557 1.00 0.00 H new ATOM 0 HD11 ILE B 82 70.846 -2.296 -3.265 1.00 0.00 H new ATOM 0 HD12 ILE B 82 72.602 -2.009 -3.246 1.00 0.00 H new ATOM 0 HD13 ILE B 82 71.868 -2.949 -4.568 1.00 0.00 H new ATOM 2952 N ALA B 83 76.074 -6.058 -2.188 1.00 0.00 N ATOM 2953 CA ALA B 83 77.296 -6.804 -2.579 1.00 0.00 C ATOM 2954 C ALA B 83 77.296 -8.163 -1.881 1.00 0.00 C ATOM 2955 O ALA B 83 77.494 -9.185 -2.498 1.00 0.00 O ATOM 2956 CB ALA B 83 78.534 -6.025 -2.156 1.00 0.00 C ATOM 0 H ALA B 83 76.236 -5.174 -1.705 1.00 0.00 H new ATOM 0 HA ALA B 83 77.307 -6.939 -3.661 1.00 0.00 H new ATOM 0 HB1 ALA B 83 79.428 -6.577 -2.446 1.00 0.00 H new ATOM 0 HB2 ALA B 83 78.535 -5.051 -2.645 1.00 0.00 H new ATOM 0 HB3 ALA B 83 78.526 -5.889 -1.075 1.00 0.00 H new ATOM 2962 N MET B 84 77.062 -8.187 -0.597 1.00 0.00 N ATOM 2963 CA MET B 84 77.036 -9.491 0.125 1.00 0.00 C ATOM 2964 C MET B 84 75.866 -10.310 -0.391 1.00 0.00 C ATOM 2965 O MET B 84 75.929 -11.521 -0.476 1.00 0.00 O ATOM 2966 CB MET B 84 76.903 -9.251 1.627 1.00 0.00 C ATOM 2967 CG MET B 84 78.209 -8.649 2.150 1.00 0.00 C ATOM 2968 SD MET B 84 78.064 -8.339 3.928 1.00 0.00 S ATOM 2969 CE MET B 84 76.815 -7.031 3.829 1.00 0.00 C ATOM 0 H MET B 84 76.889 -7.365 -0.019 1.00 0.00 H new ATOM 0 HA MET B 84 77.964 -10.035 -0.051 1.00 0.00 H new ATOM 0 HB2 MET B 84 76.070 -8.578 1.829 1.00 0.00 H new ATOM 0 HB3 MET B 84 76.687 -10.188 2.141 1.00 0.00 H new ATOM 0 HG2 MET B 84 79.038 -9.329 1.955 1.00 0.00 H new ATOM 0 HG3 MET B 84 78.429 -7.719 1.625 1.00 0.00 H new ATOM 0 HE1 MET B 84 76.813 -6.459 4.757 1.00 0.00 H new ATOM 0 HE2 MET B 84 77.047 -6.368 2.995 1.00 0.00 H new ATOM 0 HE3 MET B 84 75.832 -7.477 3.675 1.00 0.00 H new ATOM 2979 N MET B 85 74.806 -9.660 -0.768 1.00 0.00 N ATOM 2980 CA MET B 85 73.653 -10.409 -1.309 1.00 0.00 C ATOM 2981 C MET B 85 74.151 -11.155 -2.544 1.00 0.00 C ATOM 2982 O MET B 85 73.695 -12.237 -2.856 1.00 0.00 O ATOM 2983 CB MET B 85 72.528 -9.438 -1.686 1.00 0.00 C ATOM 2984 CG MET B 85 71.295 -10.228 -2.133 1.00 0.00 C ATOM 2985 SD MET B 85 70.605 -11.138 -0.724 1.00 0.00 S ATOM 2986 CE MET B 85 70.109 -9.711 0.279 1.00 0.00 C ATOM 0 H MET B 85 74.691 -8.647 -0.724 1.00 0.00 H new ATOM 0 HA MET B 85 73.254 -11.106 -0.572 1.00 0.00 H new ATOM 0 HB2 MET B 85 72.278 -8.807 -0.833 1.00 0.00 H new ATOM 0 HB3 MET B 85 72.858 -8.776 -2.487 1.00 0.00 H new ATOM 0 HG2 MET B 85 70.546 -9.550 -2.542 1.00 0.00 H new ATOM 0 HG3 MET B 85 71.565 -10.922 -2.929 1.00 0.00 H new ATOM 0 HE1 MET B 85 69.252 -9.980 0.896 1.00 0.00 H new ATOM 0 HE2 MET B 85 70.938 -9.411 0.920 1.00 0.00 H new ATOM 0 HE3 MET B 85 69.839 -8.882 -0.376 1.00 0.00 H new ATOM 2996 N CYS B 86 75.113 -10.594 -3.240 1.00 0.00 N ATOM 2997 CA CYS B 86 75.658 -11.296 -4.436 1.00 0.00 C ATOM 2998 C CYS B 86 76.917 -10.587 -4.937 1.00 0.00 C ATOM 2999 O CYS B 86 76.909 -9.942 -5.966 1.00 0.00 O ATOM 3000 CB CYS B 86 74.606 -11.316 -5.544 1.00 0.00 C ATOM 3001 SG CYS B 86 75.179 -12.365 -6.903 1.00 0.00 S ATOM 0 H CYS B 86 75.537 -9.690 -3.031 1.00 0.00 H new ATOM 0 HA CYS B 86 75.914 -12.318 -4.159 1.00 0.00 H new ATOM 0 HB2 CYS B 86 73.660 -11.692 -5.155 1.00 0.00 H new ATOM 0 HB3 CYS B 86 74.423 -10.304 -5.904 1.00 0.00 H new ATOM 0 HG CYS B 86 74.283 -12.383 -7.845 1.00 0.00 H new ATOM 3007 N ASN B 87 78.001 -10.701 -4.218 1.00 0.00 N ATOM 3008 CA ASN B 87 79.259 -10.032 -4.658 1.00 0.00 C ATOM 3009 C ASN B 87 79.853 -10.789 -5.848 1.00 0.00 C ATOM 3010 O ASN B 87 80.322 -10.196 -6.800 1.00 0.00 O ATOM 3011 CB ASN B 87 80.269 -10.014 -3.503 1.00 0.00 C ATOM 3012 CG ASN B 87 80.634 -11.448 -3.105 1.00 0.00 C ATOM 3013 OD1 ASN B 87 79.714 -12.371 -3.117 1.00 0.00 O flip ATOM 3014 ND2 ASN B 87 81.769 -11.727 -2.773 1.00 0.00 N flip ATOM 0 H ASN B 87 78.070 -11.227 -3.347 1.00 0.00 H new ATOM 0 HA ASN B 87 79.036 -9.007 -4.955 1.00 0.00 H new ATOM 0 HB2 ASN B 87 81.166 -9.471 -3.801 1.00 0.00 H new ATOM 0 HB3 ASN B 87 79.847 -9.487 -2.648 1.00 0.00 H new ATOM 0 HD21 ASN B 87 82.490 -11.005 -2.763 1.00 0.00 H new ATOM 0 HD22 ASN B 87 82.001 -12.683 -2.504 1.00 0.00 H new ATOM 3021 N GLU B 88 79.837 -12.093 -5.801 1.00 0.00 N ATOM 3022 CA GLU B 88 80.399 -12.887 -6.929 1.00 0.00 C ATOM 3023 C GLU B 88 79.974 -14.351 -6.782 1.00 0.00 C ATOM 3024 O GLU B 88 79.713 -15.034 -7.753 1.00 0.00 O ATOM 3025 CB GLU B 88 81.930 -12.779 -6.912 1.00 0.00 C ATOM 3026 CG GLU B 88 82.485 -13.408 -5.631 1.00 0.00 C ATOM 3027 CD GLU B 88 83.992 -13.155 -5.552 1.00 0.00 C ATOM 3028 OE1 GLU B 88 84.584 -12.887 -6.584 1.00 0.00 O ATOM 3029 OE2 GLU B 88 84.530 -13.237 -4.460 1.00 0.00 O ATOM 0 H GLU B 88 79.459 -12.643 -5.030 1.00 0.00 H new ATOM 0 HA GLU B 88 80.023 -12.501 -7.876 1.00 0.00 H new ATOM 0 HB2 GLU B 88 82.348 -13.281 -7.784 1.00 0.00 H new ATOM 0 HB3 GLU B 88 82.230 -11.733 -6.973 1.00 0.00 H new ATOM 0 HG2 GLU B 88 81.988 -12.983 -4.759 1.00 0.00 H new ATOM 0 HG3 GLU B 88 82.284 -14.479 -5.622 1.00 0.00 H new ATOM 3036 N PHE B 89 79.906 -14.838 -5.572 1.00 0.00 N ATOM 3037 CA PHE B 89 79.501 -16.256 -5.361 1.00 0.00 C ATOM 3038 C PHE B 89 78.041 -16.444 -5.770 1.00 0.00 C ATOM 3039 O PHE B 89 77.203 -15.596 -5.536 1.00 0.00 O ATOM 3040 CB PHE B 89 79.670 -16.631 -3.890 1.00 0.00 C ATOM 3041 CG PHE B 89 81.138 -16.665 -3.548 1.00 0.00 C ATOM 3042 CD1 PHE B 89 81.864 -17.852 -3.697 1.00 0.00 C ATOM 3043 CD2 PHE B 89 81.772 -15.509 -3.077 1.00 0.00 C ATOM 3044 CE1 PHE B 89 83.225 -17.884 -3.375 1.00 0.00 C ATOM 3045 CE2 PHE B 89 83.133 -15.541 -2.754 1.00 0.00 C ATOM 3046 CZ PHE B 89 83.860 -16.729 -2.903 1.00 0.00 C ATOM 0 H PHE B 89 80.114 -14.315 -4.721 1.00 0.00 H new ATOM 0 HA PHE B 89 80.134 -16.900 -5.972 1.00 0.00 H new ATOM 0 HB2 PHE B 89 79.154 -15.908 -3.257 1.00 0.00 H new ATOM 0 HB3 PHE B 89 79.218 -17.604 -3.697 1.00 0.00 H new ATOM 0 HD1 PHE B 89 81.374 -18.743 -4.060 1.00 0.00 H new ATOM 0 HD2 PHE B 89 81.211 -14.593 -2.963 1.00 0.00 H new ATOM 0 HE1 PHE B 89 83.786 -18.800 -3.491 1.00 0.00 H new ATOM 0 HE2 PHE B 89 83.623 -14.650 -2.390 1.00 0.00 H new ATOM 0 HZ PHE B 89 84.911 -16.754 -2.654 1.00 0.00 H new ATOM 3056 N PHE B 90 77.734 -17.550 -6.386 1.00 0.00 N ATOM 3057 CA PHE B 90 76.333 -17.806 -6.824 1.00 0.00 C ATOM 3058 C PHE B 90 75.507 -18.352 -5.656 1.00 0.00 C ATOM 3059 O PHE B 90 74.302 -18.477 -5.747 1.00 0.00 O ATOM 3060 CB PHE B 90 76.339 -18.830 -7.960 1.00 0.00 C ATOM 3061 CG PHE B 90 77.116 -20.048 -7.526 1.00 0.00 C ATOM 3062 CD1 PHE B 90 76.461 -21.105 -6.883 1.00 0.00 C ATOM 3063 CD2 PHE B 90 78.493 -20.117 -7.763 1.00 0.00 C ATOM 3064 CE1 PHE B 90 77.186 -22.232 -6.478 1.00 0.00 C ATOM 3065 CE2 PHE B 90 79.218 -21.244 -7.359 1.00 0.00 C ATOM 3066 CZ PHE B 90 78.564 -22.301 -6.714 1.00 0.00 C ATOM 0 H PHE B 90 78.397 -18.293 -6.607 1.00 0.00 H new ATOM 0 HA PHE B 90 75.890 -16.871 -7.168 1.00 0.00 H new ATOM 0 HB2 PHE B 90 75.318 -19.109 -8.220 1.00 0.00 H new ATOM 0 HB3 PHE B 90 76.788 -18.397 -8.854 1.00 0.00 H new ATOM 0 HD1 PHE B 90 75.398 -21.051 -6.700 1.00 0.00 H new ATOM 0 HD2 PHE B 90 78.997 -19.300 -8.258 1.00 0.00 H new ATOM 0 HE1 PHE B 90 76.682 -23.049 -5.983 1.00 0.00 H new ATOM 0 HE2 PHE B 90 80.281 -21.298 -7.544 1.00 0.00 H new ATOM 0 HZ PHE B 90 79.123 -23.170 -6.399 1.00 0.00 H new ATOM 3076 N GLU B 91 76.135 -18.687 -4.563 1.00 0.00 N ATOM 3077 CA GLU B 91 75.361 -19.231 -3.411 1.00 0.00 C ATOM 3078 C GLU B 91 74.270 -18.234 -3.013 1.00 0.00 C ATOM 3079 O GLU B 91 74.537 -17.087 -2.716 1.00 0.00 O ATOM 3080 CB GLU B 91 76.300 -19.463 -2.221 1.00 0.00 C ATOM 3081 CG GLU B 91 77.233 -20.652 -2.498 1.00 0.00 C ATOM 3082 CD GLU B 91 78.402 -20.209 -3.382 1.00 0.00 C ATOM 3083 OE1 GLU B 91 78.176 -19.969 -4.556 1.00 0.00 O ATOM 3084 OE2 GLU B 91 79.504 -20.113 -2.867 1.00 0.00 O ATOM 0 H GLU B 91 77.142 -18.609 -4.417 1.00 0.00 H new ATOM 0 HA GLU B 91 74.903 -20.177 -3.699 1.00 0.00 H new ATOM 0 HB2 GLU B 91 76.890 -18.566 -2.035 1.00 0.00 H new ATOM 0 HB3 GLU B 91 75.716 -19.653 -1.321 1.00 0.00 H new ATOM 0 HG2 GLU B 91 77.610 -21.055 -1.558 1.00 0.00 H new ATOM 0 HG3 GLU B 91 76.679 -21.452 -2.988 1.00 0.00 H new ATOM 3091 N GLY B 92 73.037 -18.670 -3.010 1.00 0.00 N ATOM 3092 CA GLY B 92 71.908 -17.765 -2.638 1.00 0.00 C ATOM 3093 C GLY B 92 71.664 -17.823 -1.127 1.00 0.00 C ATOM 3094 O GLY B 92 70.665 -17.336 -0.636 1.00 0.00 O ATOM 0 H GLY B 92 72.762 -19.622 -3.251 1.00 0.00 H new ATOM 0 HA2 GLY B 92 72.137 -16.743 -2.938 1.00 0.00 H new ATOM 0 HA3 GLY B 92 71.004 -18.059 -3.172 1.00 0.00 H new ATOM 3098 N PHE B 93 72.554 -18.422 -0.385 1.00 0.00 N ATOM 3099 CA PHE B 93 72.345 -18.513 1.090 1.00 0.00 C ATOM 3100 C PHE B 93 72.503 -17.110 1.715 1.00 0.00 C ATOM 3101 O PHE B 93 73.230 -16.289 1.193 1.00 0.00 O ATOM 3102 CB PHE B 93 73.382 -19.473 1.685 1.00 0.00 C ATOM 3103 CG PHE B 93 72.964 -20.903 1.416 1.00 0.00 C ATOM 3104 CD1 PHE B 93 72.078 -21.552 2.287 1.00 0.00 C ATOM 3105 CD2 PHE B 93 73.459 -21.577 0.295 1.00 0.00 C ATOM 3106 CE1 PHE B 93 71.691 -22.874 2.036 1.00 0.00 C ATOM 3107 CE2 PHE B 93 73.072 -22.899 0.044 1.00 0.00 C ATOM 3108 CZ PHE B 93 72.188 -23.546 0.913 1.00 0.00 C ATOM 0 H PHE B 93 73.412 -18.850 -0.732 1.00 0.00 H new ATOM 0 HA PHE B 93 71.344 -18.887 1.303 1.00 0.00 H new ATOM 0 HB2 PHE B 93 74.362 -19.282 1.248 1.00 0.00 H new ATOM 0 HB3 PHE B 93 73.473 -19.306 2.758 1.00 0.00 H new ATOM 0 HD1 PHE B 93 71.694 -21.032 3.152 1.00 0.00 H new ATOM 0 HD2 PHE B 93 74.140 -21.077 -0.378 1.00 0.00 H new ATOM 0 HE1 PHE B 93 71.010 -23.375 2.708 1.00 0.00 H new ATOM 0 HE2 PHE B 93 73.456 -23.419 -0.821 1.00 0.00 H new ATOM 0 HZ PHE B 93 71.888 -24.565 0.718 1.00 0.00 H new ATOM 3118 N PRO B 94 71.828 -16.817 2.818 1.00 0.00 N ATOM 3119 CA PRO B 94 71.943 -15.468 3.451 1.00 0.00 C ATOM 3120 C PRO B 94 73.341 -15.208 4.030 1.00 0.00 C ATOM 3121 O PRO B 94 73.660 -15.642 5.119 1.00 0.00 O ATOM 3122 CB PRO B 94 70.883 -15.536 4.568 1.00 0.00 C ATOM 3123 CG PRO B 94 70.516 -17.013 4.777 1.00 0.00 C ATOM 3124 CD PRO B 94 70.919 -17.783 3.507 1.00 0.00 C ATOM 0 HA PRO B 94 71.790 -14.655 2.741 1.00 0.00 H new ATOM 0 HB2 PRO B 94 71.272 -15.105 5.490 1.00 0.00 H new ATOM 0 HB3 PRO B 94 70.001 -14.958 4.293 1.00 0.00 H new ATOM 0 HG2 PRO B 94 71.033 -17.415 5.648 1.00 0.00 H new ATOM 0 HG3 PRO B 94 69.447 -17.118 4.964 1.00 0.00 H new ATOM 0 HD2 PRO B 94 71.425 -18.719 3.743 1.00 0.00 H new ATOM 0 HD3 PRO B 94 70.054 -18.035 2.893 1.00 0.00 H new ATOM 3132 N ASP B 95 74.164 -14.488 3.311 1.00 0.00 N ATOM 3133 CA ASP B 95 75.539 -14.172 3.809 1.00 0.00 C ATOM 3134 C ASP B 95 75.619 -12.683 4.146 1.00 0.00 C ATOM 3135 O ASP B 95 76.690 -12.130 4.298 1.00 0.00 O ATOM 3136 CB ASP B 95 76.563 -14.496 2.721 1.00 0.00 C ATOM 3137 CG ASP B 95 76.328 -13.590 1.511 1.00 0.00 C ATOM 3138 OD1 ASP B 95 75.235 -13.059 1.398 1.00 0.00 O ATOM 3139 OD2 ASP B 95 77.243 -13.441 0.719 1.00 0.00 O ATOM 0 H ASP B 95 73.941 -14.102 2.393 1.00 0.00 H new ATOM 0 HA ASP B 95 75.751 -14.766 4.698 1.00 0.00 H new ATOM 0 HB2 ASP B 95 77.573 -14.354 3.104 1.00 0.00 H new ATOM 0 HB3 ASP B 95 76.478 -15.542 2.427 1.00 0.00 H new ATOM 3144 N LYS B 96 74.495 -12.029 4.261 1.00 0.00 N ATOM 3145 CA LYS B 96 74.515 -10.575 4.583 1.00 0.00 C ATOM 3146 C LYS B 96 74.873 -10.380 6.059 1.00 0.00 C ATOM 3147 O LYS B 96 76.015 -10.514 6.452 1.00 0.00 O ATOM 3148 CB LYS B 96 73.141 -9.951 4.288 1.00 0.00 C ATOM 3149 CG LYS B 96 72.016 -10.919 4.675 1.00 0.00 C ATOM 3150 CD LYS B 96 70.680 -10.174 4.617 1.00 0.00 C ATOM 3151 CE LYS B 96 69.528 -11.149 4.876 1.00 0.00 C ATOM 3152 NZ LYS B 96 68.229 -10.428 4.733 1.00 0.00 N ATOM 0 H LYS B 96 73.567 -12.437 4.146 1.00 0.00 H new ATOM 0 HA LYS B 96 75.265 -10.082 3.964 1.00 0.00 H new ATOM 0 HB2 LYS B 96 73.032 -9.018 4.842 1.00 0.00 H new ATOM 0 HB3 LYS B 96 73.067 -9.704 3.229 1.00 0.00 H new ATOM 0 HG2 LYS B 96 72.002 -11.772 3.996 1.00 0.00 H new ATOM 0 HG3 LYS B 96 72.185 -11.312 5.677 1.00 0.00 H new ATOM 0 HD2 LYS B 96 70.666 -9.376 5.359 1.00 0.00 H new ATOM 0 HD3 LYS B 96 70.558 -9.704 3.641 1.00 0.00 H new ATOM 0 HE2 LYS B 96 69.575 -11.980 4.172 1.00 0.00 H new ATOM 0 HE3 LYS B 96 69.613 -11.573 5.877 1.00 0.00 H new ATOM 0 HZ1 LYS B 96 67.445 -11.088 4.908 1.00 0.00 H new ATOM 0 HZ2 LYS B 96 68.187 -9.649 5.421 1.00 0.00 H new ATOM 0 HZ3 LYS B 96 68.149 -10.044 3.770 1.00 0.00 H new