USER MOD reduce.3.24.130724 H: found=0, std=0, add=1668, rem=0, adj=49 USER MOD reduce.3.24.130724 removed 1666 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 55 SER OG : rot -76:sc= 1.45 USER MOD Set 1.2: B 85 LYS NZ :NH3+ -167:sc= 0.32! (180deg=-0.692!) USER MOD Set 2.1: B 36 ASN : amide:sc= 0.745 K(o=2.4,f=-0.22) USER MOD Set 2.2: B 67 GLN : amide:sc= 1.7 K(o=2.4,f=-1.5) USER MOD Set 3.1: B 1 MET N :NH3+ 179:sc= 1.15 (180deg=-0.0947) USER MOD Set 3.2: B 7 THR OG1 : rot 50:sc= 1.73 USER MOD Set 4.1: A 48 HIS : no HE2:sc= 2.18 K(o=3,f=-19!) USER MOD Set 4.2: A 89 LYS NZ :NH3+ 140:sc= 0.831 (180deg=-1.63!) USER MOD Set 5.1: A 55 SER OG : rot -80:sc= 2.36 USER MOD Set 5.2: A 85 LYS NZ :NH3+ 172:sc= 2.17 (180deg=1.01) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -121:sc= 0.123 (180deg=-0.0754) USER MOD Single : A 7 THR OG1 : rot 79:sc= 1.21 USER MOD Single : A 12 SER OG : rot 72:sc= 1.24 USER MOD Single : A 15 THR OG1 : rot 74:sc= 1.21 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot -46:sc= 1.25 USER MOD Single : A 22 THR OG1 : rot -170:sc= -0.0208 USER MOD Single : A 26 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 30 LYS NZ :NH3+ -111:sc= 0.572 (180deg=-2.76!) USER MOD Single : A 32 SER OG : rot -101:sc= 1.24 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 36 ASN : amide:sc= -1.02 K(o=-1,f=-2.6!) USER MOD Single : A 39 LYS NZ :NH3+ 179:sc= 1.24 (180deg=1.17) USER MOD Single : A 43 THR OG1 : rot -38:sc= 0.0507 USER MOD Single : A 44 GLN : amide:sc= -0.0219 X(o=-0.022,f=0) USER MOD Single : A 45 GLN : amide:sc= -0.995 K(o=-0.99,f=-1.5) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 LYS NZ :NH3+ -168:sc= 1.14 (180deg=0.864) USER MOD Single : A 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ -119:sc= 0.857 (180deg=0.447) USER MOD Single : A 62 SER OG : rot 86:sc= 1.24 USER MOD Single : A 66 ASN : amide:sc= -0.0741 K(o=-0.074,f=-0.79) USER MOD Single : A 67 GLN : amide:sc= -1.06 X(o=-1.1,f=-0.98) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ -154:sc= 2.39 (180deg=2.13) USER MOD Single : A 74 ASN : amide:sc= -1.1 K(o=-1.1,f=-3.5!) USER MOD Single : A 76 TYR OH : rot 30:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ -171:sc= 1.28 (180deg=0.803!) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 LYS NZ :NH3+ 146:sc= -0.314 (180deg=-1.42) USER MOD Single : B 1 MET CE :methyl -167:sc= 0 (180deg=-0.03) USER MOD Single : B 12 SER OG : rot 69:sc= 1.17 USER MOD Single : B 15 THR OG1 : rot 54:sc= 1.31 USER MOD Single : B 18 THR OG1 : rot 80:sc= 1.02 USER MOD Single : B 19 THR OG1 : rot -81:sc= 1.33 USER MOD Single : B 22 THR OG1 : rot -56:sc= 0.65 USER MOD Single : B 26 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 30 LYS NZ :NH3+ 177:sc= 1.15 (180deg=0.995) USER MOD Single : B 32 SER OG : rot 140:sc= 0.344 USER MOD Single : B 34 SER OG : rot 180:sc= 0 USER MOD Single : B 39 LYS NZ :NH3+ 180:sc= 1.11 (180deg=1.11) USER MOD Single : B 43 THR OG1 : rot -150:sc= -0.12 USER MOD Single : B 44 GLN : amide:sc= 0 X(o=0,f=-0.016) USER MOD Single : B 45 GLN : amide:sc= -0.188 K(o=-0.19,f=-2.2!) USER MOD Single : B 48 HIS : no HE2:sc= 0.899 K(o=0.9,f=-4.1!) USER MOD Single : B 51 LYS NZ :NH3+ -174:sc= 1.24 (180deg=1.04) USER MOD Single : B 59 LYS NZ :NH3+ -173:sc= -0.938 (180deg=-1.31) USER MOD Single : B 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 61 LYS NZ :NH3+ -174:sc= 1.11 (180deg=0.85) USER MOD Single : B 62 SER OG : rot 180:sc= 0 USER MOD Single : B 66 ASN : amide:sc= -0.311 X(o=-0.31,f=-0.27) USER MOD Single : B 69 SER OG : rot 180:sc= 0 USER MOD Single : B 72 LYS NZ :NH3+ -163:sc= 1.85 (180deg=1.28) USER MOD Single : B 74 ASN : amide:sc= -0.0866 K(o=-0.087,f=-3!) USER MOD Single : B 76 TYR OH : rot 120:sc= -0.141 USER MOD Single : B 89 LYS NZ :NH3+ -138:sc= -0.0335 (180deg=-2.9) USER MOD Single : B 90 LYS NZ :NH3+ -168:sc= 1.2 (180deg=1.13) USER MOD Single : B 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 94 LYS NZ :NH3+ -173:sc= 3.58 (180deg=3.22) USER MOD Single : B 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -9.989 -12.932 15.504 1.00 5.47 N ATOM 2 CA MET A 1 -9.633 -13.609 14.245 1.00 4.16 C ATOM 3 C MET A 1 -10.915 -14.258 13.741 1.00 3.15 C ATOM 4 O MET A 1 -11.699 -14.684 14.585 1.00 3.71 O ATOM 5 CB MET A 1 -8.560 -14.681 14.479 1.00 4.17 C ATOM 6 CG MET A 1 -7.200 -14.110 14.906 1.00 5.62 C ATOM 7 SD MET A 1 -5.972 -15.381 15.298 1.00 6.55 S ATOM 8 CE MET A 1 -4.575 -14.340 15.776 1.00 8.30 C ATOM 0 H1 MET A 1 -9.781 -11.916 15.423 1.00 5.47 H new ATOM 0 H2 MET A 1 -11.003 -13.064 15.694 1.00 5.47 H new ATOM 0 H3 MET A 1 -9.434 -13.337 16.285 1.00 5.47 H new ATOM 0 HA MET A 1 -9.224 -12.901 13.525 1.00 4.16 H new ATOM 0 HB2 MET A 1 -8.911 -15.372 15.245 1.00 4.17 H new ATOM 0 HB3 MET A 1 -8.430 -15.259 13.564 1.00 4.17 H new ATOM 0 HG2 MET A 1 -6.814 -13.477 14.107 1.00 5.62 H new ATOM 0 HG3 MET A 1 -7.341 -13.471 15.778 1.00 5.62 H new ATOM 0 HE1 MET A 1 -3.729 -14.970 16.049 1.00 8.30 H new ATOM 0 HE2 MET A 1 -4.295 -13.700 14.939 1.00 8.30 H new ATOM 0 HE3 MET A 1 -4.857 -13.721 16.628 1.00 8.30 H new ATOM 20 N ALA A 2 -11.165 -14.276 12.430 1.00 2.87 N ATOM 21 CA ALA A 2 -12.321 -14.940 11.851 1.00 2.74 C ATOM 22 C ALA A 2 -12.064 -15.265 10.390 1.00 1.84 C ATOM 23 O ALA A 2 -11.068 -14.835 9.813 1.00 2.69 O ATOM 24 CB ALA A 2 -13.607 -14.125 12.018 1.00 4.87 C ATOM 0 H ALA A 2 -10.563 -13.825 11.741 1.00 2.87 H new ATOM 0 HA ALA A 2 -12.471 -15.871 12.397 1.00 2.74 H new ATOM 0 HB1 ALA A 2 -14.441 -14.665 11.569 1.00 4.87 H new ATOM 0 HB2 ALA A 2 -13.804 -13.970 13.079 1.00 4.87 H new ATOM 0 HB3 ALA A 2 -13.492 -13.159 11.526 1.00 4.87 H new ATOM 30 N ALA A 3 -13.017 -15.999 9.828 1.00 2.19 N ATOM 31 CA ALA A 3 -13.130 -16.344 8.428 1.00 2.62 C ATOM 32 C ALA A 3 -14.228 -15.463 7.841 1.00 2.55 C ATOM 33 O ALA A 3 -15.342 -15.916 7.585 1.00 3.40 O ATOM 34 CB ALA A 3 -13.446 -17.837 8.291 1.00 3.96 C ATOM 0 H ALA A 3 -13.779 -16.392 10.381 1.00 2.19 H new ATOM 0 HA ALA A 3 -12.200 -16.170 7.887 1.00 2.62 H new ATOM 0 HB1 ALA A 3 -13.531 -18.096 7.236 1.00 3.96 H new ATOM 0 HB2 ALA A 3 -12.645 -18.421 8.745 1.00 3.96 H new ATOM 0 HB3 ALA A 3 -14.387 -18.058 8.795 1.00 3.96 H new ATOM 40 N GLU A 4 -13.887 -14.198 7.614 1.00 1.72 N ATOM 41 CA GLU A 4 -14.777 -13.259 6.936 1.00 1.73 C ATOM 42 C GLU A 4 -14.727 -13.547 5.430 1.00 1.78 C ATOM 43 O GLU A 4 -13.826 -14.253 4.975 1.00 1.80 O ATOM 44 CB GLU A 4 -14.302 -11.829 7.199 1.00 1.70 C ATOM 45 CG GLU A 4 -12.783 -11.662 7.265 1.00 1.90 C ATOM 46 CD GLU A 4 -12.376 -10.210 7.055 1.00 3.02 C ATOM 47 OE1 GLU A 4 -13.255 -9.344 7.237 1.00 3.83 O ATOM 48 OE2 GLU A 4 -11.181 -10.002 6.753 1.00 4.30 O ATOM 0 H GLU A 4 -12.992 -13.796 7.893 1.00 1.72 H new ATOM 0 HA GLU A 4 -15.796 -13.371 7.306 1.00 1.73 H new ATOM 0 HB2 GLU A 4 -14.691 -11.181 6.414 1.00 1.70 H new ATOM 0 HB3 GLU A 4 -14.733 -11.485 8.139 1.00 1.70 H new ATOM 0 HG2 GLU A 4 -12.419 -12.008 8.232 1.00 1.90 H new ATOM 0 HG3 GLU A 4 -12.313 -12.287 6.506 1.00 1.90 H new ATOM 55 N PRO A 5 -15.671 -13.037 4.621 1.00 1.89 N ATOM 56 CA PRO A 5 -15.720 -13.360 3.207 1.00 2.06 C ATOM 57 C PRO A 5 -14.766 -12.425 2.456 1.00 2.06 C ATOM 58 O PRO A 5 -15.181 -11.708 1.548 1.00 2.27 O ATOM 59 CB PRO A 5 -17.194 -13.175 2.836 1.00 2.27 C ATOM 60 CG PRO A 5 -17.651 -12.022 3.735 1.00 2.24 C ATOM 61 CD PRO A 5 -16.722 -12.082 4.955 1.00 1.94 C ATOM 0 HA PRO A 5 -15.396 -14.369 2.951 1.00 2.06 H new ATOM 0 HB2 PRO A 5 -17.314 -12.932 1.780 1.00 2.27 H new ATOM 0 HB3 PRO A 5 -17.771 -14.081 3.022 1.00 2.27 H new ATOM 0 HG2 PRO A 5 -17.568 -11.064 3.222 1.00 2.24 H new ATOM 0 HG3 PRO A 5 -18.695 -12.138 4.027 1.00 2.24 H new ATOM 0 HD2 PRO A 5 -16.301 -11.100 5.172 1.00 1.94 H new ATOM 0 HD3 PRO A 5 -17.267 -12.399 5.844 1.00 1.94 H new ATOM 69 N LEU A 6 -13.495 -12.411 2.870 1.00 1.84 N ATOM 70 CA LEU A 6 -12.558 -11.357 2.501 1.00 1.61 C ATOM 71 C LEU A 6 -11.904 -11.536 1.124 1.00 1.39 C ATOM 72 O LEU A 6 -11.904 -12.624 0.548 1.00 1.69 O ATOM 73 CB LEU A 6 -11.494 -11.196 3.596 1.00 1.60 C ATOM 74 CG LEU A 6 -10.343 -12.221 3.581 1.00 1.67 C ATOM 75 CD1 LEU A 6 -9.385 -11.896 4.730 1.00 1.68 C ATOM 76 CD2 LEU A 6 -10.796 -13.675 3.745 1.00 3.15 C ATOM 0 H LEU A 6 -13.092 -13.131 3.469 1.00 1.84 H new ATOM 0 HA LEU A 6 -13.149 -10.445 2.415 1.00 1.61 H new ATOM 0 HB2 LEU A 6 -11.065 -10.197 3.513 1.00 1.60 H new ATOM 0 HB3 LEU A 6 -11.989 -11.251 4.566 1.00 1.60 H new ATOM 0 HG LEU A 6 -9.872 -12.140 2.601 1.00 1.67 H new ATOM 0 HD11 LEU A 6 -8.564 -12.613 4.733 1.00 1.68 H new ATOM 0 HD12 LEU A 6 -8.987 -10.890 4.599 1.00 1.68 H new ATOM 0 HD13 LEU A 6 -9.921 -11.954 5.678 1.00 1.68 H new ATOM 0 HD21 LEU A 6 -9.926 -14.332 3.724 1.00 3.15 H new ATOM 0 HD22 LEU A 6 -11.314 -13.790 4.697 1.00 3.15 H new ATOM 0 HD23 LEU A 6 -11.471 -13.940 2.931 1.00 3.15 H new ATOM 88 N THR A 7 -11.323 -10.441 0.633 1.00 1.01 N ATOM 89 CA THR A 7 -10.713 -10.264 -0.679 1.00 0.86 C ATOM 90 C THR A 7 -9.219 -9.919 -0.507 1.00 0.75 C ATOM 91 O THR A 7 -8.799 -9.521 0.583 1.00 0.92 O ATOM 92 CB THR A 7 -11.488 -9.147 -1.419 1.00 0.92 C ATOM 93 OG1 THR A 7 -12.776 -8.919 -0.869 1.00 1.36 O ATOM 94 CG2 THR A 7 -11.701 -9.510 -2.891 1.00 1.21 C ATOM 0 H THR A 7 -11.264 -9.588 1.190 1.00 1.01 H new ATOM 0 HA THR A 7 -10.767 -11.178 -1.271 1.00 0.86 H new ATOM 0 HB THR A 7 -10.875 -8.252 -1.312 1.00 0.92 H new ATOM 0 HG1 THR A 7 -12.693 -8.379 -0.055 1.00 1.36 H new ATOM 0 HG21 THR A 7 -12.248 -8.709 -3.388 1.00 1.21 H new ATOM 0 HG22 THR A 7 -10.734 -9.645 -3.376 1.00 1.21 H new ATOM 0 HG23 THR A 7 -12.273 -10.435 -2.958 1.00 1.21 H new ATOM 102 N GLU A 8 -8.383 -10.050 -1.550 1.00 0.81 N ATOM 103 CA GLU A 8 -6.946 -9.840 -1.364 1.00 0.91 C ATOM 104 C GLU A 8 -6.646 -8.379 -1.029 1.00 0.86 C ATOM 105 O GLU A 8 -5.708 -8.095 -0.287 1.00 0.92 O ATOM 106 CB GLU A 8 -6.083 -10.282 -2.562 1.00 1.38 C ATOM 107 CG GLU A 8 -6.689 -11.380 -3.439 1.00 1.19 C ATOM 108 CD GLU A 8 -7.528 -10.733 -4.523 1.00 1.91 C ATOM 109 OE1 GLU A 8 -8.718 -10.496 -4.224 1.00 2.59 O ATOM 110 OE2 GLU A 8 -6.930 -10.402 -5.572 1.00 2.83 O ATOM 0 H GLU A 8 -8.668 -10.292 -2.499 1.00 0.81 H new ATOM 0 HA GLU A 8 -6.671 -10.482 -0.527 1.00 0.91 H new ATOM 0 HB2 GLU A 8 -5.884 -9.411 -3.186 1.00 1.38 H new ATOM 0 HB3 GLU A 8 -5.121 -10.631 -2.186 1.00 1.38 H new ATOM 0 HG2 GLU A 8 -5.900 -11.986 -3.884 1.00 1.19 H new ATOM 0 HG3 GLU A 8 -7.303 -12.049 -2.836 1.00 1.19 H new ATOM 117 N LEU A 9 -7.405 -7.441 -1.607 1.00 0.80 N ATOM 118 CA LEU A 9 -7.080 -6.029 -1.512 1.00 0.76 C ATOM 119 C LEU A 9 -7.143 -5.614 -0.039 1.00 0.76 C ATOM 120 O LEU A 9 -6.139 -5.179 0.533 1.00 0.82 O ATOM 121 CB LEU A 9 -8.039 -5.204 -2.385 1.00 0.76 C ATOM 122 CG LEU A 9 -7.941 -5.398 -3.913 1.00 0.77 C ATOM 123 CD1 LEU A 9 -6.598 -4.931 -4.473 1.00 1.76 C ATOM 124 CD2 LEU A 9 -8.263 -6.817 -4.403 1.00 1.91 C ATOM 0 H LEU A 9 -8.248 -7.643 -2.144 1.00 0.80 H new ATOM 0 HA LEU A 9 -6.073 -5.842 -1.884 1.00 0.76 H new ATOM 0 HB2 LEU A 9 -9.059 -5.436 -2.079 1.00 0.76 H new ATOM 0 HB3 LEU A 9 -7.873 -4.149 -2.166 1.00 0.76 H new ATOM 0 HG LEU A 9 -8.729 -4.757 -4.309 1.00 0.77 H new ATOM 0 HD11 LEU A 9 -6.579 -5.089 -5.551 1.00 1.76 H new ATOM 0 HD12 LEU A 9 -6.463 -3.871 -4.259 1.00 1.76 H new ATOM 0 HD13 LEU A 9 -5.793 -5.500 -4.009 1.00 1.76 H new ATOM 0 HD21 LEU A 9 -8.168 -6.858 -5.488 1.00 1.91 H new ATOM 0 HD22 LEU A 9 -7.568 -7.524 -3.951 1.00 1.91 H new ATOM 0 HD23 LEU A 9 -9.282 -7.078 -4.118 1.00 1.91 H new ATOM 136 N GLU A 10 -8.312 -5.805 0.584 1.00 0.74 N ATOM 137 CA GLU A 10 -8.480 -5.592 2.013 1.00 0.78 C ATOM 138 C GLU A 10 -7.411 -6.345 2.798 1.00 0.75 C ATOM 139 O GLU A 10 -6.707 -5.726 3.588 1.00 0.76 O ATOM 140 CB GLU A 10 -9.897 -5.938 2.476 1.00 0.92 C ATOM 141 CG GLU A 10 -10.346 -7.361 2.144 1.00 1.97 C ATOM 142 CD GLU A 10 -11.808 -7.559 2.492 1.00 3.12 C ATOM 143 OE1 GLU A 10 -12.240 -6.984 3.512 1.00 3.11 O ATOM 144 OE2 GLU A 10 -12.454 -8.291 1.711 1.00 4.85 O ATOM 0 H GLU A 10 -9.161 -6.110 0.108 1.00 0.74 H new ATOM 0 HA GLU A 10 -8.346 -4.529 2.216 1.00 0.78 H new ATOM 0 HB2 GLU A 10 -9.958 -5.794 3.555 1.00 0.92 H new ATOM 0 HB3 GLU A 10 -10.595 -5.235 2.021 1.00 0.92 H new ATOM 0 HG2 GLU A 10 -10.190 -7.558 1.083 1.00 1.97 H new ATOM 0 HG3 GLU A 10 -9.736 -8.077 2.695 1.00 1.97 H new ATOM 151 N GLU A 11 -7.233 -7.647 2.554 1.00 0.80 N ATOM 152 CA GLU A 11 -6.259 -8.422 3.312 1.00 0.95 C ATOM 153 C GLU A 11 -4.855 -7.816 3.192 1.00 0.82 C ATOM 154 O GLU A 11 -4.082 -7.819 4.152 1.00 0.82 O ATOM 155 CB GLU A 11 -6.314 -9.902 2.899 1.00 1.08 C ATOM 156 CG GLU A 11 -5.474 -10.844 3.786 1.00 1.33 C ATOM 157 CD GLU A 11 -6.066 -11.126 5.168 1.00 3.48 C ATOM 158 OE1 GLU A 11 -6.629 -10.192 5.779 1.00 4.83 O ATOM 159 OE2 GLU A 11 -5.959 -12.289 5.608 1.00 4.49 O ATOM 0 H GLU A 11 -7.744 -8.176 1.847 1.00 0.80 H new ATOM 0 HA GLU A 11 -6.517 -8.378 4.370 1.00 0.95 H new ATOM 0 HB2 GLU A 11 -7.352 -10.234 2.919 1.00 1.08 H new ATOM 0 HB3 GLU A 11 -5.971 -9.992 1.868 1.00 1.08 H new ATOM 0 HG2 GLU A 11 -5.343 -11.791 3.263 1.00 1.33 H new ATOM 0 HG3 GLU A 11 -4.482 -10.411 3.913 1.00 1.33 H new ATOM 166 N SER A 12 -4.513 -7.238 2.036 1.00 0.78 N ATOM 167 CA SER A 12 -3.201 -6.637 1.879 1.00 0.77 C ATOM 168 C SER A 12 -3.103 -5.392 2.748 1.00 0.66 C ATOM 169 O SER A 12 -2.097 -5.157 3.419 1.00 0.72 O ATOM 170 CB SER A 12 -2.923 -6.306 0.409 1.00 0.82 C ATOM 171 OG SER A 12 -3.029 -7.468 -0.387 1.00 1.78 O ATOM 0 H SER A 12 -5.117 -7.178 1.216 1.00 0.78 H new ATOM 0 HA SER A 12 -2.443 -7.351 2.201 1.00 0.77 H new ATOM 0 HB2 SER A 12 -3.629 -5.553 0.060 1.00 0.82 H new ATOM 0 HB3 SER A 12 -1.925 -5.879 0.308 1.00 0.82 H new ATOM 0 HG SER A 12 -3.970 -7.730 -0.459 1.00 1.78 H new ATOM 177 N ILE A 13 -4.168 -4.592 2.747 1.00 0.56 N ATOM 178 CA ILE A 13 -4.230 -3.405 3.575 1.00 0.52 C ATOM 179 C ILE A 13 -4.083 -3.794 5.043 1.00 0.53 C ATOM 180 O ILE A 13 -3.248 -3.225 5.745 1.00 0.52 O ATOM 181 CB ILE A 13 -5.523 -2.637 3.266 1.00 0.55 C ATOM 182 CG1 ILE A 13 -5.381 -2.028 1.869 1.00 0.79 C ATOM 183 CG2 ILE A 13 -5.860 -1.518 4.257 1.00 0.52 C ATOM 184 CD1 ILE A 13 -6.728 -1.910 1.193 1.00 0.55 C ATOM 0 H ILE A 13 -4.999 -4.752 2.177 1.00 0.56 H new ATOM 0 HA ILE A 13 -3.404 -2.730 3.352 1.00 0.52 H new ATOM 0 HB ILE A 13 -6.340 -3.355 3.340 1.00 0.55 H new ATOM 0 HG12 ILE A 13 -4.919 -1.044 1.942 1.00 0.79 H new ATOM 0 HG13 ILE A 13 -4.719 -2.647 1.264 1.00 0.79 H new ATOM 0 HG21 ILE A 13 -6.789 -1.033 3.957 1.00 0.52 H new ATOM 0 HG22 ILE A 13 -5.977 -1.939 5.255 1.00 0.52 H new ATOM 0 HG23 ILE A 13 -5.054 -0.784 4.265 1.00 0.52 H new ATOM 0 HD11 ILE A 13 -6.601 -1.475 0.202 1.00 0.55 H new ATOM 0 HD12 ILE A 13 -7.176 -2.899 1.100 1.00 0.55 H new ATOM 0 HD13 ILE A 13 -7.380 -1.271 1.789 1.00 0.55 H new ATOM 196 N GLU A 14 -4.874 -4.774 5.485 1.00 0.58 N ATOM 197 CA GLU A 14 -4.835 -5.359 6.816 1.00 0.59 C ATOM 198 C GLU A 14 -3.397 -5.724 7.174 1.00 0.63 C ATOM 199 O GLU A 14 -2.881 -5.297 8.203 1.00 0.68 O ATOM 200 CB GLU A 14 -5.744 -6.587 6.859 1.00 0.67 C ATOM 201 CG GLU A 14 -7.196 -6.196 6.562 1.00 2.06 C ATOM 202 CD GLU A 14 -7.992 -6.054 7.840 1.00 3.43 C ATOM 203 OE1 GLU A 14 -8.466 -7.117 8.295 1.00 3.83 O ATOM 204 OE2 GLU A 14 -8.062 -4.918 8.357 1.00 4.51 O ATOM 0 H GLU A 14 -5.590 -5.197 4.894 1.00 0.58 H new ATOM 0 HA GLU A 14 -5.196 -4.639 7.550 1.00 0.59 H new ATOM 0 HB2 GLU A 14 -5.404 -7.323 6.131 1.00 0.67 H new ATOM 0 HB3 GLU A 14 -5.682 -7.057 7.840 1.00 0.67 H new ATOM 0 HG2 GLU A 14 -7.218 -5.256 6.010 1.00 2.06 H new ATOM 0 HG3 GLU A 14 -7.656 -6.951 5.925 1.00 2.06 H new ATOM 211 N THR A 15 -2.749 -6.487 6.291 1.00 0.63 N ATOM 212 CA THR A 15 -1.362 -6.899 6.446 1.00 0.66 C ATOM 213 C THR A 15 -0.490 -5.672 6.705 1.00 0.61 C ATOM 214 O THR A 15 0.120 -5.579 7.768 1.00 0.76 O ATOM 215 CB THR A 15 -0.884 -7.726 5.241 1.00 0.71 C ATOM 216 OG1 THR A 15 -1.709 -8.864 5.100 1.00 0.81 O ATOM 217 CG2 THR A 15 0.556 -8.213 5.429 1.00 0.79 C ATOM 0 H THR A 15 -3.184 -6.838 5.438 1.00 0.63 H new ATOM 0 HA THR A 15 -1.276 -7.557 7.311 1.00 0.66 H new ATOM 0 HB THR A 15 -0.933 -7.086 4.360 1.00 0.71 H new ATOM 0 HG1 THR A 15 -2.578 -8.595 4.735 1.00 0.81 H new ATOM 0 HG21 THR A 15 0.860 -8.794 4.558 1.00 0.79 H new ATOM 0 HG22 THR A 15 1.218 -7.355 5.542 1.00 0.79 H new ATOM 0 HG23 THR A 15 0.615 -8.837 6.320 1.00 0.79 H new ATOM 225 N VAL A 16 -0.474 -4.699 5.787 1.00 0.52 N ATOM 226 CA VAL A 16 0.330 -3.501 5.954 1.00 0.53 C ATOM 227 C VAL A 16 0.057 -2.848 7.309 1.00 0.59 C ATOM 228 O VAL A 16 0.988 -2.580 8.068 1.00 0.69 O ATOM 229 CB VAL A 16 0.073 -2.526 4.797 1.00 0.57 C ATOM 230 CG1 VAL A 16 0.700 -1.172 5.127 1.00 0.65 C ATOM 231 CG2 VAL A 16 0.668 -3.051 3.489 1.00 0.63 C ATOM 0 H VAL A 16 -1.013 -4.726 4.921 1.00 0.52 H new ATOM 0 HA VAL A 16 1.384 -3.779 5.934 1.00 0.53 H new ATOM 0 HB VAL A 16 -1.005 -2.423 4.669 1.00 0.57 H new ATOM 0 HG11 VAL A 16 0.519 -0.478 4.307 1.00 0.65 H new ATOM 0 HG12 VAL A 16 0.255 -0.778 6.041 1.00 0.65 H new ATOM 0 HG13 VAL A 16 1.774 -1.293 5.269 1.00 0.65 H new ATOM 0 HG21 VAL A 16 0.470 -2.339 2.688 1.00 0.63 H new ATOM 0 HG22 VAL A 16 1.744 -3.178 3.604 1.00 0.63 H new ATOM 0 HG23 VAL A 16 0.214 -4.011 3.242 1.00 0.63 H new ATOM 241 N VAL A 17 -1.210 -2.565 7.629 1.00 0.58 N ATOM 242 CA VAL A 17 -1.520 -1.918 8.895 1.00 0.66 C ATOM 243 C VAL A 17 -1.120 -2.795 10.093 1.00 0.71 C ATOM 244 O VAL A 17 -0.890 -2.271 11.185 1.00 0.80 O ATOM 245 CB VAL A 17 -2.963 -1.393 8.974 1.00 0.68 C ATOM 246 CG1 VAL A 17 -3.272 -0.409 7.839 1.00 0.66 C ATOM 247 CG2 VAL A 17 -4.006 -2.504 8.985 1.00 0.65 C ATOM 0 H VAL A 17 -2.017 -2.771 7.040 1.00 0.58 H new ATOM 0 HA VAL A 17 -0.901 -1.022 8.948 1.00 0.66 H new ATOM 0 HB VAL A 17 -3.027 -0.871 9.929 1.00 0.68 H new ATOM 0 HG11 VAL A 17 -4.301 -0.061 7.930 1.00 0.66 H new ATOM 0 HG12 VAL A 17 -2.594 0.442 7.901 1.00 0.66 H new ATOM 0 HG13 VAL A 17 -3.141 -0.908 6.879 1.00 0.66 H new ATOM 0 HG21 VAL A 17 -5.003 -2.067 9.042 1.00 0.65 H new ATOM 0 HG22 VAL A 17 -3.920 -3.093 8.072 1.00 0.65 H new ATOM 0 HG23 VAL A 17 -3.842 -3.148 9.849 1.00 0.65 H new ATOM 257 N THR A 18 -1.052 -4.118 9.926 1.00 0.77 N ATOM 258 CA THR A 18 -0.480 -5.030 10.910 1.00 0.92 C ATOM 259 C THR A 18 1.026 -4.784 11.051 1.00 1.00 C ATOM 260 O THR A 18 1.516 -4.618 12.167 1.00 1.15 O ATOM 261 CB THR A 18 -0.845 -6.496 10.567 1.00 1.04 C ATOM 262 OG1 THR A 18 -1.722 -6.986 11.563 1.00 1.24 O ATOM 263 CG2 THR A 18 0.340 -7.459 10.425 1.00 1.33 C ATOM 0 H THR A 18 -1.399 -4.589 9.090 1.00 0.77 H new ATOM 0 HA THR A 18 -0.913 -4.834 11.891 1.00 0.92 H new ATOM 0 HB THR A 18 -1.305 -6.463 9.580 1.00 1.04 H new ATOM 0 HG1 THR A 18 -1.964 -7.913 11.359 1.00 1.24 H new ATOM 0 HG21 THR A 18 -0.028 -8.456 10.185 1.00 1.33 H new ATOM 0 HG22 THR A 18 0.997 -7.113 9.627 1.00 1.33 H new ATOM 0 HG23 THR A 18 0.895 -7.493 11.362 1.00 1.33 H new ATOM 271 N THR A 19 1.755 -4.756 9.935 1.00 0.95 N ATOM 272 CA THR A 19 3.209 -4.764 9.890 1.00 0.98 C ATOM 273 C THR A 19 3.851 -3.717 10.802 1.00 0.96 C ATOM 274 O THR A 19 4.838 -4.013 11.471 1.00 1.06 O ATOM 275 CB THR A 19 3.639 -4.621 8.429 1.00 1.09 C ATOM 276 OG1 THR A 19 3.073 -5.677 7.687 1.00 1.45 O ATOM 277 CG2 THR A 19 5.157 -4.638 8.269 1.00 1.10 C ATOM 0 H THR A 19 1.330 -4.726 9.008 1.00 0.95 H new ATOM 0 HA THR A 19 3.571 -5.712 10.287 1.00 0.98 H new ATOM 0 HB THR A 19 3.287 -3.656 8.063 1.00 1.09 H new ATOM 0 HG1 THR A 19 3.209 -6.522 8.165 1.00 1.45 H new ATOM 0 HG21 THR A 19 5.413 -4.534 7.215 1.00 1.10 H new ATOM 0 HG22 THR A 19 5.591 -3.812 8.831 1.00 1.10 H new ATOM 0 HG23 THR A 19 5.552 -5.581 8.647 1.00 1.10 H new ATOM 285 N PHE A 20 3.297 -2.502 10.867 1.00 0.98 N ATOM 286 CA PHE A 20 3.774 -1.500 11.825 1.00 1.05 C ATOM 287 C PHE A 20 3.912 -2.067 13.247 1.00 1.18 C ATOM 288 O PHE A 20 4.901 -1.807 13.925 1.00 1.30 O ATOM 289 CB PHE A 20 2.846 -0.285 11.852 1.00 1.10 C ATOM 290 CG PHE A 20 2.695 0.393 10.511 1.00 0.83 C ATOM 291 CD1 PHE A 20 3.586 1.404 10.115 1.00 1.80 C ATOM 292 CD2 PHE A 20 1.674 -0.015 9.645 1.00 1.42 C ATOM 293 CE1 PHE A 20 3.361 2.104 8.918 1.00 1.55 C ATOM 294 CE2 PHE A 20 1.493 0.635 8.415 1.00 1.66 C ATOM 295 CZ PHE A 20 2.294 1.736 8.083 1.00 0.77 C ATOM 0 H PHE A 20 2.527 -2.191 10.275 1.00 0.98 H new ATOM 0 HA PHE A 20 4.764 -1.197 11.485 1.00 1.05 H new ATOM 0 HB2 PHE A 20 1.863 -0.597 12.204 1.00 1.10 H new ATOM 0 HB3 PHE A 20 3.228 0.437 12.573 1.00 1.10 H new ATOM 0 HD1 PHE A 20 4.442 1.643 10.729 1.00 1.80 H new ATOM 0 HD2 PHE A 20 1.024 -0.831 9.924 1.00 1.42 H new ATOM 0 HE1 PHE A 20 4.007 2.924 8.641 1.00 1.55 H new ATOM 0 HE2 PHE A 20 0.738 0.288 7.725 1.00 1.66 H new ATOM 0 HZ PHE A 20 2.091 2.301 7.185 1.00 0.77 H new ATOM 305 N PHE A 21 2.905 -2.820 13.704 1.00 1.22 N ATOM 306 CA PHE A 21 2.941 -3.520 14.981 1.00 1.33 C ATOM 307 C PHE A 21 3.845 -4.747 14.873 1.00 1.25 C ATOM 308 O PHE A 21 4.740 -4.932 15.697 1.00 1.53 O ATOM 309 CB PHE A 21 1.518 -3.909 15.400 1.00 1.41 C ATOM 310 CG PHE A 21 1.432 -4.682 16.701 1.00 1.63 C ATOM 311 CD1 PHE A 21 1.874 -4.095 17.903 1.00 2.88 C ATOM 312 CD2 PHE A 21 0.933 -5.999 16.711 1.00 2.33 C ATOM 313 CE1 PHE A 21 1.781 -4.806 19.112 1.00 3.38 C ATOM 314 CE2 PHE A 21 0.828 -6.704 17.922 1.00 3.02 C ATOM 315 CZ PHE A 21 1.244 -6.105 19.123 1.00 3.08 C ATOM 0 H PHE A 21 2.036 -2.958 13.188 1.00 1.22 H new ATOM 0 HA PHE A 21 3.352 -2.864 15.748 1.00 1.33 H new ATOM 0 HB2 PHE A 21 0.920 -3.002 15.491 1.00 1.41 H new ATOM 0 HB3 PHE A 21 1.071 -4.508 14.607 1.00 1.41 H new ATOM 0 HD1 PHE A 21 2.285 -3.096 17.896 1.00 2.88 H new ATOM 0 HD2 PHE A 21 0.631 -6.468 15.786 1.00 2.33 H new ATOM 0 HE1 PHE A 21 2.122 -4.354 20.032 1.00 3.38 H new ATOM 0 HE2 PHE A 21 0.427 -7.707 17.930 1.00 3.02 H new ATOM 0 HZ PHE A 21 1.151 -6.643 20.055 1.00 3.08 H new ATOM 325 N THR A 22 3.654 -5.569 13.836 1.00 1.15 N ATOM 326 CA THR A 22 4.429 -6.791 13.640 1.00 1.41 C ATOM 327 C THR A 22 5.763 -6.435 12.974 1.00 1.69 C ATOM 328 O THR A 22 6.098 -6.902 11.890 1.00 2.05 O ATOM 329 CB THR A 22 3.598 -7.808 12.840 1.00 1.90 C ATOM 330 OG1 THR A 22 2.308 -7.880 13.419 1.00 2.62 O ATOM 331 CG2 THR A 22 4.207 -9.213 12.881 1.00 2.19 C ATOM 0 H THR A 22 2.957 -5.403 13.110 1.00 1.15 H new ATOM 0 HA THR A 22 4.662 -7.265 14.593 1.00 1.41 H new ATOM 0 HB THR A 22 3.569 -7.475 11.802 1.00 1.90 H new ATOM 0 HG1 THR A 22 1.815 -8.631 13.028 1.00 2.62 H new ATOM 0 HG21 THR A 22 3.585 -9.896 12.302 1.00 2.19 H new ATOM 0 HG22 THR A 22 5.210 -9.187 12.456 1.00 2.19 H new ATOM 0 HG23 THR A 22 4.259 -9.557 13.914 1.00 2.19 H new ATOM 339 N PHE A 23 6.529 -5.597 13.672 1.00 2.00 N ATOM 340 CA PHE A 23 7.853 -5.142 13.293 1.00 2.41 C ATOM 341 C PHE A 23 8.851 -5.914 14.154 1.00 2.56 C ATOM 342 O PHE A 23 9.611 -6.745 13.663 1.00 3.33 O ATOM 343 CB PHE A 23 7.911 -3.623 13.503 1.00 2.97 C ATOM 344 CG PHE A 23 9.250 -2.999 13.183 1.00 3.60 C ATOM 345 CD1 PHE A 23 9.561 -2.669 11.853 1.00 4.58 C ATOM 346 CD2 PHE A 23 10.178 -2.735 14.208 1.00 4.36 C ATOM 347 CE1 PHE A 23 10.786 -2.054 11.549 1.00 5.60 C ATOM 348 CE2 PHE A 23 11.411 -2.133 13.901 1.00 5.35 C ATOM 349 CZ PHE A 23 11.713 -1.786 12.573 1.00 5.75 C ATOM 0 H PHE A 23 6.221 -5.201 14.560 1.00 2.00 H new ATOM 0 HA PHE A 23 8.094 -5.328 12.246 1.00 2.41 H new ATOM 0 HB2 PHE A 23 7.148 -3.153 12.883 1.00 2.97 H new ATOM 0 HB3 PHE A 23 7.659 -3.402 14.540 1.00 2.97 H new ATOM 0 HD1 PHE A 23 8.857 -2.889 11.064 1.00 4.58 H new ATOM 0 HD2 PHE A 23 9.943 -2.995 15.230 1.00 4.36 H new ATOM 0 HE1 PHE A 23 11.017 -1.786 10.528 1.00 5.60 H new ATOM 0 HE2 PHE A 23 12.126 -1.937 14.686 1.00 5.35 H new ATOM 0 HZ PHE A 23 12.656 -1.314 12.339 1.00 5.75 H new ATOM 359 N ALA A 24 8.782 -5.683 15.465 1.00 2.60 N ATOM 360 CA ALA A 24 9.431 -6.452 16.512 1.00 3.01 C ATOM 361 C ALA A 24 8.711 -6.052 17.794 1.00 3.37 C ATOM 362 O ALA A 24 8.166 -4.948 17.853 1.00 3.93 O ATOM 363 CB ALA A 24 10.922 -6.111 16.588 1.00 3.46 C ATOM 0 H ALA A 24 8.238 -4.906 15.841 1.00 2.60 H new ATOM 0 HA ALA A 24 9.374 -7.526 16.332 1.00 3.01 H new ATOM 0 HB1 ALA A 24 11.390 -6.698 17.379 1.00 3.46 H new ATOM 0 HB2 ALA A 24 11.397 -6.343 15.635 1.00 3.46 H new ATOM 0 HB3 ALA A 24 11.042 -5.050 16.805 1.00 3.46 H new ATOM 369 N ARG A 25 8.684 -6.909 18.819 1.00 3.65 N ATOM 370 CA ARG A 25 7.951 -6.598 20.044 1.00 4.17 C ATOM 371 C ARG A 25 8.786 -5.666 20.931 1.00 4.21 C ATOM 372 O ARG A 25 9.025 -5.973 22.097 1.00 4.87 O ATOM 373 CB ARG A 25 7.614 -7.904 20.784 1.00 5.13 C ATOM 374 CG ARG A 25 6.789 -8.883 19.938 1.00 5.75 C ATOM 375 CD ARG A 25 6.510 -10.155 20.750 1.00 6.97 C ATOM 376 NE ARG A 25 5.823 -11.171 19.937 1.00 8.16 N ATOM 377 CZ ARG A 25 5.576 -12.431 20.335 1.00 9.57 C ATOM 378 NH1 ARG A 25 5.915 -12.815 21.571 1.00 10.02 N ATOM 379 NH2 ARG A 25 4.997 -13.298 19.498 1.00 10.89 N ATOM 0 H ARG A 25 9.156 -7.813 18.823 1.00 3.65 H new ATOM 0 HA ARG A 25 7.021 -6.087 19.796 1.00 4.17 H new ATOM 0 HB2 ARG A 25 8.540 -8.390 21.090 1.00 5.13 H new ATOM 0 HB3 ARG A 25 7.063 -7.667 21.694 1.00 5.13 H new ATOM 0 HG2 ARG A 25 5.850 -8.418 19.637 1.00 5.75 H new ATOM 0 HG3 ARG A 25 7.328 -9.133 19.024 1.00 5.75 H new ATOM 0 HD2 ARG A 25 7.449 -10.562 21.126 1.00 6.97 H new ATOM 0 HD3 ARG A 25 5.899 -9.908 21.618 1.00 6.97 H new ATOM 0 HE ARG A 25 5.512 -10.900 19.004 1.00 8.16 H new ATOM 0 HH11 ARG A 25 6.359 -12.153 22.207 1.00 10.02 H new ATOM 0 HH12 ARG A 25 5.729 -13.770 21.877 1.00 10.02 H new ATOM 0 HH21 ARG A 25 4.742 -13.004 18.555 1.00 10.89 H new ATOM 0 HH22 ARG A 25 4.811 -14.254 19.802 1.00 10.89 H new ATOM 393 N GLN A 26 9.197 -4.517 20.387 1.00 4.54 N ATOM 394 CA GLN A 26 9.941 -3.471 21.077 1.00 5.53 C ATOM 395 C GLN A 26 9.676 -2.152 20.345 1.00 5.80 C ATOM 396 O GLN A 26 10.602 -1.470 19.913 1.00 7.43 O ATOM 397 CB GLN A 26 11.450 -3.786 21.083 1.00 6.95 C ATOM 398 CG GLN A 26 11.827 -5.070 21.833 1.00 7.44 C ATOM 399 CD GLN A 26 13.338 -5.239 21.943 1.00 8.91 C ATOM 400 OE1 GLN A 26 13.913 -6.144 21.349 1.00 9.60 O ATOM 401 NE2 GLN A 26 13.998 -4.374 22.707 1.00 9.80 N ATOM 0 H GLN A 26 9.010 -4.285 19.412 1.00 4.54 H new ATOM 0 HA GLN A 26 9.617 -3.404 22.116 1.00 5.53 H new ATOM 0 HB2 GLN A 26 11.796 -3.867 20.052 1.00 6.95 H new ATOM 0 HB3 GLN A 26 11.982 -2.948 21.533 1.00 6.95 H new ATOM 0 HG2 GLN A 26 11.390 -5.049 22.831 1.00 7.44 H new ATOM 0 HG3 GLN A 26 11.402 -5.931 21.317 1.00 7.44 H new ATOM 0 HE21 GLN A 26 13.493 -3.631 23.189 1.00 9.80 H new ATOM 0 HE22 GLN A 26 15.010 -4.454 22.811 1.00 9.80 H new ATOM 410 N GLU A 27 8.400 -1.791 20.224 1.00 4.74 N ATOM 411 CA GLU A 27 7.934 -0.516 19.708 1.00 5.41 C ATOM 412 C GLU A 27 6.533 -0.334 20.287 1.00 4.21 C ATOM 413 O GLU A 27 5.850 -1.321 20.566 1.00 3.45 O ATOM 414 CB GLU A 27 7.980 -0.521 18.167 1.00 6.45 C ATOM 415 CG GLU A 27 7.217 0.606 17.444 1.00 7.82 C ATOM 416 CD GLU A 27 7.669 2.028 17.764 1.00 9.09 C ATOM 417 OE1 GLU A 27 7.736 2.394 18.961 1.00 8.92 O ATOM 418 OE2 GLU A 27 7.835 2.833 16.820 1.00 10.57 O ATOM 0 H GLU A 27 7.635 -2.408 20.496 1.00 4.74 H new ATOM 0 HA GLU A 27 8.561 0.326 20.001 1.00 5.41 H new ATOM 0 HB2 GLU A 27 9.024 -0.476 17.858 1.00 6.45 H new ATOM 0 HB3 GLU A 27 7.586 -1.476 17.819 1.00 6.45 H new ATOM 0 HG2 GLU A 27 7.309 0.449 16.369 1.00 7.82 H new ATOM 0 HG3 GLU A 27 6.159 0.518 17.690 1.00 7.82 H new ATOM 425 N GLY A 28 6.122 0.913 20.492 1.00 4.81 N ATOM 426 CA GLY A 28 4.766 1.259 20.867 1.00 4.05 C ATOM 427 C GLY A 28 3.981 1.510 19.587 1.00 3.26 C ATOM 428 O GLY A 28 4.456 2.217 18.700 1.00 3.86 O ATOM 0 H GLY A 28 6.737 1.722 20.399 1.00 4.81 H new ATOM 0 HA2 GLY A 28 4.311 0.453 21.443 1.00 4.05 H new ATOM 0 HA3 GLY A 28 4.759 2.146 21.500 1.00 4.05 H new ATOM 432 N ARG A 29 2.756 0.994 19.482 1.00 2.55 N ATOM 433 CA ARG A 29 1.973 1.223 18.280 1.00 2.28 C ATOM 434 C ARG A 29 1.363 2.618 18.420 1.00 2.11 C ATOM 435 O ARG A 29 0.249 2.799 18.914 1.00 2.31 O ATOM 436 CB ARG A 29 0.943 0.100 18.078 1.00 2.92 C ATOM 437 CG ARG A 29 0.131 0.227 16.774 1.00 3.14 C ATOM 438 CD ARG A 29 -1.379 0.227 17.050 1.00 4.64 C ATOM 439 NE ARG A 29 -1.722 1.401 17.863 1.00 5.36 N ATOM 440 CZ ARG A 29 -2.443 1.409 18.993 1.00 6.47 C ATOM 441 NH1 ARG A 29 -3.370 0.472 19.223 1.00 7.29 N ATOM 442 NH2 ARG A 29 -2.188 2.360 19.893 1.00 7.14 N ATOM 0 H ARG A 29 2.298 0.429 20.198 1.00 2.55 H new ATOM 0 HA ARG A 29 2.581 1.195 17.376 1.00 2.28 H new ATOM 0 HB2 ARG A 29 1.460 -0.859 18.081 1.00 2.92 H new ATOM 0 HB3 ARG A 29 0.256 0.094 18.924 1.00 2.92 H new ATOM 0 HG2 ARG A 29 0.408 1.147 16.260 1.00 3.14 H new ATOM 0 HG3 ARG A 29 0.380 -0.598 16.107 1.00 3.14 H new ATOM 0 HD2 ARG A 29 -1.932 0.246 16.111 1.00 4.64 H new ATOM 0 HD3 ARG A 29 -1.666 -0.687 17.570 1.00 4.64 H new ATOM 0 HE ARG A 29 -1.376 2.302 17.534 1.00 5.36 H new ATOM 0 HH11 ARG A 29 -3.536 -0.261 18.534 1.00 7.29 H new ATOM 0 HH12 ARG A 29 -3.911 0.491 20.088 1.00 7.29 H new ATOM 0 HH21 ARG A 29 -1.462 3.053 19.711 1.00 7.14 H new ATOM 0 HH22 ARG A 29 -2.719 2.394 20.763 1.00 7.14 H new ATOM 456 N LYS A 30 2.135 3.610 17.978 1.00 2.00 N ATOM 457 CA LYS A 30 1.636 4.922 17.613 1.00 2.02 C ATOM 458 C LYS A 30 0.789 4.712 16.346 1.00 1.80 C ATOM 459 O LYS A 30 -0.244 4.041 16.395 1.00 2.44 O ATOM 460 CB LYS A 30 2.842 5.861 17.407 1.00 2.28 C ATOM 461 CG LYS A 30 3.597 6.175 18.709 1.00 2.65 C ATOM 462 CD LYS A 30 5.116 6.285 18.480 1.00 3.17 C ATOM 463 CE LYS A 30 5.733 4.878 18.445 1.00 4.05 C ATOM 464 NZ LYS A 30 7.195 4.847 18.249 1.00 5.46 N ATOM 0 H LYS A 30 3.144 3.515 17.864 1.00 2.00 H new ATOM 0 HA LYS A 30 1.014 5.390 18.376 1.00 2.02 H new ATOM 0 HB2 LYS A 30 3.531 5.405 16.696 1.00 2.28 H new ATOM 0 HB3 LYS A 30 2.496 6.794 16.962 1.00 2.28 H new ATOM 0 HG2 LYS A 30 3.224 7.110 19.128 1.00 2.65 H new ATOM 0 HG3 LYS A 30 3.396 5.394 19.442 1.00 2.65 H new ATOM 0 HD2 LYS A 30 5.316 6.805 17.543 1.00 3.17 H new ATOM 0 HD3 LYS A 30 5.573 6.874 19.275 1.00 3.17 H new ATOM 0 HE2 LYS A 30 5.495 4.369 19.379 1.00 4.05 H new ATOM 0 HE3 LYS A 30 5.261 4.310 17.643 1.00 4.05 H new ATOM 0 HZ1 LYS A 30 7.411 4.458 17.309 1.00 5.46 H new ATOM 0 HZ2 LYS A 30 7.575 5.812 18.320 1.00 5.46 H new ATOM 0 HZ3 LYS A 30 7.631 4.249 18.980 1.00 5.46 H new ATOM 478 N ASP A 31 1.296 5.193 15.209 1.00 1.57 N ATOM 479 CA ASP A 31 0.738 4.993 13.883 1.00 1.41 C ATOM 480 C ASP A 31 1.804 4.343 13.003 1.00 1.36 C ATOM 481 O ASP A 31 1.555 3.334 12.347 1.00 1.79 O ATOM 482 CB ASP A 31 0.264 6.330 13.289 1.00 1.56 C ATOM 483 CG ASP A 31 -1.085 6.775 13.844 1.00 2.18 C ATOM 484 OD1 ASP A 31 -1.116 7.199 15.015 1.00 3.31 O ATOM 485 OD2 ASP A 31 -2.080 6.676 13.087 1.00 2.80 O ATOM 0 H ASP A 31 2.146 5.757 15.194 1.00 1.57 H new ATOM 0 HA ASP A 31 -0.132 4.339 13.939 1.00 1.41 H new ATOM 0 HB2 ASP A 31 1.009 7.099 13.495 1.00 1.56 H new ATOM 0 HB3 ASP A 31 0.194 6.237 12.205 1.00 1.56 H new ATOM 490 N SER A 32 3.006 4.921 12.982 1.00 1.19 N ATOM 491 CA SER A 32 4.136 4.401 12.235 1.00 1.16 C ATOM 492 C SER A 32 5.446 4.784 12.938 1.00 1.11 C ATOM 493 O SER A 32 5.413 5.291 14.059 1.00 1.32 O ATOM 494 CB SER A 32 4.057 4.937 10.802 1.00 1.13 C ATOM 495 OG SER A 32 2.765 4.764 10.245 1.00 2.69 O ATOM 0 H SER A 32 3.218 5.777 13.494 1.00 1.19 H new ATOM 0 HA SER A 32 4.110 3.312 12.193 1.00 1.16 H new ATOM 0 HB2 SER A 32 4.317 5.996 10.795 1.00 1.13 H new ATOM 0 HB3 SER A 32 4.792 4.424 10.181 1.00 1.13 H new ATOM 0 HG SER A 32 2.769 3.991 9.643 1.00 2.69 H new ATOM 501 N LEU A 33 6.587 4.520 12.288 1.00 1.13 N ATOM 502 CA LEU A 33 7.918 4.753 12.826 1.00 1.18 C ATOM 503 C LEU A 33 8.319 6.200 12.507 1.00 1.07 C ATOM 504 O LEU A 33 7.467 7.027 12.180 1.00 1.15 O ATOM 505 CB LEU A 33 8.922 3.749 12.214 1.00 1.34 C ATOM 506 CG LEU A 33 8.576 2.249 12.288 1.00 1.41 C ATOM 507 CD1 LEU A 33 8.112 1.816 13.682 1.00 1.81 C ATOM 508 CD2 LEU A 33 7.573 1.806 11.218 1.00 1.32 C ATOM 0 H LEU A 33 6.601 4.127 11.347 1.00 1.13 H new ATOM 0 HA LEU A 33 7.923 4.605 13.906 1.00 1.18 H new ATOM 0 HB2 LEU A 33 9.058 4.010 11.164 1.00 1.34 H new ATOM 0 HB3 LEU A 33 9.884 3.895 12.706 1.00 1.34 H new ATOM 0 HG LEU A 33 9.514 1.735 12.079 1.00 1.41 H new ATOM 0 HD11 LEU A 33 7.882 0.751 13.674 1.00 1.81 H new ATOM 0 HD12 LEU A 33 8.903 2.011 14.406 1.00 1.81 H new ATOM 0 HD13 LEU A 33 7.220 2.378 13.959 1.00 1.81 H new ATOM 0 HD21 LEU A 33 7.373 0.740 11.326 1.00 1.32 H new ATOM 0 HD22 LEU A 33 6.644 2.364 11.337 1.00 1.32 H new ATOM 0 HD23 LEU A 33 7.988 1.999 10.229 1.00 1.32 H new ATOM 520 N SER A 34 9.620 6.502 12.542 1.00 0.95 N ATOM 521 CA SER A 34 10.135 7.747 11.994 1.00 0.90 C ATOM 522 C SER A 34 10.313 7.600 10.483 1.00 0.94 C ATOM 523 O SER A 34 10.504 6.490 9.984 1.00 0.93 O ATOM 524 CB SER A 34 11.448 8.131 12.683 1.00 0.90 C ATOM 525 OG SER A 34 11.253 8.180 14.082 1.00 1.55 O ATOM 0 H SER A 34 10.333 5.895 12.947 1.00 0.95 H new ATOM 0 HA SER A 34 9.424 8.552 12.180 1.00 0.90 H new ATOM 0 HB2 SER A 34 12.224 7.405 12.439 1.00 0.90 H new ATOM 0 HB3 SER A 34 11.791 9.099 12.319 1.00 0.90 H new ATOM 0 HG SER A 34 12.094 8.424 14.521 1.00 1.55 H new ATOM 531 N VAL A 35 10.244 8.713 9.750 1.00 1.03 N ATOM 532 CA VAL A 35 10.277 8.715 8.292 1.00 1.01 C ATOM 533 C VAL A 35 11.599 8.125 7.791 1.00 0.99 C ATOM 534 O VAL A 35 11.619 7.162 7.026 1.00 1.04 O ATOM 535 CB VAL A 35 10.070 10.160 7.821 1.00 1.06 C ATOM 536 CG1 VAL A 35 10.277 10.323 6.320 1.00 0.87 C ATOM 537 CG2 VAL A 35 8.662 10.663 8.159 1.00 1.30 C ATOM 0 H VAL A 35 10.163 9.644 10.158 1.00 1.03 H new ATOM 0 HA VAL A 35 9.484 8.090 7.881 1.00 1.01 H new ATOM 0 HB VAL A 35 10.820 10.747 8.351 1.00 1.06 H new ATOM 0 HG11 VAL A 35 10.118 11.365 6.042 1.00 0.87 H new ATOM 0 HG12 VAL A 35 11.294 10.029 6.059 1.00 0.87 H new ATOM 0 HG13 VAL A 35 9.568 9.692 5.784 1.00 0.87 H new ATOM 0 HG21 VAL A 35 8.549 11.690 7.811 1.00 1.30 H new ATOM 0 HG22 VAL A 35 7.922 10.031 7.668 1.00 1.30 H new ATOM 0 HG23 VAL A 35 8.512 10.627 9.238 1.00 1.30 H new ATOM 547 N ASN A 36 12.708 8.720 8.235 1.00 0.98 N ATOM 548 CA ASN A 36 14.059 8.248 7.962 1.00 1.02 C ATOM 549 C ASN A 36 14.181 6.730 8.195 1.00 0.97 C ATOM 550 O ASN A 36 14.492 5.985 7.267 1.00 0.93 O ATOM 551 CB ASN A 36 15.085 9.018 8.813 1.00 1.32 C ATOM 552 CG ASN A 36 14.772 9.077 10.310 1.00 3.68 C ATOM 553 OD1 ASN A 36 15.110 8.163 11.051 1.00 4.78 O ATOM 554 ND2 ASN A 36 14.096 10.118 10.791 1.00 4.82 N ATOM 0 H ASN A 36 12.687 9.564 8.808 1.00 0.98 H new ATOM 0 HA ASN A 36 14.273 8.438 6.910 1.00 1.02 H new ATOM 0 HB2 ASN A 36 16.064 8.557 8.680 1.00 1.32 H new ATOM 0 HB3 ASN A 36 15.158 10.037 8.432 1.00 1.32 H new ATOM 0 HD21 ASN A 36 13.857 10.157 11.782 1.00 4.82 H new ATOM 0 HD22 ASN A 36 13.817 10.877 10.169 1.00 4.82 H new ATOM 561 N GLU A 37 13.913 6.285 9.430 1.00 1.01 N ATOM 562 CA GLU A 37 13.929 4.893 9.860 1.00 1.00 C ATOM 563 C GLU A 37 13.162 4.041 8.851 1.00 0.93 C ATOM 564 O GLU A 37 13.721 3.144 8.223 1.00 0.86 O ATOM 565 CB GLU A 37 13.310 4.819 11.269 1.00 1.15 C ATOM 566 CG GLU A 37 13.380 3.426 11.907 1.00 1.58 C ATOM 567 CD GLU A 37 14.782 3.113 12.409 1.00 2.48 C ATOM 568 OE1 GLU A 37 15.125 3.662 13.478 1.00 3.06 O ATOM 569 OE2 GLU A 37 15.478 2.346 11.713 1.00 3.69 O ATOM 0 H GLU A 37 13.668 6.922 10.188 1.00 1.01 H new ATOM 0 HA GLU A 37 14.946 4.504 9.906 1.00 1.00 H new ATOM 0 HB2 GLU A 37 13.821 5.531 11.917 1.00 1.15 H new ATOM 0 HB3 GLU A 37 12.267 5.130 11.214 1.00 1.15 H new ATOM 0 HG2 GLU A 37 12.674 3.368 12.736 1.00 1.58 H new ATOM 0 HG3 GLU A 37 13.077 2.675 11.178 1.00 1.58 H new ATOM 576 N PHE A 38 11.880 4.364 8.656 1.00 1.02 N ATOM 577 CA PHE A 38 11.038 3.717 7.663 1.00 1.01 C ATOM 578 C PHE A 38 11.763 3.571 6.325 1.00 0.92 C ATOM 579 O PHE A 38 11.830 2.463 5.804 1.00 0.88 O ATOM 580 CB PHE A 38 9.720 4.479 7.509 1.00 1.09 C ATOM 581 CG PHE A 38 9.110 4.382 6.124 1.00 0.92 C ATOM 582 CD1 PHE A 38 8.552 3.167 5.691 1.00 1.94 C ATOM 583 CD2 PHE A 38 9.297 5.433 5.207 1.00 1.50 C ATOM 584 CE1 PHE A 38 8.158 3.017 4.351 1.00 1.80 C ATOM 585 CE2 PHE A 38 8.976 5.252 3.855 1.00 1.68 C ATOM 586 CZ PHE A 38 8.369 4.061 3.434 1.00 0.96 C ATOM 0 H PHE A 38 11.400 5.088 9.190 1.00 1.02 H new ATOM 0 HA PHE A 38 10.810 2.710 8.011 1.00 1.01 H new ATOM 0 HB2 PHE A 38 9.004 4.098 8.238 1.00 1.09 H new ATOM 0 HB3 PHE A 38 9.889 5.529 7.748 1.00 1.09 H new ATOM 0 HD1 PHE A 38 8.426 2.351 6.387 1.00 1.94 H new ATOM 0 HD2 PHE A 38 9.689 6.381 5.546 1.00 1.50 H new ATOM 0 HE1 PHE A 38 7.693 2.099 4.025 1.00 1.80 H new ATOM 0 HE2 PHE A 38 9.196 6.029 3.138 1.00 1.68 H new ATOM 0 HZ PHE A 38 8.063 3.945 2.405 1.00 0.96 H new ATOM 596 N LYS A 39 12.302 4.663 5.770 1.00 0.92 N ATOM 597 CA LYS A 39 13.021 4.618 4.503 1.00 0.87 C ATOM 598 C LYS A 39 14.113 3.537 4.551 1.00 0.78 C ATOM 599 O LYS A 39 14.178 2.686 3.659 1.00 0.77 O ATOM 600 CB LYS A 39 13.502 6.030 4.102 1.00 1.04 C ATOM 601 CG LYS A 39 14.721 6.080 3.156 1.00 1.06 C ATOM 602 CD LYS A 39 15.903 6.696 3.925 1.00 1.94 C ATOM 603 CE LYS A 39 17.235 6.573 3.171 1.00 2.35 C ATOM 604 NZ LYS A 39 18.374 7.079 3.971 1.00 3.38 N ATOM 0 H LYS A 39 12.250 5.593 6.187 1.00 0.92 H new ATOM 0 HA LYS A 39 12.355 4.313 3.696 1.00 0.87 H new ATOM 0 HB2 LYS A 39 12.674 6.554 3.625 1.00 1.04 H new ATOM 0 HB3 LYS A 39 13.747 6.581 5.010 1.00 1.04 H new ATOM 0 HG2 LYS A 39 14.974 5.078 2.809 1.00 1.06 H new ATOM 0 HG3 LYS A 39 14.492 6.675 2.272 1.00 1.06 H new ATOM 0 HD2 LYS A 39 15.696 7.749 4.117 1.00 1.94 H new ATOM 0 HD3 LYS A 39 15.994 6.207 4.895 1.00 1.94 H new ATOM 0 HE2 LYS A 39 17.410 5.529 2.912 1.00 2.35 H new ATOM 0 HE3 LYS A 39 17.174 7.128 2.235 1.00 2.35 H new ATOM 0 HZ1 LYS A 39 19.256 6.962 3.432 1.00 3.38 H new ATOM 0 HZ2 LYS A 39 18.229 8.087 4.183 1.00 3.38 H new ATOM 0 HZ3 LYS A 39 18.438 6.544 4.860 1.00 3.38 H new ATOM 618 N GLU A 40 14.964 3.559 5.580 1.00 0.77 N ATOM 619 CA GLU A 40 16.061 2.600 5.687 1.00 0.77 C ATOM 620 C GLU A 40 15.570 1.166 5.931 1.00 0.76 C ATOM 621 O GLU A 40 16.228 0.212 5.520 1.00 0.86 O ATOM 622 CB GLU A 40 17.114 3.083 6.694 1.00 0.89 C ATOM 623 CG GLU A 40 17.543 4.500 6.286 1.00 0.99 C ATOM 624 CD GLU A 40 18.958 4.894 6.666 1.00 1.45 C ATOM 625 OE1 GLU A 40 19.563 4.223 7.525 1.00 2.16 O ATOM 626 OE2 GLU A 40 19.401 5.883 6.037 1.00 2.13 O ATOM 0 H GLU A 40 14.913 4.229 6.347 1.00 0.77 H new ATOM 0 HA GLU A 40 16.562 2.552 4.720 1.00 0.77 H new ATOM 0 HB2 GLU A 40 16.704 3.085 7.704 1.00 0.89 H new ATOM 0 HB3 GLU A 40 17.972 2.411 6.700 1.00 0.89 H new ATOM 0 HG2 GLU A 40 17.437 4.595 5.205 1.00 0.99 H new ATOM 0 HG3 GLU A 40 16.853 5.213 6.738 1.00 0.99 H new ATOM 633 N LEU A 41 14.398 0.996 6.546 1.00 0.80 N ATOM 634 CA LEU A 41 13.791 -0.316 6.725 1.00 0.86 C ATOM 635 C LEU A 41 13.163 -0.827 5.421 1.00 0.80 C ATOM 636 O LEU A 41 13.505 -1.921 4.977 1.00 0.87 O ATOM 637 CB LEU A 41 12.812 -0.295 7.908 1.00 1.02 C ATOM 638 CG LEU A 41 13.474 -0.636 9.259 1.00 1.29 C ATOM 639 CD1 LEU A 41 13.746 -2.141 9.400 1.00 2.82 C ATOM 640 CD2 LEU A 41 14.772 0.131 9.536 1.00 2.35 C ATOM 0 H LEU A 41 13.848 1.764 6.931 1.00 0.80 H new ATOM 0 HA LEU A 41 14.571 -1.036 6.975 1.00 0.86 H new ATOM 0 HB2 LEU A 41 12.356 0.693 7.975 1.00 1.02 H new ATOM 0 HB3 LEU A 41 12.008 -1.005 7.717 1.00 1.02 H new ATOM 0 HG LEU A 41 12.742 -0.318 10.001 1.00 1.29 H new ATOM 0 HD11 LEU A 41 14.213 -2.338 10.365 1.00 2.82 H new ATOM 0 HD12 LEU A 41 12.806 -2.688 9.333 1.00 2.82 H new ATOM 0 HD13 LEU A 41 14.413 -2.467 8.602 1.00 2.82 H new ATOM 0 HD21 LEU A 41 15.171 -0.168 10.505 1.00 2.35 H new ATOM 0 HD22 LEU A 41 15.501 -0.095 8.758 1.00 2.35 H new ATOM 0 HD23 LEU A 41 14.568 1.202 9.542 1.00 2.35 H new ATOM 652 N VAL A 42 12.278 -0.075 4.757 1.00 0.80 N ATOM 653 CA VAL A 42 11.638 -0.566 3.534 1.00 0.83 C ATOM 654 C VAL A 42 12.690 -0.983 2.493 1.00 0.87 C ATOM 655 O VAL A 42 12.581 -2.056 1.902 1.00 0.94 O ATOM 656 CB VAL A 42 10.557 0.392 2.983 1.00 0.87 C ATOM 657 CG1 VAL A 42 11.127 1.724 2.481 1.00 1.78 C ATOM 658 CG2 VAL A 42 9.799 -0.290 1.846 1.00 2.78 C ATOM 0 H VAL A 42 11.992 0.862 5.041 1.00 0.80 H new ATOM 0 HA VAL A 42 11.082 -1.467 3.796 1.00 0.83 H new ATOM 0 HB VAL A 42 9.890 0.621 3.814 1.00 0.87 H new ATOM 0 HG11 VAL A 42 10.316 2.349 2.108 1.00 1.78 H new ATOM 0 HG12 VAL A 42 11.632 2.236 3.300 1.00 1.78 H new ATOM 0 HG13 VAL A 42 11.839 1.535 1.677 1.00 1.78 H new ATOM 0 HG21 VAL A 42 9.037 0.387 1.459 1.00 2.78 H new ATOM 0 HG22 VAL A 42 10.495 -0.548 1.048 1.00 2.78 H new ATOM 0 HG23 VAL A 42 9.323 -1.197 2.219 1.00 2.78 H new ATOM 668 N THR A 43 13.751 -0.188 2.304 1.00 0.88 N ATOM 669 CA THR A 43 14.807 -0.579 1.371 1.00 0.98 C ATOM 670 C THR A 43 15.512 -1.876 1.795 1.00 0.96 C ATOM 671 O THR A 43 16.142 -2.514 0.957 1.00 0.96 O ATOM 672 CB THR A 43 15.810 0.562 1.141 1.00 1.07 C ATOM 673 OG1 THR A 43 16.652 0.248 0.055 1.00 1.35 O ATOM 674 CG2 THR A 43 16.689 0.831 2.359 1.00 1.24 C ATOM 0 H THR A 43 13.897 0.706 2.772 1.00 0.88 H new ATOM 0 HA THR A 43 14.321 -0.785 0.417 1.00 0.98 H new ATOM 0 HB THR A 43 15.220 1.456 0.940 1.00 1.07 H new ATOM 0 HG1 THR A 43 16.863 -0.709 0.071 1.00 1.35 H new ATOM 0 HG21 THR A 43 17.377 1.647 2.138 1.00 1.24 H new ATOM 0 HG22 THR A 43 16.062 1.105 3.207 1.00 1.24 H new ATOM 0 HG23 THR A 43 17.257 -0.067 2.603 1.00 1.24 H new ATOM 682 N GLN A 44 15.449 -2.249 3.077 1.00 1.07 N ATOM 683 CA GLN A 44 15.970 -3.509 3.584 1.00 1.13 C ATOM 684 C GLN A 44 14.965 -4.629 3.297 1.00 1.14 C ATOM 685 O GLN A 44 15.345 -5.691 2.810 1.00 1.25 O ATOM 686 CB GLN A 44 16.264 -3.364 5.082 1.00 1.16 C ATOM 687 CG GLN A 44 17.259 -4.421 5.570 1.00 1.87 C ATOM 688 CD GLN A 44 17.444 -4.356 7.083 1.00 2.05 C ATOM 689 OE1 GLN A 44 17.300 -5.358 7.774 1.00 3.13 O ATOM 690 NE2 GLN A 44 17.755 -3.178 7.617 1.00 2.34 N ATOM 0 H GLN A 44 15.025 -1.668 3.800 1.00 1.07 H new ATOM 0 HA GLN A 44 16.903 -3.769 3.084 1.00 1.13 H new ATOM 0 HB2 GLN A 44 16.664 -2.369 5.280 1.00 1.16 H new ATOM 0 HB3 GLN A 44 15.335 -3.452 5.645 1.00 1.16 H new ATOM 0 HG2 GLN A 44 16.906 -5.413 5.288 1.00 1.87 H new ATOM 0 HG3 GLN A 44 18.220 -4.273 5.078 1.00 1.87 H new ATOM 0 HE21 GLN A 44 17.869 -2.360 7.018 1.00 2.34 H new ATOM 0 HE22 GLN A 44 17.880 -3.092 8.626 1.00 2.34 H new ATOM 699 N GLN A 45 13.678 -4.385 3.577 1.00 1.09 N ATOM 700 CA GLN A 45 12.594 -5.310 3.253 1.00 1.14 C ATOM 701 C GLN A 45 12.585 -5.639 1.755 1.00 1.10 C ATOM 702 O GLN A 45 12.144 -6.724 1.390 1.00 1.22 O ATOM 703 CB GLN A 45 11.228 -4.723 3.632 1.00 1.19 C ATOM 704 CG GLN A 45 10.871 -4.467 5.109 1.00 1.23 C ATOM 705 CD GLN A 45 11.981 -4.501 6.164 1.00 1.28 C ATOM 706 OE1 GLN A 45 12.166 -3.527 6.883 1.00 1.87 O ATOM 707 NE2 GLN A 45 12.690 -5.612 6.334 1.00 2.23 N ATOM 0 H GLN A 45 13.362 -3.532 4.038 1.00 1.09 H new ATOM 0 HA GLN A 45 12.769 -6.219 3.829 1.00 1.14 H new ATOM 0 HB2 GLN A 45 11.129 -3.773 3.107 1.00 1.19 H new ATOM 0 HB3 GLN A 45 10.467 -5.391 3.228 1.00 1.19 H new ATOM 0 HG2 GLN A 45 10.394 -3.488 5.166 1.00 1.23 H new ATOM 0 HG3 GLN A 45 10.122 -5.204 5.398 1.00 1.23 H new ATOM 0 HE21 GLN A 45 12.528 -6.418 5.730 1.00 2.23 H new ATOM 0 HE22 GLN A 45 13.396 -5.659 7.069 1.00 2.23 H new ATOM 716 N LEU A 46 13.034 -4.720 0.894 1.00 1.00 N ATOM 717 CA LEU A 46 13.245 -4.983 -0.527 1.00 0.99 C ATOM 718 C LEU A 46 14.739 -5.171 -0.819 1.00 0.89 C ATOM 719 O LEU A 46 15.361 -4.255 -1.348 1.00 1.03 O ATOM 720 CB LEU A 46 12.704 -3.820 -1.379 1.00 1.07 C ATOM 721 CG LEU A 46 11.175 -3.773 -1.473 1.00 1.37 C ATOM 722 CD1 LEU A 46 10.530 -3.089 -0.268 1.00 1.39 C ATOM 723 CD2 LEU A 46 10.762 -2.998 -2.726 1.00 1.82 C ATOM 0 H LEU A 46 13.262 -3.765 1.170 1.00 1.00 H new ATOM 0 HA LEU A 46 12.708 -5.896 -0.785 1.00 0.99 H new ATOM 0 HB2 LEU A 46 13.061 -2.879 -0.959 1.00 1.07 H new ATOM 0 HB3 LEU A 46 13.117 -3.897 -2.385 1.00 1.07 H new ATOM 0 HG LEU A 46 10.833 -4.807 -1.508 1.00 1.37 H new ATOM 0 HD11 LEU A 46 9.447 -3.085 -0.389 1.00 1.39 H new ATOM 0 HD12 LEU A 46 10.792 -3.631 0.641 1.00 1.39 H new ATOM 0 HD13 LEU A 46 10.891 -2.063 -0.196 1.00 1.39 H new ATOM 0 HD21 LEU A 46 9.674 -2.965 -2.792 1.00 1.82 H new ATOM 0 HD22 LEU A 46 11.153 -1.982 -2.671 1.00 1.82 H new ATOM 0 HD23 LEU A 46 11.164 -3.494 -3.610 1.00 1.82 H new ATOM 735 N PRO A 47 15.349 -6.346 -0.611 1.00 0.89 N ATOM 736 CA PRO A 47 16.750 -6.555 -0.958 1.00 0.92 C ATOM 737 C PRO A 47 16.912 -6.783 -2.472 1.00 0.90 C ATOM 738 O PRO A 47 17.711 -7.620 -2.885 1.00 1.02 O ATOM 739 CB PRO A 47 17.141 -7.797 -0.151 1.00 1.12 C ATOM 740 CG PRO A 47 15.861 -8.628 -0.225 1.00 1.21 C ATOM 741 CD PRO A 47 14.773 -7.565 -0.072 1.00 1.09 C ATOM 0 HA PRO A 47 17.382 -5.697 -0.728 1.00 0.92 H new ATOM 0 HB2 PRO A 47 17.993 -8.318 -0.588 1.00 1.12 H new ATOM 0 HB3 PRO A 47 17.410 -7.550 0.876 1.00 1.12 H new ATOM 0 HG2 PRO A 47 15.777 -9.162 -1.171 1.00 1.21 H new ATOM 0 HG3 PRO A 47 15.814 -9.375 0.568 1.00 1.21 H new ATOM 0 HD2 PRO A 47 13.870 -7.846 -0.614 1.00 1.09 H new ATOM 0 HD3 PRO A 47 14.491 -7.438 0.973 1.00 1.09 H new ATOM 749 N HIS A 48 16.142 -6.080 -3.313 1.00 1.15 N ATOM 750 CA HIS A 48 16.007 -6.369 -4.734 1.00 1.26 C ATOM 751 C HIS A 48 17.266 -5.917 -5.494 1.00 1.40 C ATOM 752 O HIS A 48 18.279 -6.615 -5.496 1.00 2.36 O ATOM 753 CB HIS A 48 14.744 -5.685 -5.276 1.00 1.69 C ATOM 754 CG HIS A 48 13.405 -6.202 -4.824 1.00 2.02 C ATOM 755 ND1 HIS A 48 13.094 -7.374 -4.161 1.00 2.84 N ATOM 756 CD2 HIS A 48 12.227 -5.611 -5.188 1.00 3.00 C ATOM 757 CE1 HIS A 48 11.752 -7.463 -4.126 1.00 4.09 C ATOM 758 NE2 HIS A 48 11.180 -6.417 -4.753 1.00 4.16 N ATOM 0 H HIS A 48 15.587 -5.279 -3.011 1.00 1.15 H new ATOM 0 HA HIS A 48 15.906 -7.444 -4.882 1.00 1.26 H new ATOM 0 HB2 HIS A 48 14.799 -4.629 -5.013 1.00 1.69 H new ATOM 0 HB3 HIS A 48 14.774 -5.745 -6.364 1.00 1.69 H new ATOM 0 HD1 HIS A 48 13.757 -8.045 -3.772 1.00 2.84 H new ATOM 0 HD2 HIS A 48 12.127 -4.678 -5.722 1.00 3.00 H new ATOM 0 HE1 HIS A 48 11.205 -8.267 -3.657 1.00 4.09 H new ATOM 766 N LEU A 49 17.168 -4.757 -6.155 1.00 1.27 N ATOM 767 CA LEU A 49 18.225 -4.033 -6.852 1.00 1.30 C ATOM 768 C LEU A 49 18.291 -2.618 -6.269 1.00 1.19 C ATOM 769 O LEU A 49 19.378 -2.123 -5.994 1.00 1.29 O ATOM 770 CB LEU A 49 17.918 -3.933 -8.360 1.00 1.44 C ATOM 771 CG LEU A 49 18.341 -5.115 -9.252 1.00 1.36 C ATOM 772 CD1 LEU A 49 19.862 -5.309 -9.275 1.00 2.42 C ATOM 773 CD2 LEU A 49 17.640 -6.430 -8.902 1.00 2.80 C ATOM 0 H LEU A 49 16.276 -4.267 -6.218 1.00 1.27 H new ATOM 0 HA LEU A 49 19.170 -4.561 -6.724 1.00 1.30 H new ATOM 0 HB2 LEU A 49 16.843 -3.792 -8.476 1.00 1.44 H new ATOM 0 HB3 LEU A 49 18.400 -3.034 -8.742 1.00 1.44 H new ATOM 0 HG LEU A 49 18.013 -4.839 -10.254 1.00 1.36 H new ATOM 0 HD11 LEU A 49 20.111 -6.154 -9.917 1.00 2.42 H new ATOM 0 HD12 LEU A 49 20.338 -4.407 -9.660 1.00 2.42 H new ATOM 0 HD13 LEU A 49 20.219 -5.504 -8.264 1.00 2.42 H new ATOM 0 HD21 LEU A 49 17.987 -7.217 -9.571 1.00 2.80 H new ATOM 0 HD22 LEU A 49 17.870 -6.702 -7.872 1.00 2.80 H new ATOM 0 HD23 LEU A 49 16.562 -6.309 -9.013 1.00 2.80 H new ATOM 785 N LEU A 50 17.124 -1.971 -6.119 1.00 1.12 N ATOM 786 CA LEU A 50 16.980 -0.581 -5.690 1.00 1.14 C ATOM 787 C LEU A 50 17.605 0.317 -6.754 1.00 1.15 C ATOM 788 O LEU A 50 18.598 1.007 -6.537 1.00 1.34 O ATOM 789 CB LEU A 50 17.491 -0.341 -4.259 1.00 1.36 C ATOM 790 CG LEU A 50 16.460 -0.685 -3.171 1.00 1.67 C ATOM 791 CD1 LEU A 50 15.384 0.400 -3.031 1.00 2.90 C ATOM 792 CD2 LEU A 50 15.770 -2.036 -3.373 1.00 2.08 C ATOM 0 H LEU A 50 16.227 -2.422 -6.301 1.00 1.12 H new ATOM 0 HA LEU A 50 15.924 -0.322 -5.614 1.00 1.14 H new ATOM 0 HB2 LEU A 50 18.389 -0.937 -4.098 1.00 1.36 H new ATOM 0 HB3 LEU A 50 17.780 0.705 -4.156 1.00 1.36 H new ATOM 0 HG LEU A 50 17.049 -0.744 -2.256 1.00 1.67 H new ATOM 0 HD11 LEU A 50 14.678 0.114 -2.251 1.00 2.90 H new ATOM 0 HD12 LEU A 50 15.854 1.347 -2.765 1.00 2.90 H new ATOM 0 HD13 LEU A 50 14.854 0.511 -3.977 1.00 2.90 H new ATOM 0 HD21 LEU A 50 15.058 -2.205 -2.565 1.00 2.08 H new ATOM 0 HD22 LEU A 50 15.243 -2.036 -4.327 1.00 2.08 H new ATOM 0 HD23 LEU A 50 16.517 -2.830 -3.371 1.00 2.08 H new ATOM 804 N LYS A 51 17.006 0.251 -7.944 1.00 1.05 N ATOM 805 CA LYS A 51 17.447 0.989 -9.119 1.00 1.12 C ATOM 806 C LYS A 51 16.944 2.433 -9.064 1.00 1.11 C ATOM 807 O LYS A 51 17.594 3.332 -9.587 1.00 1.23 O ATOM 808 CB LYS A 51 16.976 0.245 -10.380 1.00 1.13 C ATOM 809 CG LYS A 51 15.447 0.250 -10.553 1.00 1.07 C ATOM 810 CD LYS A 51 14.957 1.487 -11.328 1.00 1.28 C ATOM 811 CE LYS A 51 14.601 1.172 -12.781 1.00 1.50 C ATOM 812 NZ LYS A 51 15.802 0.831 -13.574 1.00 2.09 N ATOM 0 H LYS A 51 16.185 -0.329 -8.117 1.00 1.05 H new ATOM 0 HA LYS A 51 18.535 1.043 -9.146 1.00 1.12 H new ATOM 0 HB2 LYS A 51 17.436 0.702 -11.256 1.00 1.13 H new ATOM 0 HB3 LYS A 51 17.327 -0.786 -10.338 1.00 1.13 H new ATOM 0 HG2 LYS A 51 15.139 -0.653 -11.080 1.00 1.07 H new ATOM 0 HG3 LYS A 51 14.971 0.225 -9.573 1.00 1.07 H new ATOM 0 HD2 LYS A 51 14.083 1.902 -10.826 1.00 1.28 H new ATOM 0 HD3 LYS A 51 15.731 2.254 -11.306 1.00 1.28 H new ATOM 0 HE2 LYS A 51 13.896 0.341 -12.812 1.00 1.50 H new ATOM 0 HE3 LYS A 51 14.101 2.031 -13.228 1.00 1.50 H new ATOM 0 HZ1 LYS A 51 15.523 0.623 -14.554 1.00 2.09 H new ATOM 0 HZ2 LYS A 51 16.463 1.634 -13.565 1.00 2.09 H new ATOM 0 HZ3 LYS A 51 16.265 -0.004 -13.161 1.00 2.09 H new ATOM 826 N ASP A 52 15.739 2.593 -8.510 1.00 1.04 N ATOM 827 CA ASP A 52 15.066 3.796 -8.067 1.00 1.14 C ATOM 828 C ASP A 52 15.456 5.066 -8.812 1.00 1.03 C ATOM 829 O ASP A 52 16.384 5.767 -8.415 1.00 1.16 O ATOM 830 CB ASP A 52 15.181 3.904 -6.542 1.00 1.49 C ATOM 831 CG ASP A 52 14.598 2.703 -5.800 1.00 1.79 C ATOM 832 OD1 ASP A 52 14.600 1.594 -6.391 1.00 2.66 O ATOM 833 OD2 ASP A 52 14.121 2.927 -4.667 1.00 2.32 O ATOM 0 H ASP A 52 15.149 1.777 -8.346 1.00 1.04 H new ATOM 0 HA ASP A 52 14.013 3.699 -8.331 1.00 1.14 H new ATOM 0 HB2 ASP A 52 16.231 4.013 -6.272 1.00 1.49 H new ATOM 0 HB3 ASP A 52 14.671 4.808 -6.210 1.00 1.49 H new ATOM 838 N VAL A 53 14.711 5.372 -9.880 1.00 1.08 N ATOM 839 CA VAL A 53 14.887 6.591 -10.652 1.00 1.11 C ATOM 840 C VAL A 53 13.645 7.476 -10.590 1.00 1.09 C ATOM 841 O VAL A 53 12.572 7.039 -10.175 1.00 1.49 O ATOM 842 CB VAL A 53 15.321 6.274 -12.094 1.00 1.67 C ATOM 843 CG1 VAL A 53 16.695 5.596 -12.109 1.00 2.84 C ATOM 844 CG2 VAL A 53 14.300 5.396 -12.831 1.00 2.73 C ATOM 0 H VAL A 53 13.965 4.771 -10.230 1.00 1.08 H new ATOM 0 HA VAL A 53 15.695 7.166 -10.200 1.00 1.11 H new ATOM 0 HB VAL A 53 15.380 7.226 -12.621 1.00 1.67 H new ATOM 0 HG11 VAL A 53 16.983 5.380 -13.138 1.00 2.84 H new ATOM 0 HG12 VAL A 53 17.433 6.259 -11.657 1.00 2.84 H new ATOM 0 HG13 VAL A 53 16.648 4.666 -11.543 1.00 2.84 H new ATOM 0 HG21 VAL A 53 14.652 5.201 -13.844 1.00 2.73 H new ATOM 0 HG22 VAL A 53 14.181 4.452 -12.300 1.00 2.73 H new ATOM 0 HG23 VAL A 53 13.340 5.911 -12.874 1.00 2.73 H new ATOM 854 N GLY A 54 13.808 8.737 -10.999 1.00 1.20 N ATOM 855 CA GLY A 54 12.755 9.734 -10.993 1.00 1.31 C ATOM 856 C GLY A 54 12.280 10.003 -9.569 1.00 1.17 C ATOM 857 O GLY A 54 12.938 10.711 -8.813 1.00 1.31 O ATOM 0 H GLY A 54 14.698 9.092 -11.349 1.00 1.20 H new ATOM 0 HA2 GLY A 54 13.119 10.658 -11.442 1.00 1.31 H new ATOM 0 HA3 GLY A 54 11.919 9.392 -11.603 1.00 1.31 H new ATOM 861 N SER A 55 11.151 9.408 -9.193 1.00 1.25 N ATOM 862 CA SER A 55 10.452 9.693 -7.950 1.00 1.37 C ATOM 863 C SER A 55 11.263 9.325 -6.705 1.00 1.14 C ATOM 864 O SER A 55 10.970 9.818 -5.616 1.00 1.14 O ATOM 865 CB SER A 55 9.061 9.071 -7.989 1.00 1.69 C ATOM 866 OG SER A 55 8.304 9.700 -9.008 1.00 2.14 O ATOM 0 H SER A 55 10.688 8.698 -9.760 1.00 1.25 H new ATOM 0 HA SER A 55 10.327 10.772 -7.864 1.00 1.37 H new ATOM 0 HB2 SER A 55 9.132 8.000 -8.179 1.00 1.69 H new ATOM 0 HB3 SER A 55 8.567 9.191 -7.025 1.00 1.69 H new ATOM 0 HG SER A 55 7.961 10.557 -8.679 1.00 2.14 H new ATOM 872 N LEU A 56 12.307 8.505 -6.863 1.00 1.02 N ATOM 873 CA LEU A 56 13.379 8.407 -5.879 1.00 0.95 C ATOM 874 C LEU A 56 13.717 9.786 -5.319 1.00 0.86 C ATOM 875 O LEU A 56 13.684 9.972 -4.106 1.00 0.77 O ATOM 876 CB LEU A 56 14.620 7.801 -6.542 1.00 1.08 C ATOM 877 CG LEU A 56 15.858 7.644 -5.631 1.00 1.29 C ATOM 878 CD1 LEU A 56 16.678 8.928 -5.432 1.00 1.69 C ATOM 879 CD2 LEU A 56 15.541 7.005 -4.273 1.00 2.44 C ATOM 0 H LEU A 56 12.429 7.896 -7.672 1.00 1.02 H new ATOM 0 HA LEU A 56 13.050 7.770 -5.058 1.00 0.95 H new ATOM 0 HB2 LEU A 56 14.356 6.820 -6.937 1.00 1.08 H new ATOM 0 HB3 LEU A 56 14.895 8.424 -7.393 1.00 1.08 H new ATOM 0 HG LEU A 56 16.486 6.954 -6.194 1.00 1.29 H new ATOM 0 HD11 LEU A 56 17.526 8.721 -4.779 1.00 1.69 H new ATOM 0 HD12 LEU A 56 17.041 9.281 -6.397 1.00 1.69 H new ATOM 0 HD13 LEU A 56 16.050 9.694 -4.978 1.00 1.69 H new ATOM 0 HD21 LEU A 56 16.456 6.926 -3.686 1.00 2.44 H new ATOM 0 HD22 LEU A 56 14.820 7.624 -3.739 1.00 2.44 H new ATOM 0 HD23 LEU A 56 15.122 6.011 -4.428 1.00 2.44 H new ATOM 891 N ASP A 57 14.033 10.738 -6.202 1.00 0.98 N ATOM 892 CA ASP A 57 14.434 12.086 -5.827 1.00 1.07 C ATOM 893 C ASP A 57 13.365 12.716 -4.930 1.00 1.01 C ATOM 894 O ASP A 57 13.636 13.105 -3.791 1.00 0.98 O ATOM 895 CB ASP A 57 14.666 12.911 -7.103 1.00 1.33 C ATOM 896 CG ASP A 57 14.772 14.400 -6.824 1.00 2.02 C ATOM 897 OD1 ASP A 57 15.505 14.781 -5.893 1.00 2.73 O ATOM 898 OD2 ASP A 57 14.049 15.168 -7.496 1.00 2.76 O ATOM 0 H ASP A 57 14.015 10.586 -7.210 1.00 0.98 H new ATOM 0 HA ASP A 57 15.364 12.061 -5.259 1.00 1.07 H new ATOM 0 HB2 ASP A 57 15.580 12.570 -7.590 1.00 1.33 H new ATOM 0 HB3 ASP A 57 13.847 12.733 -7.800 1.00 1.33 H new ATOM 903 N GLU A 58 12.131 12.774 -5.443 1.00 1.09 N ATOM 904 CA GLU A 58 10.961 13.256 -4.723 1.00 1.14 C ATOM 905 C GLU A 58 10.881 12.642 -3.321 1.00 0.92 C ATOM 906 O GLU A 58 10.675 13.351 -2.334 1.00 0.99 O ATOM 907 CB GLU A 58 9.682 12.954 -5.513 1.00 1.31 C ATOM 908 CG GLU A 58 9.670 13.573 -6.915 1.00 1.93 C ATOM 909 CD GLU A 58 8.342 13.292 -7.608 1.00 2.54 C ATOM 910 OE1 GLU A 58 8.223 12.184 -8.179 1.00 3.48 O ATOM 911 OE2 GLU A 58 7.468 14.180 -7.537 1.00 3.50 O ATOM 0 H GLU A 58 11.920 12.478 -6.396 1.00 1.09 H new ATOM 0 HA GLU A 58 11.057 14.336 -4.613 1.00 1.14 H new ATOM 0 HB2 GLU A 58 9.565 11.874 -5.600 1.00 1.31 H new ATOM 0 HB3 GLU A 58 8.823 13.324 -4.954 1.00 1.31 H new ATOM 0 HG2 GLU A 58 9.831 14.649 -6.846 1.00 1.93 H new ATOM 0 HG3 GLU A 58 10.490 13.165 -7.507 1.00 1.93 H new ATOM 918 N LYS A 59 11.054 11.326 -3.220 1.00 0.78 N ATOM 919 CA LYS A 59 10.956 10.643 -1.944 1.00 0.72 C ATOM 920 C LYS A 59 12.101 11.072 -1.026 1.00 0.65 C ATOM 921 O LYS A 59 11.871 11.476 0.113 1.00 0.70 O ATOM 922 CB LYS A 59 10.906 9.122 -2.155 1.00 0.79 C ATOM 923 CG LYS A 59 10.171 8.457 -0.985 1.00 0.68 C ATOM 924 CD LYS A 59 9.617 7.070 -1.327 1.00 0.68 C ATOM 925 CE LYS A 59 10.633 5.931 -1.422 1.00 0.74 C ATOM 926 NZ LYS A 59 11.335 5.899 -2.724 1.00 1.03 N ATOM 0 H LYS A 59 11.263 10.716 -4.010 1.00 0.78 H new ATOM 0 HA LYS A 59 10.026 10.926 -1.450 1.00 0.72 H new ATOM 0 HB2 LYS A 59 10.399 8.893 -3.092 1.00 0.79 H new ATOM 0 HB3 LYS A 59 11.917 8.724 -2.234 1.00 0.79 H new ATOM 0 HG2 LYS A 59 10.853 8.370 -0.139 1.00 0.68 H new ATOM 0 HG3 LYS A 59 9.350 9.100 -0.668 1.00 0.68 H new ATOM 0 HD2 LYS A 59 8.876 6.804 -0.573 1.00 0.68 H new ATOM 0 HD3 LYS A 59 9.092 7.138 -2.280 1.00 0.68 H new ATOM 0 HE2 LYS A 59 11.365 6.035 -0.621 1.00 0.74 H new ATOM 0 HE3 LYS A 59 10.123 4.981 -1.265 1.00 0.74 H new ATOM 0 HZ1 LYS A 59 11.855 5.003 -2.816 1.00 1.03 H new ATOM 0 HZ2 LYS A 59 10.641 5.977 -3.495 1.00 1.03 H new ATOM 0 HZ3 LYS A 59 12.003 6.694 -2.778 1.00 1.03 H new ATOM 940 N MET A 60 13.333 10.986 -1.529 1.00 0.64 N ATOM 941 CA MET A 60 14.540 11.323 -0.798 1.00 0.70 C ATOM 942 C MET A 60 14.410 12.713 -0.182 1.00 0.76 C ATOM 943 O MET A 60 14.586 12.859 1.026 1.00 0.85 O ATOM 944 CB MET A 60 15.757 11.192 -1.722 1.00 0.78 C ATOM 945 CG MET A 60 17.072 11.403 -0.964 1.00 0.99 C ATOM 946 SD MET A 60 18.554 11.050 -1.943 1.00 1.62 S ATOM 947 CE MET A 60 19.829 11.397 -0.711 1.00 2.57 C ATOM 0 H MET A 60 13.516 10.671 -2.482 1.00 0.64 H new ATOM 0 HA MET A 60 14.685 10.626 0.027 1.00 0.70 H new ATOM 0 HB2 MET A 60 15.758 10.205 -2.184 1.00 0.78 H new ATOM 0 HB3 MET A 60 15.681 11.921 -2.529 1.00 0.78 H new ATOM 0 HG2 MET A 60 17.117 12.435 -0.616 1.00 0.99 H new ATOM 0 HG3 MET A 60 17.075 10.767 -0.078 1.00 0.99 H new ATOM 0 HE1 MET A 60 20.813 11.229 -1.149 1.00 2.57 H new ATOM 0 HE2 MET A 60 19.748 12.434 -0.386 1.00 2.57 H new ATOM 0 HE3 MET A 60 19.696 10.737 0.146 1.00 2.57 H new ATOM 957 N LYS A 61 14.069 13.722 -0.991 1.00 0.80 N ATOM 958 CA LYS A 61 13.903 15.071 -0.460 1.00 0.92 C ATOM 959 C LYS A 61 12.776 15.102 0.578 1.00 0.87 C ATOM 960 O LYS A 61 12.950 15.650 1.661 1.00 0.95 O ATOM 961 CB LYS A 61 13.725 16.116 -1.569 1.00 1.11 C ATOM 962 CG LYS A 61 12.405 15.941 -2.322 1.00 1.39 C ATOM 963 CD LYS A 61 12.253 16.865 -3.523 1.00 1.72 C ATOM 964 CE LYS A 61 13.360 16.588 -4.550 1.00 2.10 C ATOM 965 NZ LYS A 61 12.948 16.867 -5.938 1.00 2.49 N ATOM 0 H LYS A 61 13.906 13.630 -1.994 1.00 0.80 H new ATOM 0 HA LYS A 61 14.824 15.350 0.051 1.00 0.92 H new ATOM 0 HB2 LYS A 61 13.764 17.115 -1.134 1.00 1.11 H new ATOM 0 HB3 LYS A 61 14.555 16.042 -2.272 1.00 1.11 H new ATOM 0 HG2 LYS A 61 12.324 14.907 -2.659 1.00 1.39 H new ATOM 0 HG3 LYS A 61 11.579 16.117 -1.633 1.00 1.39 H new ATOM 0 HD2 LYS A 61 11.276 16.718 -3.983 1.00 1.72 H new ATOM 0 HD3 LYS A 61 12.300 17.905 -3.199 1.00 1.72 H new ATOM 0 HE2 LYS A 61 14.232 17.196 -4.308 1.00 2.10 H new ATOM 0 HE3 LYS A 61 13.667 15.545 -4.472 1.00 2.10 H new ATOM 0 HZ1 LYS A 61 13.004 15.993 -6.499 1.00 2.49 H new ATOM 0 HZ2 LYS A 61 11.970 17.221 -5.945 1.00 2.49 H new ATOM 0 HZ3 LYS A 61 13.579 17.584 -6.350 1.00 2.49 H new ATOM 979 N SER A 62 11.620 14.506 0.264 1.00 0.82 N ATOM 980 CA SER A 62 10.507 14.444 1.210 1.00 0.88 C ATOM 981 C SER A 62 10.944 13.909 2.578 1.00 0.91 C ATOM 982 O SER A 62 10.526 14.453 3.599 1.00 1.04 O ATOM 983 CB SER A 62 9.334 13.633 0.653 1.00 0.95 C ATOM 984 OG SER A 62 8.834 14.238 -0.523 1.00 1.79 O ATOM 0 H SER A 62 11.434 14.062 -0.635 1.00 0.82 H new ATOM 0 HA SER A 62 10.164 15.468 1.355 1.00 0.88 H new ATOM 0 HB2 SER A 62 9.657 12.615 0.437 1.00 0.95 H new ATOM 0 HB3 SER A 62 8.543 13.565 1.400 1.00 0.95 H new ATOM 0 HG SER A 62 9.352 13.929 -1.296 1.00 1.79 H new ATOM 990 N LEU A 63 11.787 12.869 2.620 1.00 0.87 N ATOM 991 CA LEU A 63 12.396 12.465 3.883 1.00 0.96 C ATOM 992 C LEU A 63 13.286 13.606 4.388 1.00 1.00 C ATOM 993 O LEU A 63 13.035 14.139 5.465 1.00 1.10 O ATOM 994 CB LEU A 63 13.135 11.115 3.799 1.00 1.02 C ATOM 995 CG LEU A 63 12.289 9.855 3.502 1.00 1.35 C ATOM 996 CD1 LEU A 63 10.827 10.068 3.076 1.00 1.60 C ATOM 997 CD2 LEU A 63 12.980 9.071 2.384 1.00 1.95 C ATOM 0 H LEU A 63 12.055 12.307 1.812 1.00 0.87 H new ATOM 0 HA LEU A 63 11.604 12.286 4.610 1.00 0.96 H new ATOM 0 HB2 LEU A 63 13.899 11.197 3.026 1.00 1.02 H new ATOM 0 HB3 LEU A 63 13.654 10.956 4.744 1.00 1.02 H new ATOM 0 HG LEU A 63 12.233 9.337 4.460 1.00 1.35 H new ATOM 0 HD11 LEU A 63 10.355 9.101 2.901 1.00 1.60 H new ATOM 0 HD12 LEU A 63 10.291 10.596 3.865 1.00 1.60 H new ATOM 0 HD13 LEU A 63 10.797 10.658 2.160 1.00 1.60 H new ATOM 0 HD21 LEU A 63 12.401 8.176 2.156 1.00 1.95 H new ATOM 0 HD22 LEU A 63 13.051 9.694 1.493 1.00 1.95 H new ATOM 0 HD23 LEU A 63 13.981 8.784 2.706 1.00 1.95 H new ATOM 1009 N ASP A 64 14.302 14.000 3.616 1.00 0.99 N ATOM 1010 CA ASP A 64 15.309 14.980 4.028 1.00 1.12 C ATOM 1011 C ASP A 64 14.709 16.190 4.760 1.00 1.16 C ATOM 1012 O ASP A 64 15.163 16.541 5.847 1.00 1.32 O ATOM 1013 CB ASP A 64 16.115 15.428 2.805 1.00 1.14 C ATOM 1014 CG ASP A 64 17.231 16.381 3.204 1.00 1.38 C ATOM 1015 OD1 ASP A 64 18.297 15.865 3.602 1.00 2.39 O ATOM 1016 OD2 ASP A 64 16.998 17.601 3.083 1.00 1.89 O ATOM 0 H ASP A 64 14.450 13.641 2.673 1.00 0.99 H new ATOM 0 HA ASP A 64 15.966 14.491 4.747 1.00 1.12 H new ATOM 0 HB2 ASP A 64 16.538 14.557 2.305 1.00 1.14 H new ATOM 0 HB3 ASP A 64 15.454 15.916 2.089 1.00 1.14 H new ATOM 1021 N VAL A 65 13.654 16.778 4.182 1.00 1.06 N ATOM 1022 CA VAL A 65 12.979 17.986 4.663 1.00 1.12 C ATOM 1023 C VAL A 65 12.742 17.948 6.170 1.00 1.13 C ATOM 1024 O VAL A 65 13.283 18.764 6.915 1.00 1.25 O ATOM 1025 CB VAL A 65 11.651 18.165 3.901 1.00 1.19 C ATOM 1026 CG1 VAL A 65 10.716 19.212 4.524 1.00 1.81 C ATOM 1027 CG2 VAL A 65 11.943 18.611 2.473 1.00 1.85 C ATOM 0 H VAL A 65 13.231 16.408 3.331 1.00 1.06 H new ATOM 0 HA VAL A 65 13.627 18.841 4.471 1.00 1.12 H new ATOM 0 HB VAL A 65 11.150 17.198 3.943 1.00 1.19 H new ATOM 0 HG11 VAL A 65 9.803 19.282 3.933 1.00 1.81 H new ATOM 0 HG12 VAL A 65 10.467 18.917 5.543 1.00 1.81 H new ATOM 0 HG13 VAL A 65 11.214 20.182 4.539 1.00 1.81 H new ATOM 0 HG21 VAL A 65 11.005 18.738 1.933 1.00 1.85 H new ATOM 0 HG22 VAL A 65 12.483 19.558 2.491 1.00 1.85 H new ATOM 0 HG23 VAL A 65 12.550 17.856 1.973 1.00 1.85 H new ATOM 1037 N ASN A 66 11.888 17.025 6.613 1.00 1.06 N ATOM 1038 CA ASN A 66 11.595 16.846 8.037 1.00 1.09 C ATOM 1039 C ASN A 66 11.378 15.374 8.357 1.00 1.07 C ATOM 1040 O ASN A 66 10.379 14.999 8.969 1.00 1.08 O ATOM 1041 CB ASN A 66 10.373 17.677 8.479 1.00 1.16 C ATOM 1042 CG ASN A 66 10.651 19.176 8.545 1.00 1.48 C ATOM 1043 OD1 ASN A 66 10.105 19.951 7.767 1.00 2.76 O ATOM 1044 ND2 ASN A 66 11.471 19.609 9.498 1.00 2.29 N ATOM 0 H ASN A 66 11.383 16.384 6.001 1.00 1.06 H new ATOM 0 HA ASN A 66 12.459 17.206 8.596 1.00 1.09 H new ATOM 0 HB2 ASN A 66 9.551 17.498 7.786 1.00 1.16 H new ATOM 0 HB3 ASN A 66 10.044 17.333 9.459 1.00 1.16 H new ATOM 0 HD21 ASN A 66 11.659 20.607 9.595 1.00 2.29 H new ATOM 0 HD22 ASN A 66 11.912 18.943 10.132 1.00 2.29 H new ATOM 1051 N GLN A 67 12.372 14.542 8.053 1.00 1.08 N ATOM 1052 CA GLN A 67 12.349 13.131 8.380 1.00 1.06 C ATOM 1053 C GLN A 67 12.269 12.879 9.884 1.00 1.01 C ATOM 1054 O GLN A 67 11.968 11.762 10.298 1.00 1.07 O ATOM 1055 CB GLN A 67 13.569 12.417 7.809 1.00 1.14 C ATOM 1056 CG GLN A 67 14.854 13.252 7.957 1.00 1.26 C ATOM 1057 CD GLN A 67 16.084 12.365 7.958 1.00 2.27 C ATOM 1058 OE1 GLN A 67 16.540 11.908 6.915 1.00 2.87 O ATOM 1059 NE2 GLN A 67 16.593 12.060 9.147 1.00 3.62 N ATOM 0 H GLN A 67 13.220 14.838 7.569 1.00 1.08 H new ATOM 0 HA GLN A 67 11.445 12.728 7.925 1.00 1.06 H new ATOM 0 HB2 GLN A 67 13.699 11.461 8.316 1.00 1.14 H new ATOM 0 HB3 GLN A 67 13.399 12.198 6.755 1.00 1.14 H new ATOM 0 HG2 GLN A 67 14.921 13.971 7.140 1.00 1.26 H new ATOM 0 HG3 GLN A 67 14.814 13.825 8.883 1.00 1.26 H new ATOM 0 HE21 GLN A 67 16.187 12.460 9.993 1.00 3.62 H new ATOM 0 HE22 GLN A 67 17.390 11.426 9.213 1.00 3.62 H new ATOM 1068 N ASP A 68 12.632 13.880 10.686 1.00 1.05 N ATOM 1069 CA ASP A 68 12.490 13.854 12.127 1.00 1.12 C ATOM 1070 C ASP A 68 11.014 13.717 12.526 1.00 1.18 C ATOM 1071 O ASP A 68 10.694 13.028 13.492 1.00 1.39 O ATOM 1072 CB ASP A 68 13.100 15.144 12.682 1.00 1.20 C ATOM 1073 CG ASP A 68 12.897 15.249 14.184 1.00 2.09 C ATOM 1074 OD1 ASP A 68 13.682 14.597 14.904 1.00 2.77 O ATOM 1075 OD2 ASP A 68 11.972 15.992 14.572 1.00 3.04 O ATOM 0 H ASP A 68 13.041 14.747 10.336 1.00 1.05 H new ATOM 0 HA ASP A 68 13.010 12.991 12.544 1.00 1.12 H new ATOM 0 HB2 ASP A 68 14.166 15.172 12.454 1.00 1.20 H new ATOM 0 HB3 ASP A 68 12.646 16.004 12.190 1.00 1.20 H new ATOM 1080 N SER A 69 10.108 14.334 11.753 1.00 1.10 N ATOM 1081 CA SER A 69 8.674 14.136 11.929 1.00 1.20 C ATOM 1082 C SER A 69 8.369 12.645 11.815 1.00 1.28 C ATOM 1083 O SER A 69 9.032 11.930 11.061 1.00 2.33 O ATOM 1084 CB SER A 69 7.897 14.931 10.870 1.00 1.20 C ATOM 1085 OG SER A 69 6.495 14.896 11.093 1.00 2.46 O ATOM 0 H SER A 69 10.351 14.976 10.998 1.00 1.10 H new ATOM 0 HA SER A 69 8.366 14.495 12.911 1.00 1.20 H new ATOM 0 HB2 SER A 69 8.238 15.966 10.873 1.00 1.20 H new ATOM 0 HB3 SER A 69 8.116 14.527 9.882 1.00 1.20 H new ATOM 0 HG SER A 69 6.040 15.415 10.398 1.00 2.46 H new ATOM 1091 N GLU A 70 7.366 12.163 12.547 1.00 1.03 N ATOM 1092 CA GLU A 70 7.017 10.758 12.463 1.00 0.89 C ATOM 1093 C GLU A 70 6.420 10.473 11.103 1.00 0.84 C ATOM 1094 O GLU A 70 5.934 11.368 10.406 1.00 1.07 O ATOM 1095 CB GLU A 70 6.017 10.289 13.524 1.00 1.10 C ATOM 1096 CG GLU A 70 6.129 11.022 14.851 1.00 1.82 C ATOM 1097 CD GLU A 70 5.219 12.247 14.902 1.00 2.63 C ATOM 1098 OE1 GLU A 70 5.269 13.032 13.924 1.00 3.43 O ATOM 1099 OE2 GLU A 70 4.434 12.343 15.864 1.00 3.45 O ATOM 0 H GLU A 70 6.796 12.714 13.189 1.00 1.03 H new ATOM 0 HA GLU A 70 7.945 10.213 12.634 1.00 0.89 H new ATOM 0 HB2 GLU A 70 5.006 10.415 13.136 1.00 1.10 H new ATOM 0 HB3 GLU A 70 6.161 9.223 13.697 1.00 1.10 H new ATOM 0 HG2 GLU A 70 5.870 10.343 15.664 1.00 1.82 H new ATOM 0 HG3 GLU A 70 7.162 11.330 15.010 1.00 1.82 H new ATOM 1106 N LEU A 71 6.357 9.191 10.797 1.00 0.88 N ATOM 1107 CA LEU A 71 5.611 8.708 9.654 1.00 0.95 C ATOM 1108 C LEU A 71 4.166 8.484 10.099 1.00 0.79 C ATOM 1109 O LEU A 71 3.895 8.386 11.296 1.00 1.00 O ATOM 1110 CB LEU A 71 6.302 7.451 9.128 1.00 1.45 C ATOM 1111 CG LEU A 71 5.802 6.969 7.760 1.00 1.47 C ATOM 1112 CD1 LEU A 71 6.147 7.952 6.635 1.00 1.55 C ATOM 1113 CD2 LEU A 71 6.532 5.660 7.484 1.00 2.67 C ATOM 0 H LEU A 71 6.821 8.458 11.333 1.00 0.88 H new ATOM 0 HA LEU A 71 5.586 9.420 8.829 1.00 0.95 H new ATOM 0 HB2 LEU A 71 7.373 7.643 9.061 1.00 1.45 H new ATOM 0 HB3 LEU A 71 6.166 6.648 9.853 1.00 1.45 H new ATOM 0 HG LEU A 71 4.717 6.867 7.784 1.00 1.47 H new ATOM 0 HD11 LEU A 71 5.772 7.566 5.687 1.00 1.55 H new ATOM 0 HD12 LEU A 71 5.686 8.918 6.842 1.00 1.55 H new ATOM 0 HD13 LEU A 71 7.229 8.072 6.576 1.00 1.55 H new ATOM 0 HD21 LEU A 71 6.217 5.264 6.518 1.00 2.67 H new ATOM 0 HD22 LEU A 71 7.607 5.839 7.470 1.00 2.67 H new ATOM 0 HD23 LEU A 71 6.295 4.939 8.266 1.00 2.67 H new ATOM 1125 N LYS A 72 3.230 8.437 9.151 1.00 0.77 N ATOM 1126 CA LYS A 72 1.827 8.149 9.401 1.00 0.91 C ATOM 1127 C LYS A 72 1.343 7.245 8.260 1.00 0.86 C ATOM 1128 O LYS A 72 1.854 7.370 7.143 1.00 0.82 O ATOM 1129 CB LYS A 72 1.022 9.461 9.487 1.00 1.19 C ATOM 1130 CG LYS A 72 1.390 10.357 10.690 1.00 1.22 C ATOM 1131 CD LYS A 72 2.467 11.429 10.409 1.00 2.00 C ATOM 1132 CE LYS A 72 2.892 12.123 11.720 1.00 2.29 C ATOM 1133 NZ LYS A 72 4.104 12.965 11.582 1.00 3.41 N ATOM 0 H LYS A 72 3.436 8.603 8.166 1.00 0.77 H new ATOM 0 HA LYS A 72 1.686 7.639 10.354 1.00 0.91 H new ATOM 0 HB2 LYS A 72 1.174 10.027 8.568 1.00 1.19 H new ATOM 0 HB3 LYS A 72 -0.039 9.219 9.541 1.00 1.19 H new ATOM 0 HG2 LYS A 72 0.487 10.856 11.040 1.00 1.22 H new ATOM 0 HG3 LYS A 72 1.738 9.720 11.503 1.00 1.22 H new ATOM 0 HD2 LYS A 72 3.334 10.967 9.937 1.00 2.00 H new ATOM 0 HD3 LYS A 72 2.079 12.168 9.708 1.00 2.00 H new ATOM 0 HE2 LYS A 72 2.069 12.742 12.076 1.00 2.29 H new ATOM 0 HE3 LYS A 72 3.072 11.364 12.481 1.00 2.29 H new ATOM 0 HZ1 LYS A 72 4.583 13.037 12.502 1.00 3.41 H new ATOM 0 HZ2 LYS A 72 4.749 12.534 10.889 1.00 3.41 H new ATOM 0 HZ3 LYS A 72 3.832 13.915 11.258 1.00 3.41 H new ATOM 1147 N PHE A 73 0.387 6.344 8.536 1.00 0.91 N ATOM 1148 CA PHE A 73 -0.061 5.279 7.633 1.00 0.89 C ATOM 1149 C PHE A 73 -0.170 5.726 6.174 1.00 0.72 C ATOM 1150 O PHE A 73 0.388 5.087 5.288 1.00 0.59 O ATOM 1151 CB PHE A 73 -1.408 4.691 8.088 1.00 1.22 C ATOM 1152 CG PHE A 73 -1.370 3.899 9.379 1.00 1.20 C ATOM 1153 CD1 PHE A 73 -1.130 2.513 9.335 1.00 2.91 C ATOM 1154 CD2 PHE A 73 -1.642 4.517 10.611 1.00 2.30 C ATOM 1155 CE1 PHE A 73 -1.159 1.750 10.514 1.00 4.54 C ATOM 1156 CE2 PHE A 73 -1.715 3.741 11.783 1.00 3.66 C ATOM 1157 CZ PHE A 73 -1.456 2.364 11.739 1.00 4.68 C ATOM 0 H PHE A 73 -0.111 6.339 9.426 1.00 0.91 H new ATOM 0 HA PHE A 73 0.712 4.512 7.684 1.00 0.89 H new ATOM 0 HB2 PHE A 73 -2.121 5.508 8.204 1.00 1.22 H new ATOM 0 HB3 PHE A 73 -1.789 4.045 7.297 1.00 1.22 H new ATOM 0 HD1 PHE A 73 -0.922 2.034 8.390 1.00 2.91 H new ATOM 0 HD2 PHE A 73 -1.795 5.585 10.659 1.00 2.30 H new ATOM 0 HE1 PHE A 73 -0.953 0.691 10.477 1.00 4.54 H new ATOM 0 HE2 PHE A 73 -1.972 4.209 12.722 1.00 3.66 H new ATOM 0 HZ PHE A 73 -1.485 1.778 12.646 1.00 4.68 H new ATOM 1167 N ASN A 74 -0.905 6.808 5.910 1.00 0.85 N ATOM 1168 CA ASN A 74 -1.093 7.300 4.548 1.00 0.88 C ATOM 1169 C ASN A 74 0.234 7.659 3.884 1.00 0.73 C ATOM 1170 O ASN A 74 0.428 7.376 2.705 1.00 0.77 O ATOM 1171 CB ASN A 74 -2.009 8.522 4.544 1.00 1.18 C ATOM 1172 CG ASN A 74 -2.038 9.197 3.172 1.00 2.70 C ATOM 1173 OD1 ASN A 74 -1.583 10.325 3.029 1.00 3.43 O ATOM 1174 ND2 ASN A 74 -2.598 8.533 2.168 1.00 4.04 N ATOM 0 H ASN A 74 -1.380 7.360 6.625 1.00 0.85 H new ATOM 0 HA ASN A 74 -1.553 6.494 3.976 1.00 0.88 H new ATOM 0 HB2 ASN A 74 -3.019 8.222 4.824 1.00 1.18 H new ATOM 0 HB3 ASN A 74 -1.669 9.235 5.294 1.00 1.18 H new ATOM 0 HD21 ASN A 74 -2.659 8.961 1.244 1.00 4.04 H new ATOM 0 HD22 ASN A 74 -2.968 7.595 2.320 1.00 4.04 H new ATOM 1181 N GLU A 75 1.129 8.311 4.629 1.00 0.66 N ATOM 1182 CA GLU A 75 2.369 8.808 4.067 1.00 0.63 C ATOM 1183 C GLU A 75 3.315 7.638 3.824 1.00 0.50 C ATOM 1184 O GLU A 75 3.909 7.540 2.752 1.00 0.57 O ATOM 1185 CB GLU A 75 2.969 9.895 4.972 1.00 0.76 C ATOM 1186 CG GLU A 75 3.870 10.843 4.167 1.00 2.06 C ATOM 1187 CD GLU A 75 3.043 11.691 3.210 1.00 3.12 C ATOM 1188 OE1 GLU A 75 2.418 12.661 3.687 1.00 3.22 O ATOM 1189 OE2 GLU A 75 2.933 11.326 2.021 1.00 4.66 O ATOM 0 H GLU A 75 1.010 8.503 5.624 1.00 0.66 H new ATOM 0 HA GLU A 75 2.186 9.283 3.103 1.00 0.63 H new ATOM 0 HB2 GLU A 75 2.168 10.463 5.445 1.00 0.76 H new ATOM 0 HB3 GLU A 75 3.546 9.430 5.772 1.00 0.76 H new ATOM 0 HG2 GLU A 75 4.425 11.490 4.847 1.00 2.06 H new ATOM 0 HG3 GLU A 75 4.605 10.265 3.606 1.00 2.06 H new ATOM 1196 N TYR A 76 3.397 6.709 4.790 1.00 0.45 N ATOM 1197 CA TYR A 76 4.004 5.401 4.556 1.00 0.44 C ATOM 1198 C TYR A 76 3.487 4.867 3.225 1.00 0.40 C ATOM 1199 O TYR A 76 4.267 4.485 2.355 1.00 0.40 O ATOM 1200 CB TYR A 76 3.666 4.423 5.696 1.00 0.54 C ATOM 1201 CG TYR A 76 4.034 2.973 5.420 1.00 0.71 C ATOM 1202 CD1 TYR A 76 3.167 2.153 4.669 1.00 2.23 C ATOM 1203 CD2 TYR A 76 5.198 2.416 5.978 1.00 1.80 C ATOM 1204 CE1 TYR A 76 3.514 0.821 4.392 1.00 2.36 C ATOM 1205 CE2 TYR A 76 5.508 1.064 5.757 1.00 1.90 C ATOM 1206 CZ TYR A 76 4.681 0.273 4.945 1.00 1.22 C ATOM 1207 OH TYR A 76 5.013 -1.023 4.689 1.00 1.53 O ATOM 0 H TYR A 76 3.049 6.845 5.739 1.00 0.45 H new ATOM 0 HA TYR A 76 5.089 5.501 4.525 1.00 0.44 H new ATOM 0 HB2 TYR A 76 4.181 4.748 6.600 1.00 0.54 H new ATOM 0 HB3 TYR A 76 2.597 4.480 5.900 1.00 0.54 H new ATOM 0 HD1 TYR A 76 2.231 2.551 4.305 1.00 2.23 H new ATOM 0 HD2 TYR A 76 5.855 3.029 6.578 1.00 1.80 H new ATOM 0 HE1 TYR A 76 2.883 0.219 3.754 1.00 2.36 H new ATOM 0 HE2 TYR A 76 6.386 0.632 6.214 1.00 1.90 H new ATOM 0 HH TYR A 76 4.675 -1.279 3.805 1.00 1.53 H new ATOM 1217 N TRP A 77 2.159 4.866 3.079 1.00 0.42 N ATOM 1218 CA TRP A 77 1.514 4.385 1.884 1.00 0.45 C ATOM 1219 C TRP A 77 2.060 5.069 0.642 1.00 0.46 C ATOM 1220 O TRP A 77 2.775 4.421 -0.114 1.00 0.49 O ATOM 1221 CB TRP A 77 0.000 4.512 1.997 1.00 0.47 C ATOM 1222 CG TRP A 77 -0.647 3.248 1.633 1.00 0.45 C ATOM 1223 CD1 TRP A 77 -0.943 2.907 0.374 1.00 0.45 C ATOM 1224 CD2 TRP A 77 -1.112 2.170 2.482 1.00 0.44 C ATOM 1225 NE1 TRP A 77 -1.549 1.684 0.365 1.00 0.44 N ATOM 1226 CE2 TRP A 77 -1.750 1.217 1.643 1.00 0.44 C ATOM 1227 CE3 TRP A 77 -1.146 1.942 3.871 1.00 0.46 C ATOM 1228 CZ2 TRP A 77 -2.436 0.120 2.157 1.00 0.45 C ATOM 1229 CZ3 TRP A 77 -1.848 0.838 4.383 1.00 0.46 C ATOM 1230 CH2 TRP A 77 -2.462 -0.081 3.537 1.00 0.46 C ATOM 0 H TRP A 77 1.513 5.201 3.794 1.00 0.42 H new ATOM 0 HA TRP A 77 1.742 3.324 1.779 1.00 0.45 H new ATOM 0 HB2 TRP A 77 -0.273 4.788 3.016 1.00 0.47 H new ATOM 0 HB3 TRP A 77 -0.354 5.310 1.345 1.00 0.47 H new ATOM 0 HD1 TRP A 77 -0.735 3.506 -0.500 1.00 0.45 H new ATOM 0 HE1 TRP A 77 -1.818 1.181 -0.481 1.00 0.44 H new ATOM 0 HE3 TRP A 77 -0.633 2.615 4.542 1.00 0.46 H new ATOM 0 HZ2 TRP A 77 -2.942 -0.567 1.495 1.00 0.45 H new ATOM 0 HZ3 TRP A 77 -1.912 0.700 5.452 1.00 0.46 H new ATOM 0 HH2 TRP A 77 -2.958 -0.948 3.948 1.00 0.46 H new ATOM 1241 N ARG A 78 1.745 6.352 0.429 1.00 0.49 N ATOM 1242 CA ARG A 78 2.270 7.121 -0.688 1.00 0.58 C ATOM 1243 C ARG A 78 3.744 6.772 -0.950 1.00 0.49 C ATOM 1244 O ARG A 78 4.076 6.357 -2.053 1.00 0.49 O ATOM 1245 CB ARG A 78 2.099 8.633 -0.427 1.00 0.80 C ATOM 1246 CG ARG A 78 0.619 9.033 -0.322 1.00 1.48 C ATOM 1247 CD ARG A 78 0.341 10.531 -0.519 1.00 1.89 C ATOM 1248 NE ARG A 78 0.590 11.328 0.701 1.00 2.30 N ATOM 1249 CZ ARG A 78 -0.223 12.259 1.242 1.00 3.36 C ATOM 1250 NH1 ARG A 78 -1.454 12.485 0.756 1.00 4.22 N ATOM 1251 NH2 ARG A 78 0.198 12.994 2.275 1.00 4.12 N ATOM 0 H ARG A 78 1.116 6.881 1.033 1.00 0.49 H new ATOM 0 HA ARG A 78 1.702 6.861 -1.581 1.00 0.58 H new ATOM 0 HB2 ARG A 78 2.614 8.903 0.495 1.00 0.80 H new ATOM 0 HB3 ARG A 78 2.571 9.196 -1.232 1.00 0.80 H new ATOM 0 HG2 ARG A 78 0.052 8.472 -1.065 1.00 1.48 H new ATOM 0 HG3 ARG A 78 0.245 8.734 0.657 1.00 1.48 H new ATOM 0 HD2 ARG A 78 0.967 10.908 -1.327 1.00 1.89 H new ATOM 0 HD3 ARG A 78 -0.695 10.665 -0.829 1.00 1.89 H new ATOM 0 HE ARG A 78 1.471 11.156 1.186 1.00 2.30 H new ATOM 0 HH11 ARG A 78 -1.794 11.947 -0.041 1.00 4.22 H new ATOM 0 HH12 ARG A 78 -2.049 13.195 1.184 1.00 4.22 H new ATOM 0 HH21 ARG A 78 1.134 12.851 2.655 1.00 4.12 H new ATOM 0 HH22 ARG A 78 -0.416 13.698 2.684 1.00 4.12 H new ATOM 1265 N LEU A 79 4.618 6.851 0.060 1.00 0.49 N ATOM 1266 CA LEU A 79 6.042 6.558 -0.095 1.00 0.47 C ATOM 1267 C LEU A 79 6.316 5.148 -0.652 1.00 0.45 C ATOM 1268 O LEU A 79 7.078 5.019 -1.612 1.00 0.50 O ATOM 1269 CB LEU A 79 6.789 6.811 1.226 1.00 0.52 C ATOM 1270 CG LEU A 79 7.139 8.294 1.504 1.00 0.58 C ATOM 1271 CD1 LEU A 79 6.158 9.338 0.944 1.00 0.76 C ATOM 1272 CD2 LEU A 79 7.274 8.540 3.012 1.00 0.79 C ATOM 0 H LEU A 79 4.355 7.120 1.008 1.00 0.49 H new ATOM 0 HA LEU A 79 6.430 7.245 -0.848 1.00 0.47 H new ATOM 0 HB2 LEU A 79 6.180 6.436 2.048 1.00 0.52 H new ATOM 0 HB3 LEU A 79 7.711 6.230 1.222 1.00 0.52 H new ATOM 0 HG LEU A 79 8.079 8.437 0.971 1.00 0.58 H new ATOM 0 HD11 LEU A 79 6.506 10.339 1.200 1.00 0.76 H new ATOM 0 HD12 LEU A 79 6.102 9.240 -0.140 1.00 0.76 H new ATOM 0 HD13 LEU A 79 5.170 9.176 1.374 1.00 0.76 H new ATOM 0 HD21 LEU A 79 7.520 9.587 3.189 1.00 0.79 H new ATOM 0 HD22 LEU A 79 6.332 8.300 3.506 1.00 0.79 H new ATOM 0 HD23 LEU A 79 8.066 7.908 3.414 1.00 0.79 H new ATOM 1284 N ILE A 80 5.750 4.081 -0.070 1.00 0.43 N ATOM 1285 CA ILE A 80 5.995 2.734 -0.603 1.00 0.42 C ATOM 1286 C ILE A 80 5.320 2.553 -1.972 1.00 0.40 C ATOM 1287 O ILE A 80 5.810 1.827 -2.834 1.00 0.43 O ATOM 1288 CB ILE A 80 5.689 1.612 0.411 1.00 0.46 C ATOM 1289 CG1 ILE A 80 4.204 1.398 0.735 1.00 0.76 C ATOM 1290 CG2 ILE A 80 6.406 1.866 1.726 1.00 0.60 C ATOM 1291 CD1 ILE A 80 3.863 -0.100 0.739 1.00 0.50 C ATOM 0 H ILE A 80 5.138 4.120 0.745 1.00 0.43 H new ATOM 0 HA ILE A 80 7.067 2.638 -0.775 1.00 0.42 H new ATOM 0 HB ILE A 80 6.044 0.711 -0.090 1.00 0.46 H new ATOM 0 HG12 ILE A 80 3.972 1.832 1.708 1.00 0.76 H new ATOM 0 HG13 ILE A 80 3.587 1.915 -0.000 1.00 0.76 H new ATOM 0 HG21 ILE A 80 6.176 1.063 2.427 1.00 0.60 H new ATOM 0 HG22 ILE A 80 7.482 1.900 1.553 1.00 0.60 H new ATOM 0 HG23 ILE A 80 6.075 2.817 2.143 1.00 0.60 H new ATOM 0 HD11 ILE A 80 2.806 -0.232 0.971 1.00 0.50 H new ATOM 0 HD12 ILE A 80 4.075 -0.524 -0.242 1.00 0.50 H new ATOM 0 HD13 ILE A 80 4.466 -0.608 1.492 1.00 0.50 H new ATOM 1303 N GLY A 81 4.219 3.266 -2.194 1.00 0.40 N ATOM 1304 CA GLY A 81 3.603 3.455 -3.496 1.00 0.42 C ATOM 1305 C GLY A 81 4.576 3.999 -4.528 1.00 0.46 C ATOM 1306 O GLY A 81 4.703 3.425 -5.611 1.00 0.55 O ATOM 0 H GLY A 81 3.717 3.742 -1.444 1.00 0.40 H new ATOM 0 HA2 GLY A 81 3.202 2.504 -3.846 1.00 0.42 H new ATOM 0 HA3 GLY A 81 2.761 4.140 -3.400 1.00 0.42 H new ATOM 1310 N GLU A 82 5.281 5.087 -4.207 1.00 0.46 N ATOM 1311 CA GLU A 82 6.347 5.545 -5.073 1.00 0.49 C ATOM 1312 C GLU A 82 7.346 4.395 -5.241 1.00 0.53 C ATOM 1313 O GLU A 82 7.653 4.005 -6.365 1.00 0.67 O ATOM 1314 CB GLU A 82 7.016 6.834 -4.577 1.00 0.50 C ATOM 1315 CG GLU A 82 6.098 8.000 -4.164 1.00 0.76 C ATOM 1316 CD GLU A 82 4.946 8.308 -5.112 1.00 2.18 C ATOM 1317 OE1 GLU A 82 5.154 9.045 -6.107 1.00 3.19 O ATOM 1318 OE2 GLU A 82 3.815 7.859 -4.823 1.00 3.44 O ATOM 0 H GLU A 82 5.131 5.650 -3.370 1.00 0.46 H new ATOM 0 HA GLU A 82 5.927 5.816 -6.042 1.00 0.49 H new ATOM 0 HB2 GLU A 82 7.642 6.580 -3.722 1.00 0.50 H new ATOM 0 HB3 GLU A 82 7.681 7.192 -5.363 1.00 0.50 H new ATOM 0 HG2 GLU A 82 5.684 7.780 -3.180 1.00 0.76 H new ATOM 0 HG3 GLU A 82 6.708 8.898 -4.060 1.00 0.76 H new ATOM 1325 N LEU A 83 7.784 3.777 -4.138 1.00 0.48 N ATOM 1326 CA LEU A 83 8.755 2.695 -4.209 1.00 0.53 C ATOM 1327 C LEU A 83 8.376 1.628 -5.249 1.00 0.52 C ATOM 1328 O LEU A 83 9.221 1.262 -6.068 1.00 0.56 O ATOM 1329 CB LEU A 83 9.024 2.107 -2.823 1.00 0.60 C ATOM 1330 CG LEU A 83 10.315 1.280 -2.759 1.00 1.09 C ATOM 1331 CD1 LEU A 83 11.580 2.131 -2.934 1.00 2.24 C ATOM 1332 CD2 LEU A 83 10.355 0.635 -1.378 1.00 1.80 C ATOM 0 H LEU A 83 7.479 4.011 -3.193 1.00 0.48 H new ATOM 0 HA LEU A 83 9.694 3.121 -4.563 1.00 0.53 H new ATOM 0 HB2 LEU A 83 9.083 2.917 -2.096 1.00 0.60 H new ATOM 0 HB3 LEU A 83 8.182 1.478 -2.532 1.00 0.60 H new ATOM 0 HG LEU A 83 10.305 0.554 -3.572 1.00 1.09 H new ATOM 0 HD11 LEU A 83 12.460 1.490 -2.879 1.00 2.24 H new ATOM 0 HD12 LEU A 83 11.553 2.628 -3.904 1.00 2.24 H new ATOM 0 HD13 LEU A 83 11.627 2.880 -2.143 1.00 2.24 H new ATOM 0 HD21 LEU A 83 11.259 0.033 -1.283 1.00 1.80 H new ATOM 0 HD22 LEU A 83 10.354 1.412 -0.613 1.00 1.80 H new ATOM 0 HD23 LEU A 83 9.480 -0.002 -1.249 1.00 1.80 H new ATOM 1344 N ALA A 84 7.116 1.161 -5.268 1.00 0.53 N ATOM 1345 CA ALA A 84 6.621 0.298 -6.337 1.00 0.62 C ATOM 1346 C ALA A 84 6.971 0.782 -7.761 1.00 0.64 C ATOM 1347 O ALA A 84 7.346 -0.040 -8.596 1.00 0.75 O ATOM 1348 CB ALA A 84 5.110 0.092 -6.183 1.00 0.66 C ATOM 0 H ALA A 84 6.424 1.372 -4.549 1.00 0.53 H new ATOM 0 HA ALA A 84 7.140 -0.654 -6.226 1.00 0.62 H new ATOM 0 HB1 ALA A 84 4.747 -0.553 -6.984 1.00 0.66 H new ATOM 0 HB2 ALA A 84 4.903 -0.374 -5.220 1.00 0.66 H new ATOM 0 HB3 ALA A 84 4.604 1.056 -6.236 1.00 0.66 H new ATOM 1354 N LYS A 85 6.835 2.080 -8.075 1.00 0.64 N ATOM 1355 CA LYS A 85 7.189 2.602 -9.400 1.00 0.76 C ATOM 1356 C LYS A 85 8.693 2.839 -9.571 1.00 0.75 C ATOM 1357 O LYS A 85 9.178 2.697 -10.694 1.00 0.94 O ATOM 1358 CB LYS A 85 6.366 3.836 -9.819 1.00 1.12 C ATOM 1359 CG LYS A 85 6.503 5.003 -8.849 1.00 1.40 C ATOM 1360 CD LYS A 85 6.087 6.355 -9.441 1.00 1.50 C ATOM 1361 CE LYS A 85 5.939 7.295 -8.241 1.00 2.93 C ATOM 1362 NZ LYS A 85 5.866 8.726 -8.576 1.00 3.37 N ATOM 0 H LYS A 85 6.482 2.785 -7.428 1.00 0.64 H new ATOM 0 HA LYS A 85 6.914 1.805 -10.091 1.00 0.76 H new ATOM 0 HB2 LYS A 85 6.683 4.157 -10.811 1.00 1.12 H new ATOM 0 HB3 LYS A 85 5.315 3.556 -9.895 1.00 1.12 H new ATOM 0 HG2 LYS A 85 5.896 4.802 -7.966 1.00 1.40 H new ATOM 0 HG3 LYS A 85 7.539 5.066 -8.516 1.00 1.40 H new ATOM 0 HD2 LYS A 85 6.837 6.725 -10.140 1.00 1.50 H new ATOM 0 HD3 LYS A 85 5.151 6.271 -9.993 1.00 1.50 H new ATOM 0 HE2 LYS A 85 5.039 7.020 -7.692 1.00 2.93 H new ATOM 0 HE3 LYS A 85 6.783 7.137 -7.569 1.00 2.93 H new ATOM 0 HZ1 LYS A 85 5.632 9.271 -7.722 1.00 3.37 H new ATOM 0 HZ2 LYS A 85 6.784 9.043 -8.948 1.00 3.37 H new ATOM 0 HZ3 LYS A 85 5.130 8.877 -9.295 1.00 3.37 H new ATOM 1376 N GLU A 86 9.422 3.201 -8.511 1.00 0.63 N ATOM 1377 CA GLU A 86 10.884 3.217 -8.522 1.00 0.64 C ATOM 1378 C GLU A 86 11.396 1.826 -8.937 1.00 0.67 C ATOM 1379 O GLU A 86 11.876 1.636 -10.055 1.00 0.74 O ATOM 1380 CB GLU A 86 11.407 3.597 -7.126 1.00 0.64 C ATOM 1381 CG GLU A 86 11.521 5.107 -6.866 1.00 0.87 C ATOM 1382 CD GLU A 86 10.251 5.708 -6.291 1.00 1.86 C ATOM 1383 OE1 GLU A 86 9.376 6.083 -7.094 1.00 3.61 O ATOM 1384 OE2 GLU A 86 10.181 5.803 -5.044 1.00 1.92 O ATOM 0 H GLU A 86 9.013 3.491 -7.622 1.00 0.63 H new ATOM 0 HA GLU A 86 11.246 3.956 -9.236 1.00 0.64 H new ATOM 0 HB2 GLU A 86 10.746 3.163 -6.376 1.00 0.64 H new ATOM 0 HB3 GLU A 86 12.389 3.144 -6.986 1.00 0.64 H new ATOM 0 HG2 GLU A 86 12.347 5.290 -6.178 1.00 0.87 H new ATOM 0 HG3 GLU A 86 11.765 5.613 -7.800 1.00 0.87 H new ATOM 1391 N ILE A 87 11.301 0.839 -8.044 1.00 0.65 N ATOM 1392 CA ILE A 87 11.952 -0.450 -8.209 1.00 0.78 C ATOM 1393 C ILE A 87 11.111 -1.341 -9.127 1.00 0.81 C ATOM 1394 O ILE A 87 10.196 -2.053 -8.711 1.00 0.81 O ATOM 1395 CB ILE A 87 12.301 -1.060 -6.838 1.00 0.94 C ATOM 1396 CG1 ILE A 87 13.462 -2.069 -6.916 1.00 1.41 C ATOM 1397 CG2 ILE A 87 11.113 -1.643 -6.065 1.00 1.04 C ATOM 1398 CD1 ILE A 87 13.316 -3.173 -7.970 1.00 1.16 C ATOM 0 H ILE A 87 10.764 0.919 -7.180 1.00 0.65 H new ATOM 0 HA ILE A 87 12.912 -0.337 -8.712 1.00 0.78 H new ATOM 0 HB ILE A 87 12.633 -0.202 -6.253 1.00 0.94 H new ATOM 0 HG12 ILE A 87 14.382 -1.521 -7.117 1.00 1.41 H new ATOM 0 HG13 ILE A 87 13.577 -2.538 -5.939 1.00 1.41 H new ATOM 0 HG21 ILE A 87 11.461 -2.048 -5.115 1.00 1.04 H new ATOM 0 HG22 ILE A 87 10.380 -0.858 -5.879 1.00 1.04 H new ATOM 0 HG23 ILE A 87 10.652 -2.438 -6.651 1.00 1.04 H new ATOM 0 HD11 ILE A 87 14.189 -3.825 -7.937 1.00 1.16 H new ATOM 0 HD12 ILE A 87 12.419 -3.757 -7.764 1.00 1.16 H new ATOM 0 HD13 ILE A 87 13.237 -2.723 -8.960 1.00 1.16 H new ATOM 1410 N ARG A 88 11.467 -1.335 -10.411 1.00 1.01 N ATOM 1411 CA ARG A 88 10.705 -2.033 -11.430 1.00 1.19 C ATOM 1412 C ARG A 88 11.087 -3.515 -11.398 1.00 1.24 C ATOM 1413 O ARG A 88 11.910 -3.981 -12.184 1.00 1.52 O ATOM 1414 CB ARG A 88 10.946 -1.359 -12.794 1.00 1.46 C ATOM 1415 CG ARG A 88 9.708 -1.467 -13.701 1.00 1.93 C ATOM 1416 CD ARG A 88 9.775 -0.506 -14.904 1.00 1.91 C ATOM 1417 NE ARG A 88 8.622 0.415 -14.952 1.00 2.31 N ATOM 1418 CZ ARG A 88 8.387 1.418 -14.085 1.00 3.36 C ATOM 1419 NH1 ARG A 88 9.275 1.667 -13.123 1.00 4.36 N ATOM 1420 NH2 ARG A 88 7.277 2.156 -14.180 1.00 4.53 N ATOM 0 H ARG A 88 12.289 -0.847 -10.767 1.00 1.01 H new ATOM 0 HA ARG A 88 9.633 -1.976 -11.243 1.00 1.19 H new ATOM 0 HB2 ARG A 88 11.198 -0.309 -12.643 1.00 1.46 H new ATOM 0 HB3 ARG A 88 11.800 -1.824 -13.285 1.00 1.46 H new ATOM 0 HG2 ARG A 88 9.614 -2.491 -14.062 1.00 1.93 H new ATOM 0 HG3 ARG A 88 8.813 -1.252 -13.117 1.00 1.93 H new ATOM 0 HD2 ARG A 88 10.697 0.073 -14.853 1.00 1.91 H new ATOM 0 HD3 ARG A 88 9.813 -1.085 -15.827 1.00 1.91 H new ATOM 0 HE ARG A 88 7.947 0.280 -15.705 1.00 2.31 H new ATOM 0 HH11 ARG A 88 10.120 1.101 -13.050 1.00 4.36 H new ATOM 0 HH12 ARG A 88 9.109 2.424 -12.460 1.00 4.36 H new ATOM 0 HH21 ARG A 88 6.597 1.962 -14.915 1.00 4.53 H new ATOM 0 HH22 ARG A 88 7.110 2.913 -13.517 1.00 4.53 H new ATOM 1434 N LYS A 89 10.489 -4.233 -10.441 1.00 1.15 N ATOM 1435 CA LYS A 89 10.550 -5.683 -10.309 1.00 1.16 C ATOM 1436 C LYS A 89 10.404 -6.368 -11.674 1.00 1.52 C ATOM 1437 O LYS A 89 9.622 -5.934 -12.518 1.00 2.07 O ATOM 1438 CB LYS A 89 9.397 -6.165 -9.417 1.00 1.23 C ATOM 1439 CG LYS A 89 9.437 -5.729 -7.943 1.00 1.20 C ATOM 1440 CD LYS A 89 7.994 -5.666 -7.411 1.00 1.41 C ATOM 1441 CE LYS A 89 7.851 -6.023 -5.927 1.00 2.09 C ATOM 1442 NZ LYS A 89 8.724 -5.237 -5.036 1.00 2.73 N ATOM 0 H LYS A 89 9.927 -3.797 -9.710 1.00 1.15 H new ATOM 0 HA LYS A 89 11.516 -5.938 -9.874 1.00 1.16 H new ATOM 0 HB2 LYS A 89 8.461 -5.813 -9.851 1.00 1.23 H new ATOM 0 HB3 LYS A 89 9.374 -7.254 -9.449 1.00 1.23 H new ATOM 0 HG2 LYS A 89 10.026 -6.433 -7.356 1.00 1.20 H new ATOM 0 HG3 LYS A 89 9.918 -4.755 -7.849 1.00 1.20 H new ATOM 0 HD2 LYS A 89 7.605 -4.660 -7.570 1.00 1.41 H new ATOM 0 HD3 LYS A 89 7.374 -6.344 -7.997 1.00 1.41 H new ATOM 0 HE2 LYS A 89 6.814 -5.875 -5.626 1.00 2.09 H new ATOM 0 HE3 LYS A 89 8.073 -7.082 -5.795 1.00 2.09 H new ATOM 0 HZ1 LYS A 89 8.203 -4.987 -4.171 1.00 2.73 H new ATOM 0 HZ2 LYS A 89 9.561 -5.801 -4.785 1.00 2.73 H new ATOM 0 HZ3 LYS A 89 9.025 -4.368 -5.522 1.00 2.73 H new ATOM 1456 N LYS A 90 11.109 -7.489 -11.855 1.00 1.91 N ATOM 1457 CA LYS A 90 10.733 -8.465 -12.866 1.00 2.33 C ATOM 1458 C LYS A 90 9.439 -9.157 -12.415 1.00 2.19 C ATOM 1459 O LYS A 90 8.924 -8.889 -11.333 1.00 3.73 O ATOM 1460 CB LYS A 90 11.874 -9.482 -13.034 1.00 3.31 C ATOM 1461 CG LYS A 90 13.135 -8.837 -13.625 1.00 4.21 C ATOM 1462 CD LYS A 90 14.247 -9.894 -13.721 1.00 5.45 C ATOM 1463 CE LYS A 90 15.534 -9.354 -14.362 1.00 6.51 C ATOM 1464 NZ LYS A 90 15.372 -9.058 -15.801 1.00 6.67 N ATOM 0 H LYS A 90 11.938 -7.737 -11.315 1.00 1.91 H new ATOM 0 HA LYS A 90 10.561 -7.982 -13.828 1.00 2.33 H new ATOM 0 HB2 LYS A 90 12.112 -9.923 -12.066 1.00 3.31 H new ATOM 0 HB3 LYS A 90 11.544 -10.294 -13.682 1.00 3.31 H new ATOM 0 HG2 LYS A 90 12.920 -8.428 -14.612 1.00 4.21 H new ATOM 0 HG3 LYS A 90 13.460 -8.006 -12.999 1.00 4.21 H new ATOM 0 HD2 LYS A 90 14.474 -10.267 -12.722 1.00 5.45 H new ATOM 0 HD3 LYS A 90 13.886 -10.742 -14.303 1.00 5.45 H new ATOM 0 HE2 LYS A 90 15.842 -8.448 -13.841 1.00 6.51 H new ATOM 0 HE3 LYS A 90 16.334 -10.083 -14.233 1.00 6.51 H new ATOM 0 HZ1 LYS A 90 16.269 -8.697 -16.184 1.00 6.67 H new ATOM 0 HZ2 LYS A 90 15.104 -9.927 -16.306 1.00 6.67 H new ATOM 0 HZ3 LYS A 90 14.629 -8.342 -15.927 1.00 6.67 H new ATOM 1478 N LYS A 91 8.951 -10.106 -13.217 1.00 1.66 N ATOM 1479 CA LYS A 91 7.886 -11.010 -12.792 1.00 2.11 C ATOM 1480 C LYS A 91 8.253 -11.713 -11.477 1.00 2.13 C ATOM 1481 O LYS A 91 7.380 -11.944 -10.645 1.00 2.66 O ATOM 1482 CB LYS A 91 7.648 -12.070 -13.876 1.00 2.81 C ATOM 1483 CG LYS A 91 7.161 -11.488 -15.210 1.00 3.18 C ATOM 1484 CD LYS A 91 6.965 -12.638 -16.209 1.00 3.86 C ATOM 1485 CE LYS A 91 6.505 -12.115 -17.577 1.00 4.67 C ATOM 1486 NZ LYS A 91 6.324 -13.211 -18.554 1.00 5.76 N ATOM 0 H LYS A 91 9.280 -10.267 -14.169 1.00 1.66 H new ATOM 0 HA LYS A 91 6.982 -10.422 -12.635 1.00 2.11 H new ATOM 0 HB2 LYS A 91 8.575 -12.618 -14.045 1.00 2.81 H new ATOM 0 HB3 LYS A 91 6.914 -12.789 -13.514 1.00 2.81 H new ATOM 0 HG2 LYS A 91 6.225 -10.948 -15.067 1.00 3.18 H new ATOM 0 HG3 LYS A 91 7.886 -10.772 -15.596 1.00 3.18 H new ATOM 0 HD2 LYS A 91 7.900 -13.187 -16.323 1.00 3.86 H new ATOM 0 HD3 LYS A 91 6.228 -13.340 -15.819 1.00 3.86 H new ATOM 0 HE2 LYS A 91 5.566 -11.573 -17.462 1.00 4.67 H new ATOM 0 HE3 LYS A 91 7.238 -11.405 -17.960 1.00 4.67 H new ATOM 0 HZ1 LYS A 91 6.013 -12.816 -19.465 1.00 5.76 H new ATOM 0 HZ2 LYS A 91 7.226 -13.713 -18.684 1.00 5.76 H new ATOM 0 HZ3 LYS A 91 5.606 -13.875 -18.201 1.00 5.76 H new ATOM 1500 N ASP A 92 9.546 -12.035 -11.336 1.00 1.89 N ATOM 1501 CA ASP A 92 10.183 -12.995 -10.450 1.00 2.26 C ATOM 1502 C ASP A 92 10.984 -12.214 -9.428 1.00 1.78 C ATOM 1503 O ASP A 92 12.172 -11.982 -9.630 1.00 2.16 O ATOM 1504 CB ASP A 92 9.250 -14.061 -9.843 1.00 3.06 C ATOM 1505 CG ASP A 92 8.731 -15.059 -10.877 1.00 4.02 C ATOM 1506 OD1 ASP A 92 8.719 -14.713 -12.080 1.00 4.15 O ATOM 1507 OD2 ASP A 92 8.372 -16.171 -10.438 1.00 5.37 O ATOM 0 H ASP A 92 10.245 -11.568 -11.913 1.00 1.89 H new ATOM 0 HA ASP A 92 10.849 -13.621 -11.043 1.00 2.26 H new ATOM 0 HB2 ASP A 92 9.784 -14.601 -9.061 1.00 3.06 H new ATOM 0 HB3 ASP A 92 8.403 -13.566 -9.367 1.00 3.06 H new ATOM 1512 N LEU A 93 10.329 -11.761 -8.360 1.00 1.47 N ATOM 1513 CA LEU A 93 11.022 -11.076 -7.280 1.00 1.22 C ATOM 1514 C LEU A 93 11.695 -12.091 -6.347 1.00 1.22 C ATOM 1515 O LEU A 93 12.921 -12.133 -6.249 1.00 1.36 O ATOM 1516 CB LEU A 93 10.133 -10.053 -6.535 1.00 1.59 C ATOM 1517 CG LEU A 93 8.593 -10.177 -6.523 1.00 1.53 C ATOM 1518 CD1 LEU A 93 7.925 -9.741 -7.835 1.00 2.92 C ATOM 1519 CD2 LEU A 93 8.044 -11.527 -6.048 1.00 2.93 C ATOM 0 H LEU A 93 9.323 -11.857 -8.223 1.00 1.47 H new ATOM 0 HA LEU A 93 11.810 -10.470 -7.727 1.00 1.22 H new ATOM 0 HB2 LEU A 93 10.458 -10.050 -5.495 1.00 1.59 H new ATOM 0 HB3 LEU A 93 10.368 -9.071 -6.946 1.00 1.59 H new ATOM 0 HG LEU A 93 8.310 -9.458 -5.754 1.00 1.53 H new ATOM 0 HD11 LEU A 93 6.845 -9.857 -7.749 1.00 2.92 H new ATOM 0 HD12 LEU A 93 8.163 -8.696 -8.035 1.00 2.92 H new ATOM 0 HD13 LEU A 93 8.292 -10.360 -8.654 1.00 2.92 H new ATOM 0 HD21 LEU A 93 6.955 -11.508 -6.078 1.00 2.93 H new ATOM 0 HD22 LEU A 93 8.411 -12.319 -6.701 1.00 2.93 H new ATOM 0 HD23 LEU A 93 8.375 -11.716 -5.027 1.00 2.93 H new ATOM 1531 N LYS A 94 10.911 -12.968 -5.711 1.00 1.26 N ATOM 1532 CA LYS A 94 11.422 -13.929 -4.737 1.00 1.32 C ATOM 1533 C LYS A 94 12.362 -14.954 -5.375 1.00 1.31 C ATOM 1534 O LYS A 94 13.180 -15.551 -4.680 1.00 1.45 O ATOM 1535 CB LYS A 94 10.271 -14.570 -3.941 1.00 1.49 C ATOM 1536 CG LYS A 94 9.842 -13.613 -2.824 1.00 2.01 C ATOM 1537 CD LYS A 94 8.578 -14.062 -2.071 1.00 2.04 C ATOM 1538 CE LYS A 94 7.325 -13.526 -2.772 1.00 2.12 C ATOM 1539 NZ LYS A 94 6.131 -13.523 -1.903 1.00 2.52 N ATOM 0 H LYS A 94 9.904 -13.029 -5.860 1.00 1.26 H new ATOM 0 HA LYS A 94 12.035 -13.386 -4.018 1.00 1.32 H new ATOM 0 HB2 LYS A 94 9.429 -14.780 -4.600 1.00 1.49 H new ATOM 0 HB3 LYS A 94 10.591 -15.523 -3.518 1.00 1.49 H new ATOM 0 HG2 LYS A 94 10.661 -13.511 -2.112 1.00 2.01 H new ATOM 0 HG3 LYS A 94 9.667 -12.626 -3.252 1.00 2.01 H new ATOM 0 HD2 LYS A 94 8.540 -15.150 -2.026 1.00 2.04 H new ATOM 0 HD3 LYS A 94 8.611 -13.701 -1.043 1.00 2.04 H new ATOM 0 HE2 LYS A 94 7.517 -12.511 -3.119 1.00 2.12 H new ATOM 0 HE3 LYS A 94 7.123 -14.132 -3.655 1.00 2.12 H new ATOM 0 HZ1 LYS A 94 5.289 -13.297 -2.470 1.00 2.52 H new ATOM 0 HZ2 LYS A 94 6.015 -14.461 -1.470 1.00 2.52 H new ATOM 0 HZ3 LYS A 94 6.247 -12.809 -1.156 1.00 2.52 H new ATOM 1553 N ILE A 95 12.300 -15.125 -6.700 1.00 1.27 N ATOM 1554 CA ILE A 95 13.270 -15.931 -7.428 1.00 1.41 C ATOM 1555 C ILE A 95 14.711 -15.451 -7.205 1.00 1.49 C ATOM 1556 O ILE A 95 15.647 -16.204 -7.462 1.00 1.68 O ATOM 1557 CB ILE A 95 12.882 -15.994 -8.918 1.00 1.44 C ATOM 1558 CG1 ILE A 95 13.194 -17.379 -9.502 1.00 1.93 C ATOM 1559 CG2 ILE A 95 13.562 -14.884 -9.734 1.00 1.71 C ATOM 1560 CD1 ILE A 95 12.625 -17.509 -10.915 1.00 2.05 C ATOM 0 H ILE A 95 11.579 -14.709 -7.289 1.00 1.27 H new ATOM 0 HA ILE A 95 13.244 -16.946 -7.032 1.00 1.41 H new ATOM 0 HB ILE A 95 11.807 -15.828 -8.984 1.00 1.44 H new ATOM 0 HG12 ILE A 95 14.272 -17.536 -9.523 1.00 1.93 H new ATOM 0 HG13 ILE A 95 12.771 -18.153 -8.862 1.00 1.93 H new ATOM 0 HG21 ILE A 95 13.262 -14.964 -10.779 1.00 1.71 H new ATOM 0 HG22 ILE A 95 13.263 -13.911 -9.344 1.00 1.71 H new ATOM 0 HG23 ILE A 95 14.644 -14.988 -9.659 1.00 1.71 H new ATOM 0 HD11 ILE A 95 12.857 -18.498 -11.311 1.00 2.05 H new ATOM 0 HD12 ILE A 95 11.544 -17.374 -10.886 1.00 2.05 H new ATOM 0 HD13 ILE A 95 13.068 -16.748 -11.557 1.00 2.05 H new ATOM 1572 N ARG A 96 14.906 -14.202 -6.753 1.00 1.42 N ATOM 1573 CA ARG A 96 16.165 -13.693 -6.217 1.00 1.58 C ATOM 1574 C ARG A 96 17.106 -13.272 -7.349 1.00 1.74 C ATOM 1575 O ARG A 96 17.563 -12.131 -7.398 1.00 2.12 O ATOM 1576 CB ARG A 96 16.805 -14.729 -5.265 1.00 2.03 C ATOM 1577 CG ARG A 96 17.763 -14.254 -4.156 1.00 2.13 C ATOM 1578 CD ARG A 96 18.625 -13.024 -4.468 1.00 2.72 C ATOM 1579 NE ARG A 96 17.792 -11.822 -4.390 1.00 3.21 N ATOM 1580 CZ ARG A 96 18.133 -10.545 -4.578 1.00 4.37 C ATOM 1581 NH1 ARG A 96 19.391 -10.187 -4.848 1.00 4.99 N ATOM 1582 NH2 ARG A 96 17.183 -9.629 -4.455 1.00 5.65 N ATOM 0 H ARG A 96 14.164 -13.502 -6.753 1.00 1.42 H new ATOM 0 HA ARG A 96 15.965 -12.798 -5.627 1.00 1.58 H new ATOM 0 HB2 ARG A 96 15.993 -15.274 -4.783 1.00 2.03 H new ATOM 0 HB3 ARG A 96 17.349 -15.445 -5.881 1.00 2.03 H new ATOM 0 HG2 ARG A 96 17.172 -14.038 -3.266 1.00 2.13 H new ATOM 0 HG3 ARG A 96 18.428 -15.080 -3.904 1.00 2.13 H new ATOM 0 HD2 ARG A 96 19.452 -12.955 -3.761 1.00 2.72 H new ATOM 0 HD3 ARG A 96 19.063 -13.114 -5.462 1.00 2.72 H new ATOM 0 HE ARG A 96 16.812 -11.983 -4.159 1.00 3.21 H new ATOM 0 HH11 ARG A 96 20.120 -10.897 -4.915 1.00 4.99 H new ATOM 0 HH12 ARG A 96 19.623 -9.203 -4.987 1.00 4.99 H new ATOM 0 HH21 ARG A 96 16.230 -9.910 -4.224 1.00 5.65 H new ATOM 0 HH22 ARG A 96 17.405 -8.643 -4.591 1.00 5.65 H new ATOM 1596 N LYS A 97 17.410 -14.207 -8.252 1.00 2.00 N ATOM 1597 CA LYS A 97 18.239 -13.996 -9.427 1.00 2.24 C ATOM 1598 C LYS A 97 17.739 -14.947 -10.516 1.00 2.58 C ATOM 1599 O LYS A 97 17.290 -14.508 -11.573 1.00 2.90 O ATOM 1600 CB LYS A 97 19.709 -14.251 -9.048 1.00 2.58 C ATOM 1601 CG LYS A 97 20.682 -13.943 -10.195 1.00 3.09 C ATOM 1602 CD LYS A 97 22.076 -14.537 -9.938 1.00 3.60 C ATOM 1603 CE LYS A 97 22.729 -13.983 -8.661 1.00 3.87 C ATOM 1604 NZ LYS A 97 24.089 -14.525 -8.453 1.00 4.84 N ATOM 0 H LYS A 97 17.070 -15.166 -8.176 1.00 2.00 H new ATOM 0 HA LYS A 97 18.176 -12.975 -9.802 1.00 2.24 H new ATOM 0 HB2 LYS A 97 19.968 -13.639 -8.184 1.00 2.58 H new ATOM 0 HB3 LYS A 97 19.827 -15.292 -8.748 1.00 2.58 H new ATOM 0 HG2 LYS A 97 20.283 -14.343 -11.127 1.00 3.09 H new ATOM 0 HG3 LYS A 97 20.765 -12.863 -10.321 1.00 3.09 H new ATOM 0 HD2 LYS A 97 21.996 -15.621 -9.860 1.00 3.60 H new ATOM 0 HD3 LYS A 97 22.720 -14.326 -10.792 1.00 3.60 H new ATOM 0 HE2 LYS A 97 22.778 -12.896 -8.721 1.00 3.87 H new ATOM 0 HE3 LYS A 97 22.106 -14.227 -7.800 1.00 3.87 H new ATOM 0 HZ1 LYS A 97 24.492 -14.126 -7.582 1.00 4.84 H new ATOM 0 HZ2 LYS A 97 24.041 -15.561 -8.369 1.00 4.84 H new ATOM 0 HZ3 LYS A 97 24.692 -14.271 -9.262 1.00 4.84 H new ATOM 1618 N LYS A 98 17.807 -16.246 -10.229 1.00 2.85 N ATOM 1619 CA LYS A 98 17.196 -17.357 -10.925 1.00 3.32 C ATOM 1620 C LYS A 98 17.441 -18.547 -9.991 1.00 3.62 C ATOM 1621 O LYS A 98 16.814 -19.603 -10.213 1.00 4.27 O ATOM 1622 CB LYS A 98 17.842 -17.594 -12.299 1.00 4.06 C ATOM 1623 CG LYS A 98 16.932 -18.465 -13.181 1.00 4.74 C ATOM 1624 CD LYS A 98 17.663 -19.250 -14.281 1.00 5.61 C ATOM 1625 CE LYS A 98 18.387 -18.375 -15.313 1.00 6.08 C ATOM 1626 NZ LYS A 98 19.644 -17.806 -14.788 1.00 6.27 N ATOM 1627 OXT LYS A 98 18.290 -18.363 -9.085 1.00 3.91 O ATOM 0 H LYS A 98 18.345 -16.568 -9.425 1.00 2.85 H new ATOM 0 HA LYS A 98 16.140 -17.186 -11.132 1.00 3.32 H new ATOM 0 HB2 LYS A 98 18.027 -16.638 -12.790 1.00 4.06 H new ATOM 0 HB3 LYS A 98 18.809 -18.080 -12.173 1.00 4.06 H new ATOM 0 HG2 LYS A 98 16.399 -19.170 -12.544 1.00 4.74 H new ATOM 0 HG3 LYS A 98 16.182 -17.826 -13.647 1.00 4.74 H new ATOM 0 HD2 LYS A 98 18.389 -19.915 -13.814 1.00 5.61 H new ATOM 0 HD3 LYS A 98 16.941 -19.881 -14.800 1.00 5.61 H new ATOM 0 HE2 LYS A 98 18.604 -18.969 -16.201 1.00 6.08 H new ATOM 0 HE3 LYS A 98 17.727 -17.565 -15.625 1.00 6.08 H new ATOM 0 HZ1 LYS A 98 20.342 -17.740 -15.556 1.00 6.27 H new ATOM 0 HZ2 LYS A 98 19.461 -16.857 -14.403 1.00 6.27 H new ATOM 0 HZ3 LYS A 98 20.015 -18.420 -14.035 1.00 6.27 H new TER 1641 LYS A 98 ATOM 1642 N MET B 1 9.699 -11.984 6.990 1.00 3.56 N ATOM 1643 CA MET B 1 9.337 -13.165 6.184 1.00 2.92 C ATOM 1644 C MET B 1 10.616 -13.995 6.073 1.00 3.35 C ATOM 1645 O MET B 1 11.248 -14.174 7.110 1.00 4.52 O ATOM 1646 CB MET B 1 8.224 -13.963 6.894 1.00 3.59 C ATOM 1647 CG MET B 1 6.986 -13.121 7.250 1.00 4.09 C ATOM 1648 SD MET B 1 6.313 -12.081 5.930 1.00 5.12 S ATOM 1649 CE MET B 1 5.603 -13.323 4.828 1.00 6.16 C ATOM 0 H1 MET B 1 8.870 -11.364 7.090 1.00 3.56 H new ATOM 0 H2 MET B 1 10.017 -12.291 7.931 1.00 3.56 H new ATOM 0 H3 MET B 1 10.466 -11.463 6.518 1.00 3.56 H new ATOM 0 HA MET B 1 8.957 -12.892 5.200 1.00 2.92 H new ATOM 0 HB2 MET B 1 7.917 -14.790 6.253 1.00 3.59 H new ATOM 0 HB3 MET B 1 8.629 -14.400 7.807 1.00 3.59 H new ATOM 0 HG2 MET B 1 6.199 -13.796 7.588 1.00 4.09 H new ATOM 0 HG3 MET B 1 7.240 -12.480 8.094 1.00 4.09 H new ATOM 0 HE1 MET B 1 5.360 -12.863 3.870 1.00 6.16 H new ATOM 0 HE2 MET B 1 6.323 -14.126 4.673 1.00 6.16 H new ATOM 0 HE3 MET B 1 4.696 -13.731 5.275 1.00 6.16 H new ATOM 1661 N ALA B 2 11.122 -14.351 4.889 1.00 3.17 N ATOM 1662 CA ALA B 2 10.505 -14.569 3.580 1.00 2.75 C ATOM 1663 C ALA B 2 11.534 -15.376 2.769 1.00 2.73 C ATOM 1664 O ALA B 2 12.589 -15.694 3.323 1.00 3.39 O ATOM 1665 CB ALA B 2 9.210 -15.379 3.699 1.00 3.22 C ATOM 0 H ALA B 2 12.126 -14.517 4.820 1.00 3.17 H new ATOM 0 HA ALA B 2 10.247 -13.619 3.112 1.00 2.75 H new ATOM 0 HB1 ALA B 2 8.778 -15.522 2.708 1.00 3.22 H new ATOM 0 HB2 ALA B 2 9.428 -16.350 4.144 1.00 3.22 H new ATOM 0 HB3 ALA B 2 8.501 -14.842 4.329 1.00 3.22 H new ATOM 1671 N ALA B 3 11.249 -15.749 1.510 1.00 2.45 N ATOM 1672 CA ALA B 3 12.226 -16.468 0.688 1.00 2.52 C ATOM 1673 C ALA B 3 12.353 -15.880 -0.725 1.00 2.06 C ATOM 1674 O ALA B 3 12.272 -16.602 -1.712 1.00 2.40 O ATOM 1675 CB ALA B 3 11.833 -17.949 0.653 1.00 3.36 C ATOM 0 H ALA B 3 10.359 -15.565 1.047 1.00 2.45 H new ATOM 0 HA ALA B 3 13.213 -16.359 1.137 1.00 2.52 H new ATOM 0 HB1 ALA B 3 12.550 -18.501 0.045 1.00 3.36 H new ATOM 0 HB2 ALA B 3 11.833 -18.349 1.667 1.00 3.36 H new ATOM 0 HB3 ALA B 3 10.837 -18.051 0.222 1.00 3.36 H new ATOM 1681 N GLU B 4 12.652 -14.582 -0.809 1.00 1.77 N ATOM 1682 CA GLU B 4 14.031 -14.093 -0.799 1.00 1.48 C ATOM 1683 C GLU B 4 14.189 -13.407 0.567 1.00 1.45 C ATOM 1684 O GLU B 4 13.216 -13.431 1.318 1.00 2.01 O ATOM 1685 CB GLU B 4 14.338 -13.193 -2.015 1.00 1.63 C ATOM 1686 CG GLU B 4 13.703 -11.785 -2.032 1.00 1.96 C ATOM 1687 CD GLU B 4 14.367 -10.842 -3.033 1.00 2.61 C ATOM 1688 OE1 GLU B 4 15.310 -11.291 -3.719 1.00 3.30 O ATOM 1689 OE2 GLU B 4 14.005 -9.646 -3.072 1.00 3.46 O ATOM 0 H GLU B 4 11.950 -13.846 -0.885 1.00 1.77 H new ATOM 0 HA GLU B 4 14.766 -14.891 -0.907 1.00 1.48 H new ATOM 0 HB2 GLU B 4 15.420 -13.076 -2.084 1.00 1.63 H new ATOM 0 HB3 GLU B 4 14.016 -13.719 -2.914 1.00 1.63 H new ATOM 0 HG2 GLU B 4 12.644 -11.873 -2.272 1.00 1.96 H new ATOM 0 HG3 GLU B 4 13.768 -11.351 -1.034 1.00 1.96 H new ATOM 1696 N PRO B 5 15.334 -12.825 0.957 1.00 1.50 N ATOM 1697 CA PRO B 5 15.469 -12.123 2.238 1.00 1.76 C ATOM 1698 C PRO B 5 14.576 -10.869 2.423 1.00 1.63 C ATOM 1699 O PRO B 5 14.976 -9.939 3.120 1.00 1.89 O ATOM 1700 CB PRO B 5 16.960 -11.766 2.341 1.00 2.41 C ATOM 1701 CG PRO B 5 17.645 -12.766 1.409 1.00 2.41 C ATOM 1702 CD PRO B 5 16.619 -12.922 0.290 1.00 1.80 C ATOM 0 HA PRO B 5 15.118 -12.777 3.036 1.00 1.76 H new ATOM 0 HB2 PRO B 5 17.147 -10.738 2.030 1.00 2.41 H new ATOM 0 HB3 PRO B 5 17.323 -11.861 3.364 1.00 2.41 H new ATOM 0 HG2 PRO B 5 18.598 -12.389 1.038 1.00 2.41 H new ATOM 0 HG3 PRO B 5 17.850 -13.713 1.908 1.00 2.41 H new ATOM 0 HD2 PRO B 5 16.734 -12.144 -0.465 1.00 1.80 H new ATOM 0 HD3 PRO B 5 16.730 -13.879 -0.219 1.00 1.80 H new ATOM 1710 N LEU B 6 13.378 -10.831 1.832 1.00 1.48 N ATOM 1711 CA LEU B 6 12.379 -9.788 1.973 1.00 1.48 C ATOM 1712 C LEU B 6 11.525 -10.005 3.228 1.00 1.21 C ATOM 1713 O LEU B 6 11.735 -10.954 3.986 1.00 1.47 O ATOM 1714 CB LEU B 6 11.524 -9.685 0.694 1.00 1.61 C ATOM 1715 CG LEU B 6 10.892 -10.984 0.162 1.00 1.61 C ATOM 1716 CD1 LEU B 6 10.304 -11.878 1.244 1.00 2.40 C ATOM 1717 CD2 LEU B 6 9.774 -10.646 -0.820 1.00 2.32 C ATOM 0 H LEU B 6 13.069 -11.576 1.207 1.00 1.48 H new ATOM 0 HA LEU B 6 12.888 -8.833 2.103 1.00 1.48 H new ATOM 0 HB2 LEU B 6 10.722 -8.971 0.881 1.00 1.61 H new ATOM 0 HB3 LEU B 6 12.147 -9.265 -0.096 1.00 1.61 H new ATOM 0 HG LEU B 6 11.706 -11.533 -0.312 1.00 1.61 H new ATOM 0 HD11 LEU B 6 9.879 -12.771 0.787 1.00 2.40 H new ATOM 0 HD12 LEU B 6 11.088 -12.167 1.944 1.00 2.40 H new ATOM 0 HD13 LEU B 6 9.523 -11.337 1.778 1.00 2.40 H new ATOM 0 HD21 LEU B 6 9.328 -11.567 -1.195 1.00 2.32 H new ATOM 0 HD22 LEU B 6 9.012 -10.054 -0.314 1.00 2.32 H new ATOM 0 HD23 LEU B 6 10.182 -10.075 -1.654 1.00 2.32 H new ATOM 1729 N THR B 7 10.588 -9.092 3.501 1.00 1.07 N ATOM 1730 CA THR B 7 9.703 -9.157 4.658 1.00 1.08 C ATOM 1731 C THR B 7 8.420 -8.367 4.369 1.00 1.03 C ATOM 1732 O THR B 7 8.305 -7.756 3.307 1.00 1.14 O ATOM 1733 CB THR B 7 10.521 -8.728 5.894 1.00 1.18 C ATOM 1734 OG1 THR B 7 11.230 -9.867 6.344 1.00 2.05 O ATOM 1735 CG2 THR B 7 9.781 -8.128 7.091 1.00 1.29 C ATOM 0 H THR B 7 10.424 -8.276 2.912 1.00 1.07 H new ATOM 0 HA THR B 7 9.342 -10.162 4.875 1.00 1.08 H new ATOM 0 HB THR B 7 11.135 -7.901 5.536 1.00 1.18 H new ATOM 0 HG1 THR B 7 11.705 -10.276 5.590 1.00 2.05 H new ATOM 0 HG21 THR B 7 10.497 -7.880 7.874 1.00 1.29 H new ATOM 0 HG22 THR B 7 9.257 -7.225 6.779 1.00 1.29 H new ATOM 0 HG23 THR B 7 9.061 -8.851 7.474 1.00 1.29 H new ATOM 1743 N GLU B 8 7.462 -8.415 5.305 1.00 1.10 N ATOM 1744 CA GLU B 8 6.067 -8.012 5.177 1.00 1.19 C ATOM 1745 C GLU B 8 5.849 -6.756 4.331 1.00 1.17 C ATOM 1746 O GLU B 8 4.939 -6.726 3.505 1.00 1.26 O ATOM 1747 CB GLU B 8 5.471 -7.794 6.572 1.00 1.40 C ATOM 1748 CG GLU B 8 5.418 -9.070 7.423 1.00 1.72 C ATOM 1749 CD GLU B 8 4.723 -8.855 8.765 1.00 2.95 C ATOM 1750 OE1 GLU B 8 3.948 -7.877 8.866 1.00 4.57 O ATOM 1751 OE2 GLU B 8 4.974 -9.688 9.661 1.00 3.27 O ATOM 0 H GLU B 8 7.665 -8.765 6.241 1.00 1.10 H new ATOM 0 HA GLU B 8 5.564 -8.823 4.651 1.00 1.19 H new ATOM 0 HB2 GLU B 8 6.060 -7.042 7.096 1.00 1.40 H new ATOM 0 HB3 GLU B 8 4.462 -7.394 6.469 1.00 1.40 H new ATOM 0 HG2 GLU B 8 4.896 -9.850 6.869 1.00 1.72 H new ATOM 0 HG3 GLU B 8 6.433 -9.428 7.597 1.00 1.72 H new ATOM 1758 N LEU B 9 6.669 -5.719 4.532 1.00 1.12 N ATOM 1759 CA LEU B 9 6.558 -4.487 3.770 1.00 1.17 C ATOM 1760 C LEU B 9 6.584 -4.809 2.270 1.00 1.21 C ATOM 1761 O LEU B 9 5.671 -4.442 1.533 1.00 1.38 O ATOM 1762 CB LEU B 9 7.682 -3.512 4.161 1.00 1.16 C ATOM 1763 CG LEU B 9 7.579 -2.948 5.598 1.00 1.13 C ATOM 1764 CD1 LEU B 9 8.141 -3.758 6.778 1.00 2.10 C ATOM 1765 CD2 LEU B 9 8.179 -1.537 5.661 1.00 2.87 C ATOM 0 H LEU B 9 7.419 -5.717 5.223 1.00 1.12 H new ATOM 0 HA LEU B 9 5.610 -3.999 3.999 1.00 1.17 H new ATOM 0 HB2 LEU B 9 8.640 -4.021 4.053 1.00 1.16 H new ATOM 0 HB3 LEU B 9 7.683 -2.679 3.458 1.00 1.16 H new ATOM 0 HG LEU B 9 6.501 -2.985 5.756 1.00 1.13 H new ATOM 0 HD11 LEU B 9 7.980 -3.209 7.706 1.00 2.10 H new ATOM 0 HD12 LEU B 9 7.633 -4.721 6.834 1.00 2.10 H new ATOM 0 HD13 LEU B 9 9.209 -3.920 6.632 1.00 2.10 H new ATOM 0 HD21 LEU B 9 8.100 -1.153 6.678 1.00 2.87 H new ATOM 0 HD22 LEU B 9 9.228 -1.574 5.368 1.00 2.87 H new ATOM 0 HD23 LEU B 9 7.636 -0.880 4.982 1.00 2.87 H new ATOM 1777 N GLU B 10 7.610 -5.545 1.836 1.00 1.12 N ATOM 1778 CA GLU B 10 7.760 -5.982 0.458 1.00 1.15 C ATOM 1779 C GLU B 10 6.698 -7.013 0.101 1.00 1.10 C ATOM 1780 O GLU B 10 6.060 -6.893 -0.943 1.00 1.18 O ATOM 1781 CB GLU B 10 9.178 -6.504 0.228 1.00 1.06 C ATOM 1782 CG GLU B 10 9.356 -7.266 -1.093 1.00 1.42 C ATOM 1783 CD GLU B 10 8.818 -6.603 -2.351 1.00 2.09 C ATOM 1784 OE1 GLU B 10 8.628 -5.368 -2.401 1.00 2.65 O ATOM 1785 OE2 GLU B 10 8.631 -7.327 -3.346 1.00 3.28 O ATOM 0 H GLU B 10 8.367 -5.855 2.445 1.00 1.12 H new ATOM 0 HA GLU B 10 7.610 -5.133 -0.208 1.00 1.15 H new ATOM 0 HB2 GLU B 10 9.871 -5.663 0.247 1.00 1.06 H new ATOM 0 HB3 GLU B 10 9.451 -7.161 1.054 1.00 1.06 H new ATOM 0 HG2 GLU B 10 10.421 -7.451 -1.236 1.00 1.42 H new ATOM 0 HG3 GLU B 10 8.875 -8.239 -0.990 1.00 1.42 H new ATOM 1792 N GLU B 11 6.486 -8.008 0.970 1.00 1.04 N ATOM 1793 CA GLU B 11 5.481 -9.036 0.712 1.00 1.07 C ATOM 1794 C GLU B 11 4.124 -8.379 0.391 1.00 1.01 C ATOM 1795 O GLU B 11 3.379 -8.844 -0.466 1.00 1.11 O ATOM 1796 CB GLU B 11 5.381 -10.023 1.881 1.00 1.07 C ATOM 1797 CG GLU B 11 6.720 -10.712 2.224 1.00 2.23 C ATOM 1798 CD GLU B 11 6.936 -12.049 1.511 1.00 2.64 C ATOM 1799 OE1 GLU B 11 6.628 -12.141 0.302 1.00 3.19 O ATOM 1800 OE2 GLU B 11 7.434 -12.974 2.189 1.00 3.47 O ATOM 0 H GLU B 11 6.993 -8.120 1.848 1.00 1.04 H new ATOM 0 HA GLU B 11 5.788 -9.615 -0.159 1.00 1.07 H new ATOM 0 HB2 GLU B 11 5.018 -9.494 2.762 1.00 1.07 H new ATOM 0 HB3 GLU B 11 4.641 -10.786 1.639 1.00 1.07 H new ATOM 0 HG2 GLU B 11 7.538 -10.039 1.967 1.00 2.23 H new ATOM 0 HG3 GLU B 11 6.767 -10.875 3.301 1.00 2.23 H new ATOM 1807 N SER B 12 3.811 -7.244 1.024 1.00 0.93 N ATOM 1808 CA SER B 12 2.575 -6.540 0.717 1.00 0.98 C ATOM 1809 C SER B 12 2.620 -6.010 -0.715 1.00 0.93 C ATOM 1810 O SER B 12 1.649 -6.113 -1.466 1.00 1.03 O ATOM 1811 CB SER B 12 2.359 -5.400 1.711 1.00 1.07 C ATOM 1812 OG SER B 12 2.331 -5.900 3.034 1.00 1.60 O ATOM 0 H SER B 12 4.389 -6.804 1.740 1.00 0.93 H new ATOM 0 HA SER B 12 1.737 -7.232 0.803 1.00 0.98 H new ATOM 0 HB2 SER B 12 3.157 -4.664 1.610 1.00 1.07 H new ATOM 0 HB3 SER B 12 1.423 -4.887 1.489 1.00 1.07 H new ATOM 0 HG SER B 12 3.224 -6.218 3.282 1.00 1.60 H new ATOM 1818 N ILE B 13 3.757 -5.423 -1.094 1.00 0.85 N ATOM 1819 CA ILE B 13 3.922 -4.801 -2.393 1.00 0.84 C ATOM 1820 C ILE B 13 3.802 -5.855 -3.494 1.00 0.82 C ATOM 1821 O ILE B 13 2.983 -5.693 -4.403 1.00 0.81 O ATOM 1822 CB ILE B 13 5.235 -3.996 -2.442 1.00 0.82 C ATOM 1823 CG1 ILE B 13 5.153 -2.800 -1.482 1.00 1.09 C ATOM 1824 CG2 ILE B 13 5.552 -3.419 -3.829 1.00 0.82 C ATOM 1825 CD1 ILE B 13 6.512 -2.424 -0.938 1.00 0.85 C ATOM 0 H ILE B 13 4.586 -5.370 -0.502 1.00 0.85 H new ATOM 0 HA ILE B 13 3.124 -4.080 -2.567 1.00 0.84 H new ATOM 0 HB ILE B 13 6.017 -4.703 -2.166 1.00 0.82 H new ATOM 0 HG12 ILE B 13 4.720 -1.945 -2.002 1.00 1.09 H new ATOM 0 HG13 ILE B 13 4.485 -3.042 -0.656 1.00 1.09 H new ATOM 0 HG21 ILE B 13 6.490 -2.865 -3.787 1.00 0.82 H new ATOM 0 HG22 ILE B 13 5.642 -4.232 -4.549 1.00 0.82 H new ATOM 0 HG23 ILE B 13 4.749 -2.749 -4.137 1.00 0.82 H new ATOM 0 HD11 ILE B 13 6.411 -1.574 -0.263 1.00 0.85 H new ATOM 0 HD12 ILE B 13 6.934 -3.270 -0.395 1.00 0.85 H new ATOM 0 HD13 ILE B 13 7.173 -2.156 -1.763 1.00 0.85 H new ATOM 1837 N GLU B 14 4.594 -6.932 -3.415 1.00 0.87 N ATOM 1838 CA GLU B 14 4.530 -8.010 -4.398 1.00 0.93 C ATOM 1839 C GLU B 14 3.111 -8.593 -4.484 1.00 0.89 C ATOM 1840 O GLU B 14 2.601 -8.825 -5.581 1.00 0.91 O ATOM 1841 CB GLU B 14 5.636 -9.050 -4.191 1.00 1.17 C ATOM 1842 CG GLU B 14 5.546 -9.802 -2.869 1.00 1.24 C ATOM 1843 CD GLU B 14 4.663 -11.035 -2.944 1.00 2.18 C ATOM 1844 OE1 GLU B 14 5.049 -11.970 -3.678 1.00 2.71 O ATOM 1845 OE2 GLU B 14 3.673 -11.103 -2.195 1.00 3.29 O ATOM 0 H GLU B 14 5.285 -7.076 -2.679 1.00 0.87 H new ATOM 0 HA GLU B 14 4.737 -7.591 -5.383 1.00 0.93 H new ATOM 0 HB2 GLU B 14 5.600 -9.770 -5.009 1.00 1.17 H new ATOM 0 HB3 GLU B 14 6.604 -8.551 -4.247 1.00 1.17 H new ATOM 0 HG2 GLU B 14 6.548 -10.098 -2.557 1.00 1.24 H new ATOM 0 HG3 GLU B 14 5.159 -9.131 -2.102 1.00 1.24 H new ATOM 1852 N THR B 15 2.447 -8.771 -3.338 1.00 0.89 N ATOM 1853 CA THR B 15 1.072 -9.251 -3.277 1.00 0.93 C ATOM 1854 C THR B 15 0.151 -8.313 -4.061 1.00 0.87 C ATOM 1855 O THR B 15 -0.602 -8.771 -4.918 1.00 0.93 O ATOM 1856 CB THR B 15 0.622 -9.451 -1.820 1.00 1.02 C ATOM 1857 OG1 THR B 15 1.275 -10.575 -1.270 1.00 1.18 O ATOM 1858 CG2 THR B 15 -0.882 -9.721 -1.706 1.00 1.02 C ATOM 0 H THR B 15 2.856 -8.583 -2.422 1.00 0.89 H new ATOM 0 HA THR B 15 1.013 -10.231 -3.751 1.00 0.93 H new ATOM 0 HB THR B 15 0.869 -8.530 -1.292 1.00 1.02 H new ATOM 0 HG1 THR B 15 2.243 -10.481 -1.388 1.00 1.18 H new ATOM 0 HG21 THR B 15 -1.149 -9.855 -0.658 1.00 1.02 H new ATOM 0 HG22 THR B 15 -1.435 -8.876 -2.116 1.00 1.02 H new ATOM 0 HG23 THR B 15 -1.133 -10.624 -2.263 1.00 1.02 H new ATOM 1866 N VAL B 16 0.206 -7.000 -3.820 1.00 0.79 N ATOM 1867 CA VAL B 16 -0.616 -6.061 -4.568 1.00 0.77 C ATOM 1868 C VAL B 16 -0.365 -6.210 -6.074 1.00 0.78 C ATOM 1869 O VAL B 16 -1.295 -6.456 -6.848 1.00 0.85 O ATOM 1870 CB VAL B 16 -0.343 -4.634 -4.074 1.00 0.75 C ATOM 1871 CG1 VAL B 16 -0.919 -3.620 -5.059 1.00 0.77 C ATOM 1872 CG2 VAL B 16 -0.984 -4.399 -2.699 1.00 0.93 C ATOM 0 H VAL B 16 0.808 -6.571 -3.117 1.00 0.79 H new ATOM 0 HA VAL B 16 -1.670 -6.279 -4.399 1.00 0.77 H new ATOM 0 HB VAL B 16 0.737 -4.509 -3.995 1.00 0.75 H new ATOM 0 HG11 VAL B 16 -0.720 -2.610 -4.700 1.00 0.77 H new ATOM 0 HG12 VAL B 16 -0.453 -3.756 -6.035 1.00 0.77 H new ATOM 0 HG13 VAL B 16 -1.995 -3.769 -5.147 1.00 0.77 H new ATOM 0 HG21 VAL B 16 -0.777 -3.381 -2.370 1.00 0.93 H new ATOM 0 HG22 VAL B 16 -2.062 -4.545 -2.770 1.00 0.93 H new ATOM 0 HG23 VAL B 16 -0.569 -5.104 -1.979 1.00 0.93 H new ATOM 1882 N VAL B 17 0.891 -6.040 -6.503 1.00 0.77 N ATOM 1883 CA VAL B 17 1.207 -6.050 -7.929 1.00 0.84 C ATOM 1884 C VAL B 17 0.912 -7.417 -8.557 1.00 0.81 C ATOM 1885 O VAL B 17 0.665 -7.485 -9.764 1.00 0.95 O ATOM 1886 CB VAL B 17 2.641 -5.574 -8.216 1.00 0.79 C ATOM 1887 CG1 VAL B 17 2.874 -4.155 -7.682 1.00 1.04 C ATOM 1888 CG2 VAL B 17 3.668 -6.534 -7.620 1.00 0.80 C ATOM 0 H VAL B 17 1.693 -5.896 -5.889 1.00 0.77 H new ATOM 0 HA VAL B 17 0.548 -5.326 -8.407 1.00 0.84 H new ATOM 0 HB VAL B 17 2.767 -5.559 -9.299 1.00 0.79 H new ATOM 0 HG11 VAL B 17 3.897 -3.847 -7.900 1.00 1.04 H new ATOM 0 HG12 VAL B 17 2.178 -3.467 -8.162 1.00 1.04 H new ATOM 0 HG13 VAL B 17 2.713 -4.141 -6.604 1.00 1.04 H new ATOM 0 HG21 VAL B 17 4.673 -6.173 -7.838 1.00 0.80 H new ATOM 0 HG22 VAL B 17 3.529 -6.591 -6.540 1.00 0.80 H new ATOM 0 HG23 VAL B 17 3.536 -7.524 -8.056 1.00 0.80 H new ATOM 1898 N THR B 18 0.914 -8.491 -7.764 1.00 0.78 N ATOM 1899 CA THR B 18 0.385 -9.784 -8.167 1.00 0.85 C ATOM 1900 C THR B 18 -1.123 -9.683 -8.393 1.00 0.87 C ATOM 1901 O THR B 18 -1.596 -9.980 -9.488 1.00 0.91 O ATOM 1902 CB THR B 18 0.737 -10.844 -7.113 1.00 0.97 C ATOM 1903 OG1 THR B 18 2.132 -11.050 -7.133 1.00 1.79 O ATOM 1904 CG2 THR B 18 -0.001 -12.163 -7.340 1.00 1.63 C ATOM 0 H THR B 18 1.288 -8.481 -6.815 1.00 0.78 H new ATOM 0 HA THR B 18 0.840 -10.090 -9.109 1.00 0.85 H new ATOM 0 HB THR B 18 0.419 -10.478 -6.137 1.00 0.97 H new ATOM 0 HG1 THR B 18 2.576 -10.335 -6.631 1.00 1.79 H new ATOM 0 HG21 THR B 18 0.284 -12.877 -6.567 1.00 1.63 H new ATOM 0 HG22 THR B 18 -1.076 -11.991 -7.296 1.00 1.63 H new ATOM 0 HG23 THR B 18 0.262 -12.563 -8.319 1.00 1.63 H new ATOM 1912 N THR B 19 -1.879 -9.266 -7.376 1.00 0.92 N ATOM 1913 CA THR B 19 -3.339 -9.265 -7.405 1.00 1.03 C ATOM 1914 C THR B 19 -3.841 -8.495 -8.631 1.00 0.99 C ATOM 1915 O THR B 19 -4.726 -8.970 -9.341 1.00 1.14 O ATOM 1916 CB THR B 19 -3.888 -8.778 -6.051 1.00 1.17 C ATOM 1917 OG1 THR B 19 -4.315 -9.889 -5.291 1.00 1.68 O ATOM 1918 CG2 THR B 19 -5.038 -7.773 -6.136 1.00 0.98 C ATOM 0 H THR B 19 -1.489 -8.916 -6.501 1.00 0.92 H new ATOM 0 HA THR B 19 -3.729 -10.275 -7.527 1.00 1.03 H new ATOM 0 HB THR B 19 -3.060 -8.249 -5.580 1.00 1.17 H new ATOM 0 HG1 THR B 19 -5.211 -10.159 -5.581 1.00 1.68 H new ATOM 0 HG21 THR B 19 -5.352 -7.493 -5.130 1.00 0.98 H new ATOM 0 HG22 THR B 19 -4.706 -6.884 -6.673 1.00 0.98 H new ATOM 0 HG23 THR B 19 -5.877 -8.224 -6.666 1.00 0.98 H new ATOM 1926 N PHE B 20 -3.212 -7.353 -8.939 1.00 0.87 N ATOM 1927 CA PHE B 20 -3.490 -6.580 -10.151 1.00 0.83 C ATOM 1928 C PHE B 20 -3.616 -7.459 -11.409 1.00 0.90 C ATOM 1929 O PHE B 20 -4.439 -7.174 -12.275 1.00 1.02 O ATOM 1930 CB PHE B 20 -2.377 -5.552 -10.387 1.00 0.84 C ATOM 1931 CG PHE B 20 -2.484 -4.210 -9.692 1.00 0.71 C ATOM 1932 CD1 PHE B 20 -2.950 -4.106 -8.369 1.00 2.22 C ATOM 1933 CD2 PHE B 20 -2.084 -3.046 -10.378 1.00 1.69 C ATOM 1934 CE1 PHE B 20 -3.024 -2.849 -7.749 1.00 2.23 C ATOM 1935 CE2 PHE B 20 -2.180 -1.790 -9.764 1.00 1.70 C ATOM 1936 CZ PHE B 20 -2.628 -1.692 -8.439 1.00 0.80 C ATOM 0 H PHE B 20 -2.491 -6.939 -8.348 1.00 0.87 H new ATOM 0 HA PHE B 20 -4.448 -6.088 -9.987 1.00 0.83 H new ATOM 0 HB2 PHE B 20 -1.433 -6.008 -10.087 1.00 0.84 H new ATOM 0 HB3 PHE B 20 -2.316 -5.368 -11.460 1.00 0.84 H new ATOM 0 HD1 PHE B 20 -3.251 -4.993 -7.831 1.00 2.22 H new ATOM 0 HD2 PHE B 20 -1.700 -3.122 -11.385 1.00 1.69 H new ATOM 0 HE1 PHE B 20 -3.388 -2.771 -6.735 1.00 2.23 H new ATOM 0 HE2 PHE B 20 -1.909 -0.899 -10.311 1.00 1.70 H new ATOM 0 HZ PHE B 20 -2.668 -0.730 -7.951 1.00 0.80 H new ATOM 1946 N PHE B 21 -2.776 -8.492 -11.549 1.00 0.92 N ATOM 1947 CA PHE B 21 -2.812 -9.379 -12.707 1.00 1.10 C ATOM 1948 C PHE B 21 -4.176 -10.059 -12.838 1.00 1.29 C ATOM 1949 O PHE B 21 -4.697 -10.192 -13.941 1.00 1.55 O ATOM 1950 CB PHE B 21 -1.706 -10.452 -12.627 1.00 1.25 C ATOM 1951 CG PHE B 21 -0.851 -10.642 -13.870 1.00 1.76 C ATOM 1952 CD1 PHE B 21 -1.371 -10.420 -15.160 1.00 2.87 C ATOM 1953 CD2 PHE B 21 0.475 -11.098 -13.728 1.00 2.61 C ATOM 1954 CE1 PHE B 21 -0.536 -10.534 -16.285 1.00 3.71 C ATOM 1955 CE2 PHE B 21 1.313 -11.199 -14.851 1.00 3.35 C ATOM 1956 CZ PHE B 21 0.812 -10.899 -16.129 1.00 3.62 C ATOM 0 H PHE B 21 -2.058 -8.731 -10.865 1.00 0.92 H new ATOM 0 HA PHE B 21 -2.638 -8.762 -13.588 1.00 1.10 H new ATOM 0 HB2 PHE B 21 -1.047 -10.201 -11.795 1.00 1.25 H new ATOM 0 HB3 PHE B 21 -2.174 -11.406 -12.386 1.00 1.25 H new ATOM 0 HD1 PHE B 21 -2.412 -10.162 -15.285 1.00 2.87 H new ATOM 0 HD2 PHE B 21 0.848 -11.371 -12.752 1.00 2.61 H new ATOM 0 HE1 PHE B 21 -0.931 -10.341 -17.271 1.00 3.71 H new ATOM 0 HE2 PHE B 21 2.341 -11.507 -14.732 1.00 3.35 H new ATOM 0 HZ PHE B 21 1.462 -10.949 -16.990 1.00 3.62 H new ATOM 1966 N THR B 22 -4.741 -10.520 -11.721 1.00 1.41 N ATOM 1967 CA THR B 22 -5.979 -11.283 -11.722 1.00 1.79 C ATOM 1968 C THR B 22 -7.159 -10.325 -11.555 1.00 1.86 C ATOM 1969 O THR B 22 -7.953 -10.460 -10.623 1.00 2.22 O ATOM 1970 CB THR B 22 -5.918 -12.422 -10.682 1.00 2.20 C ATOM 1971 OG1 THR B 22 -7.179 -13.046 -10.566 1.00 3.69 O ATOM 1972 CG2 THR B 22 -5.457 -11.989 -9.286 1.00 2.24 C ATOM 0 H THR B 22 -4.348 -10.372 -10.791 1.00 1.41 H new ATOM 0 HA THR B 22 -6.124 -11.787 -12.678 1.00 1.79 H new ATOM 0 HB THR B 22 -5.165 -13.112 -11.063 1.00 2.20 H new ATOM 0 HG1 THR B 22 -7.856 -12.375 -10.337 1.00 3.69 H new ATOM 0 HG21 THR B 22 -5.445 -12.854 -8.622 1.00 2.24 H new ATOM 0 HG22 THR B 22 -4.455 -11.566 -9.349 1.00 2.24 H new ATOM 0 HG23 THR B 22 -6.143 -11.239 -8.892 1.00 2.24 H new ATOM 1980 N PHE B 23 -7.339 -9.407 -12.509 1.00 1.96 N ATOM 1981 CA PHE B 23 -8.415 -8.417 -12.471 1.00 2.33 C ATOM 1982 C PHE B 23 -9.708 -9.047 -13.007 1.00 2.51 C ATOM 1983 O PHE B 23 -10.336 -8.540 -13.932 1.00 3.70 O ATOM 1984 CB PHE B 23 -7.995 -7.130 -13.210 1.00 2.75 C ATOM 1985 CG PHE B 23 -7.680 -7.257 -14.694 1.00 3.99 C ATOM 1986 CD1 PHE B 23 -6.441 -7.773 -15.115 1.00 5.04 C ATOM 1987 CD2 PHE B 23 -8.591 -6.785 -15.659 1.00 5.01 C ATOM 1988 CE1 PHE B 23 -6.193 -7.986 -16.481 1.00 6.81 C ATOM 1989 CE2 PHE B 23 -8.275 -6.860 -17.027 1.00 6.56 C ATOM 1990 CZ PHE B 23 -7.088 -7.489 -17.442 1.00 7.42 C ATOM 0 H PHE B 23 -6.740 -9.331 -13.331 1.00 1.96 H new ATOM 0 HA PHE B 23 -8.614 -8.113 -11.443 1.00 2.33 H new ATOM 0 HB2 PHE B 23 -8.794 -6.397 -13.095 1.00 2.75 H new ATOM 0 HB3 PHE B 23 -7.115 -6.724 -12.710 1.00 2.75 H new ATOM 0 HD1 PHE B 23 -5.679 -8.006 -14.386 1.00 5.04 H new ATOM 0 HD2 PHE B 23 -9.535 -6.364 -15.347 1.00 5.01 H new ATOM 0 HE1 PHE B 23 -5.314 -8.532 -16.792 1.00 6.81 H new ATOM 0 HE2 PHE B 23 -8.945 -6.434 -17.760 1.00 6.56 H new ATOM 0 HZ PHE B 23 -6.866 -7.589 -18.494 1.00 7.42 H new ATOM 2000 N ALA B 24 -10.084 -10.184 -12.408 1.00 2.30 N ATOM 2001 CA ALA B 24 -11.093 -11.124 -12.883 1.00 2.74 C ATOM 2002 C ALA B 24 -11.043 -11.261 -14.407 1.00 3.02 C ATOM 2003 O ALA B 24 -12.046 -11.077 -15.096 1.00 3.55 O ATOM 2004 CB ALA B 24 -12.475 -10.693 -12.379 1.00 3.18 C ATOM 0 H ALA B 24 -9.665 -10.485 -11.528 1.00 2.30 H new ATOM 0 HA ALA B 24 -10.883 -12.114 -12.479 1.00 2.74 H new ATOM 0 HB1 ALA B 24 -13.228 -11.396 -12.735 1.00 3.18 H new ATOM 0 HB2 ALA B 24 -12.477 -10.680 -11.289 1.00 3.18 H new ATOM 0 HB3 ALA B 24 -12.704 -9.696 -12.754 1.00 3.18 H new ATOM 2010 N ARG B 25 -9.869 -11.630 -14.929 1.00 3.24 N ATOM 2011 CA ARG B 25 -9.605 -11.746 -16.352 1.00 3.75 C ATOM 2012 C ARG B 25 -8.204 -12.338 -16.512 1.00 3.58 C ATOM 2013 O ARG B 25 -7.434 -12.343 -15.553 1.00 4.07 O ATOM 2014 CB ARG B 25 -9.695 -10.360 -17.021 1.00 4.77 C ATOM 2015 CG ARG B 25 -10.109 -10.469 -18.493 1.00 5.82 C ATOM 2016 CD ARG B 25 -10.276 -9.073 -19.098 1.00 7.00 C ATOM 2017 NE ARG B 25 -10.682 -9.155 -20.508 1.00 7.70 N ATOM 2018 CZ ARG B 25 -11.928 -9.229 -20.994 1.00 8.17 C ATOM 2019 NH1 ARG B 25 -12.978 -9.277 -20.167 1.00 8.26 N ATOM 2020 NH2 ARG B 25 -12.091 -9.262 -22.317 1.00 9.03 N ATOM 0 H ARG B 25 -9.060 -11.861 -14.352 1.00 3.24 H new ATOM 0 HA ARG B 25 -10.341 -12.390 -16.833 1.00 3.75 H new ATOM 0 HB2 ARG B 25 -10.416 -9.743 -16.485 1.00 4.77 H new ATOM 0 HB3 ARG B 25 -8.730 -9.858 -16.950 1.00 4.77 H new ATOM 0 HG2 ARG B 25 -9.357 -11.027 -19.050 1.00 5.82 H new ATOM 0 HG3 ARG B 25 -11.044 -11.024 -18.576 1.00 5.82 H new ATOM 0 HD2 ARG B 25 -11.022 -8.515 -18.533 1.00 7.00 H new ATOM 0 HD3 ARG B 25 -9.338 -8.523 -19.017 1.00 7.00 H new ATOM 0 HE ARG B 25 -9.928 -9.156 -21.195 1.00 7.70 H new ATOM 0 HH11 ARG B 25 -12.833 -9.257 -19.157 1.00 8.26 H new ATOM 0 HH12 ARG B 25 -13.923 -9.333 -20.546 1.00 8.26 H new ATOM 0 HH21 ARG B 25 -11.278 -9.231 -22.932 1.00 9.03 H new ATOM 0 HH22 ARG B 25 -13.029 -9.318 -22.714 1.00 9.03 H new ATOM 2034 N GLN B 26 -7.880 -12.819 -17.715 1.00 3.92 N ATOM 2035 CA GLN B 26 -6.550 -13.281 -18.091 1.00 4.26 C ATOM 2036 C GLN B 26 -6.239 -12.717 -19.483 1.00 4.03 C ATOM 2037 O GLN B 26 -6.033 -13.463 -20.435 1.00 4.93 O ATOM 2038 CB GLN B 26 -6.517 -14.818 -18.031 1.00 5.76 C ATOM 2039 CG GLN B 26 -5.093 -15.382 -18.136 1.00 7.00 C ATOM 2040 CD GLN B 26 -5.089 -16.907 -18.124 1.00 8.56 C ATOM 2041 OE1 GLN B 26 -4.677 -17.544 -19.087 1.00 9.62 O ATOM 2042 NE2 GLN B 26 -5.542 -17.513 -17.031 1.00 9.17 N ATOM 0 H GLN B 26 -8.558 -12.898 -18.473 1.00 3.92 H new ATOM 0 HA GLN B 26 -5.778 -12.929 -17.407 1.00 4.26 H new ATOM 0 HB2 GLN B 26 -6.968 -15.151 -17.096 1.00 5.76 H new ATOM 0 HB3 GLN B 26 -7.125 -15.223 -18.840 1.00 5.76 H new ATOM 0 HG2 GLN B 26 -4.626 -15.024 -19.054 1.00 7.00 H new ATOM 0 HG3 GLN B 26 -4.492 -15.010 -17.306 1.00 7.00 H new ATOM 0 HE21 GLN B 26 -5.879 -16.959 -16.244 1.00 9.17 H new ATOM 0 HE22 GLN B 26 -5.552 -18.532 -16.980 1.00 9.17 H new ATOM 2051 N GLU B 27 -6.244 -11.385 -19.595 1.00 3.47 N ATOM 2052 CA GLU B 27 -6.001 -10.659 -20.835 1.00 3.75 C ATOM 2053 C GLU B 27 -4.922 -9.612 -20.558 1.00 3.02 C ATOM 2054 O GLU B 27 -5.225 -8.451 -20.288 1.00 3.35 O ATOM 2055 CB GLU B 27 -7.318 -10.045 -21.331 1.00 4.69 C ATOM 2056 CG GLU B 27 -7.195 -9.455 -22.744 1.00 5.94 C ATOM 2057 CD GLU B 27 -8.476 -8.755 -23.172 1.00 7.08 C ATOM 2058 OE1 GLU B 27 -9.554 -9.321 -22.881 1.00 7.59 O ATOM 2059 OE2 GLU B 27 -8.378 -7.647 -23.733 1.00 7.92 O ATOM 0 H GLU B 27 -6.423 -10.770 -18.801 1.00 3.47 H new ATOM 0 HA GLU B 27 -5.644 -11.316 -21.629 1.00 3.75 H new ATOM 0 HB2 GLU B 27 -8.096 -10.808 -21.326 1.00 4.69 H new ATOM 0 HB3 GLU B 27 -7.634 -9.263 -20.640 1.00 4.69 H new ATOM 0 HG2 GLU B 27 -6.366 -8.748 -22.773 1.00 5.94 H new ATOM 0 HG3 GLU B 27 -6.960 -10.250 -23.452 1.00 5.94 H new ATOM 2066 N GLY B 28 -3.658 -10.043 -20.575 1.00 2.86 N ATOM 2067 CA GLY B 28 -2.534 -9.190 -20.219 1.00 2.59 C ATOM 2068 C GLY B 28 -2.778 -8.537 -18.859 1.00 2.32 C ATOM 2069 O GLY B 28 -3.182 -9.213 -17.914 1.00 3.07 O ATOM 0 H GLY B 28 -3.391 -10.992 -20.836 1.00 2.86 H new ATOM 0 HA2 GLY B 28 -1.617 -9.778 -20.189 1.00 2.59 H new ATOM 0 HA3 GLY B 28 -2.395 -8.422 -20.980 1.00 2.59 H new ATOM 2073 N ARG B 29 -2.538 -7.227 -18.756 1.00 1.98 N ATOM 2074 CA ARG B 29 -2.927 -6.427 -17.608 1.00 1.76 C ATOM 2075 C ARG B 29 -3.036 -4.969 -18.054 1.00 1.80 C ATOM 2076 O ARG B 29 -2.029 -4.374 -18.430 1.00 2.03 O ATOM 2077 CB ARG B 29 -1.899 -6.603 -16.480 1.00 1.92 C ATOM 2078 CG ARG B 29 -2.313 -5.854 -15.208 1.00 2.28 C ATOM 2079 CD ARG B 29 -1.086 -5.552 -14.347 1.00 2.99 C ATOM 2080 NE ARG B 29 -0.429 -6.790 -13.906 1.00 3.36 N ATOM 2081 CZ ARG B 29 0.195 -6.944 -12.730 1.00 4.60 C ATOM 2082 NH1 ARG B 29 0.410 -5.905 -11.923 1.00 5.45 N ATOM 2083 NH2 ARG B 29 0.595 -8.150 -12.332 1.00 5.68 N ATOM 0 H ARG B 29 -2.061 -6.692 -19.482 1.00 1.98 H new ATOM 0 HA ARG B 29 -3.893 -6.749 -17.220 1.00 1.76 H new ATOM 0 HB2 ARG B 29 -1.784 -7.663 -16.256 1.00 1.92 H new ATOM 0 HB3 ARG B 29 -0.927 -6.241 -16.815 1.00 1.92 H new ATOM 0 HG2 ARG B 29 -2.817 -4.925 -15.473 1.00 2.28 H new ATOM 0 HG3 ARG B 29 -3.025 -6.453 -14.641 1.00 2.28 H new ATOM 0 HD2 ARG B 29 -0.381 -4.945 -14.915 1.00 2.99 H new ATOM 0 HD3 ARG B 29 -1.384 -4.966 -13.478 1.00 2.99 H new ATOM 0 HE ARG B 29 -0.449 -7.589 -14.540 1.00 3.36 H new ATOM 0 HH11 ARG B 29 0.098 -4.973 -12.197 1.00 5.45 H new ATOM 0 HH12 ARG B 29 0.887 -6.042 -11.032 1.00 5.45 H new ATOM 0 HH21 ARG B 29 0.427 -8.964 -12.923 1.00 5.68 H new ATOM 0 HH22 ARG B 29 1.069 -8.260 -11.436 1.00 5.68 H new ATOM 2097 N LYS B 30 -4.219 -4.355 -17.953 1.00 2.14 N ATOM 2098 CA LYS B 30 -4.422 -2.928 -18.227 1.00 2.72 C ATOM 2099 C LYS B 30 -3.900 -2.054 -17.068 1.00 2.85 C ATOM 2100 O LYS B 30 -4.491 -1.028 -16.742 1.00 4.59 O ATOM 2101 CB LYS B 30 -5.922 -2.700 -18.530 1.00 3.37 C ATOM 2102 CG LYS B 30 -6.213 -2.621 -20.037 1.00 3.89 C ATOM 2103 CD LYS B 30 -6.310 -1.167 -20.534 1.00 3.72 C ATOM 2104 CE LYS B 30 -5.036 -0.340 -20.288 1.00 3.12 C ATOM 2105 NZ LYS B 30 -5.227 1.085 -20.626 1.00 3.88 N ATOM 0 H LYS B 30 -5.072 -4.840 -17.676 1.00 2.14 H new ATOM 0 HA LYS B 30 -3.843 -2.624 -19.099 1.00 2.72 H new ATOM 0 HB2 LYS B 30 -6.505 -3.511 -18.093 1.00 3.37 H new ATOM 0 HB3 LYS B 30 -6.250 -1.777 -18.051 1.00 3.37 H new ATOM 0 HG2 LYS B 30 -5.426 -3.139 -20.585 1.00 3.89 H new ATOM 0 HG3 LYS B 30 -7.147 -3.140 -20.253 1.00 3.89 H new ATOM 0 HD2 LYS B 30 -6.528 -1.172 -21.602 1.00 3.72 H new ATOM 0 HD3 LYS B 30 -7.150 -0.679 -20.039 1.00 3.72 H new ATOM 0 HE2 LYS B 30 -4.743 -0.428 -19.242 1.00 3.12 H new ATOM 0 HE3 LYS B 30 -4.219 -0.747 -20.883 1.00 3.12 H new ATOM 0 HZ1 LYS B 30 -4.362 1.615 -20.398 1.00 3.88 H new ATOM 0 HZ2 LYS B 30 -5.432 1.177 -21.642 1.00 3.88 H new ATOM 0 HZ3 LYS B 30 -6.023 1.468 -20.077 1.00 3.88 H new ATOM 2119 N ASP B 31 -2.780 -2.452 -16.455 1.00 1.70 N ATOM 2120 CA ASP B 31 -2.335 -2.032 -15.129 1.00 1.71 C ATOM 2121 C ASP B 31 -3.431 -2.270 -14.079 1.00 1.80 C ATOM 2122 O ASP B 31 -3.341 -3.221 -13.302 1.00 2.03 O ATOM 2123 CB ASP B 31 -1.799 -0.596 -15.140 1.00 1.70 C ATOM 2124 CG ASP B 31 -1.013 -0.265 -13.877 1.00 2.66 C ATOM 2125 OD1 ASP B 31 -1.382 -0.767 -12.793 1.00 4.36 O ATOM 2126 OD2 ASP B 31 -0.044 0.509 -14.008 1.00 2.71 O ATOM 0 H ASP B 31 -2.132 -3.106 -16.893 1.00 1.70 H new ATOM 0 HA ASP B 31 -1.491 -2.656 -14.836 1.00 1.71 H new ATOM 0 HB2 ASP B 31 -1.159 -0.456 -16.011 1.00 1.70 H new ATOM 0 HB3 ASP B 31 -2.632 0.100 -15.240 1.00 1.70 H new ATOM 2131 N SER B 32 -4.479 -1.444 -14.091 1.00 1.77 N ATOM 2132 CA SER B 32 -5.598 -1.491 -13.166 1.00 1.76 C ATOM 2133 C SER B 32 -6.902 -1.144 -13.906 1.00 1.69 C ATOM 2134 O SER B 32 -7.067 -1.506 -15.069 1.00 1.86 O ATOM 2135 CB SER B 32 -5.298 -0.540 -11.999 1.00 1.72 C ATOM 2136 OG SER B 32 -6.226 -0.740 -10.951 1.00 2.49 O ATOM 0 H SER B 32 -4.569 -0.695 -14.777 1.00 1.77 H new ATOM 0 HA SER B 32 -5.733 -2.493 -12.758 1.00 1.76 H new ATOM 0 HB2 SER B 32 -4.285 -0.710 -11.634 1.00 1.72 H new ATOM 0 HB3 SER B 32 -5.344 0.494 -12.342 1.00 1.72 H new ATOM 0 HG SER B 32 -5.762 -0.691 -10.089 1.00 2.49 H new ATOM 2142 N LEU B 33 -7.835 -0.469 -13.223 1.00 1.51 N ATOM 2143 CA LEU B 33 -9.148 -0.084 -13.734 1.00 1.43 C ATOM 2144 C LEU B 33 -9.161 1.427 -13.977 1.00 1.21 C ATOM 2145 O LEU B 33 -8.132 2.093 -13.890 1.00 1.21 O ATOM 2146 CB LEU B 33 -10.260 -0.462 -12.730 1.00 1.49 C ATOM 2147 CG LEU B 33 -10.354 -1.933 -12.297 1.00 1.78 C ATOM 2148 CD1 LEU B 33 -10.329 -2.908 -13.479 1.00 2.33 C ATOM 2149 CD2 LEU B 33 -9.282 -2.285 -11.266 1.00 1.63 C ATOM 0 H LEU B 33 -7.685 -0.166 -12.261 1.00 1.51 H new ATOM 0 HA LEU B 33 -9.337 -0.615 -14.667 1.00 1.43 H new ATOM 0 HB2 LEU B 33 -10.125 0.144 -11.834 1.00 1.49 H new ATOM 0 HB3 LEU B 33 -11.218 -0.178 -13.166 1.00 1.49 H new ATOM 0 HG LEU B 33 -11.329 -2.047 -11.823 1.00 1.78 H new ATOM 0 HD11 LEU B 33 -10.398 -3.931 -13.109 1.00 2.33 H new ATOM 0 HD12 LEU B 33 -11.173 -2.703 -14.138 1.00 2.33 H new ATOM 0 HD13 LEU B 33 -9.398 -2.785 -14.032 1.00 2.33 H new ATOM 0 HD21 LEU B 33 -9.379 -3.333 -10.983 1.00 1.63 H new ATOM 0 HD22 LEU B 33 -8.295 -2.115 -11.695 1.00 1.63 H new ATOM 0 HD23 LEU B 33 -9.406 -1.658 -10.383 1.00 1.63 H new ATOM 2161 N SER B 34 -10.340 1.993 -14.232 1.00 1.15 N ATOM 2162 CA SER B 34 -10.527 3.436 -14.220 1.00 0.97 C ATOM 2163 C SER B 34 -10.482 3.931 -12.768 1.00 0.79 C ATOM 2164 O SER B 34 -10.789 3.169 -11.856 1.00 0.85 O ATOM 2165 CB SER B 34 -11.837 3.797 -14.928 1.00 1.19 C ATOM 2166 OG SER B 34 -11.918 3.098 -16.154 1.00 1.65 O ATOM 0 H SER B 34 -11.185 1.465 -14.451 1.00 1.15 H new ATOM 0 HA SER B 34 -9.726 3.934 -14.767 1.00 0.97 H new ATOM 0 HB2 SER B 34 -12.687 3.542 -14.295 1.00 1.19 H new ATOM 0 HB3 SER B 34 -11.883 4.871 -15.106 1.00 1.19 H new ATOM 0 HG SER B 34 -12.757 3.327 -16.606 1.00 1.65 H new ATOM 2172 N VAL B 35 -10.086 5.182 -12.517 1.00 0.74 N ATOM 2173 CA VAL B 35 -9.847 5.634 -11.145 1.00 0.82 C ATOM 2174 C VAL B 35 -11.160 5.739 -10.349 1.00 0.82 C ATOM 2175 O VAL B 35 -11.242 5.325 -9.193 1.00 0.85 O ATOM 2176 CB VAL B 35 -9.074 6.960 -11.172 1.00 1.12 C ATOM 2177 CG1 VAL B 35 -8.716 7.421 -9.758 1.00 1.32 C ATOM 2178 CG2 VAL B 35 -7.765 6.871 -11.960 1.00 1.35 C ATOM 0 H VAL B 35 -9.926 5.890 -13.234 1.00 0.74 H new ATOM 0 HA VAL B 35 -9.238 4.894 -10.626 1.00 0.82 H new ATOM 0 HB VAL B 35 -9.743 7.669 -11.660 1.00 1.12 H new ATOM 0 HG11 VAL B 35 -8.169 8.362 -9.810 1.00 1.32 H new ATOM 0 HG12 VAL B 35 -9.629 7.563 -9.180 1.00 1.32 H new ATOM 0 HG13 VAL B 35 -8.094 6.667 -9.276 1.00 1.32 H new ATOM 0 HG21 VAL B 35 -7.264 7.839 -11.943 1.00 1.35 H new ATOM 0 HG22 VAL B 35 -7.118 6.119 -11.507 1.00 1.35 H new ATOM 0 HG23 VAL B 35 -7.980 6.591 -12.991 1.00 1.35 H new ATOM 2188 N ASN B 36 -12.197 6.306 -10.965 1.00 0.92 N ATOM 2189 CA ASN B 36 -13.493 6.501 -10.323 1.00 1.16 C ATOM 2190 C ASN B 36 -14.115 5.139 -10.005 1.00 1.19 C ATOM 2191 O ASN B 36 -14.393 4.838 -8.846 1.00 1.26 O ATOM 2192 CB ASN B 36 -14.373 7.381 -11.217 1.00 1.49 C ATOM 2193 CG ASN B 36 -15.553 7.979 -10.458 1.00 2.44 C ATOM 2194 OD1 ASN B 36 -16.296 7.264 -9.800 1.00 3.18 O ATOM 2195 ND2 ASN B 36 -15.728 9.300 -10.516 1.00 2.96 N ATOM 0 H ASN B 36 -12.160 6.644 -11.927 1.00 0.92 H new ATOM 0 HA ASN B 36 -13.385 7.024 -9.373 1.00 1.16 H new ATOM 0 HB2 ASN B 36 -13.770 8.185 -11.638 1.00 1.49 H new ATOM 0 HB3 ASN B 36 -14.744 6.789 -12.054 1.00 1.49 H new ATOM 0 HD21 ASN B 36 -16.495 9.736 -10.004 1.00 2.96 H new ATOM 0 HD22 ASN B 36 -15.095 9.874 -11.072 1.00 2.96 H new ATOM 2202 N GLU B 37 -14.213 4.289 -11.035 1.00 1.24 N ATOM 2203 CA GLU B 37 -14.521 2.865 -10.927 1.00 1.34 C ATOM 2204 C GLU B 37 -13.760 2.264 -9.739 1.00 1.20 C ATOM 2205 O GLU B 37 -14.351 1.704 -8.818 1.00 1.29 O ATOM 2206 CB GLU B 37 -14.122 2.195 -12.255 1.00 1.43 C ATOM 2207 CG GLU B 37 -14.481 0.707 -12.370 1.00 1.65 C ATOM 2208 CD GLU B 37 -15.970 0.475 -12.596 1.00 3.43 C ATOM 2209 OE1 GLU B 37 -16.524 1.188 -13.460 1.00 4.27 O ATOM 2210 OE2 GLU B 37 -16.510 -0.426 -11.925 1.00 4.52 O ATOM 0 H GLU B 37 -14.074 4.589 -12.000 1.00 1.24 H new ATOM 0 HA GLU B 37 -15.584 2.702 -10.749 1.00 1.34 H new ATOM 0 HB2 GLU B 37 -14.602 2.732 -13.073 1.00 1.43 H new ATOM 0 HB3 GLU B 37 -13.046 2.304 -12.390 1.00 1.43 H new ATOM 0 HG2 GLU B 37 -13.920 0.265 -13.193 1.00 1.65 H new ATOM 0 HG3 GLU B 37 -14.171 0.192 -11.461 1.00 1.65 H new ATOM 2217 N PHE B 38 -12.433 2.421 -9.742 1.00 1.01 N ATOM 2218 CA PHE B 38 -11.575 1.922 -8.684 1.00 0.83 C ATOM 2219 C PHE B 38 -12.039 2.365 -7.292 1.00 0.79 C ATOM 2220 O PHE B 38 -12.037 1.536 -6.385 1.00 0.80 O ATOM 2221 CB PHE B 38 -10.102 2.252 -8.942 1.00 0.68 C ATOM 2222 CG PHE B 38 -9.199 1.776 -7.827 1.00 0.97 C ATOM 2223 CD1 PHE B 38 -9.091 0.396 -7.573 1.00 2.35 C ATOM 2224 CD2 PHE B 38 -8.648 2.703 -6.921 1.00 1.49 C ATOM 2225 CE1 PHE B 38 -8.473 -0.054 -6.397 1.00 2.85 C ATOM 2226 CE2 PHE B 38 -7.984 2.250 -5.770 1.00 1.77 C ATOM 2227 CZ PHE B 38 -7.920 0.873 -5.498 1.00 2.12 C ATOM 0 H PHE B 38 -11.929 2.902 -10.487 1.00 1.01 H new ATOM 0 HA PHE B 38 -11.662 0.836 -8.697 1.00 0.83 H new ATOM 0 HB2 PHE B 38 -9.789 1.793 -9.880 1.00 0.68 H new ATOM 0 HB3 PHE B 38 -9.990 3.330 -9.061 1.00 0.68 H new ATOM 0 HD1 PHE B 38 -9.484 -0.316 -8.283 1.00 2.35 H new ATOM 0 HD2 PHE B 38 -8.736 3.762 -7.112 1.00 1.49 H new ATOM 0 HE1 PHE B 38 -8.422 -1.111 -6.183 1.00 2.85 H new ATOM 0 HE2 PHE B 38 -7.524 2.957 -5.096 1.00 1.77 H new ATOM 0 HZ PHE B 38 -7.443 0.526 -4.593 1.00 2.12 H new ATOM 2237 N LYS B 39 -12.458 3.627 -7.099 1.00 0.83 N ATOM 2238 CA LYS B 39 -13.011 4.046 -5.809 1.00 0.89 C ATOM 2239 C LYS B 39 -14.106 3.066 -5.375 1.00 0.98 C ATOM 2240 O LYS B 39 -14.048 2.505 -4.278 1.00 0.98 O ATOM 2241 CB LYS B 39 -13.508 5.511 -5.804 1.00 1.06 C ATOM 2242 CG LYS B 39 -13.835 5.994 -4.370 1.00 1.41 C ATOM 2243 CD LYS B 39 -15.271 5.663 -3.906 1.00 2.23 C ATOM 2244 CE LYS B 39 -15.360 4.995 -2.518 1.00 3.53 C ATOM 2245 NZ LYS B 39 -15.071 5.903 -1.386 1.00 5.34 N ATOM 0 H LYS B 39 -12.424 4.360 -7.808 1.00 0.83 H new ATOM 0 HA LYS B 39 -12.202 4.020 -5.079 1.00 0.89 H new ATOM 0 HB2 LYS B 39 -12.746 6.156 -6.242 1.00 1.06 H new ATOM 0 HB3 LYS B 39 -14.396 5.597 -6.430 1.00 1.06 H new ATOM 0 HG2 LYS B 39 -13.127 5.542 -3.675 1.00 1.41 H new ATOM 0 HG3 LYS B 39 -13.688 7.073 -4.319 1.00 1.41 H new ATOM 0 HD2 LYS B 39 -15.855 6.583 -3.890 1.00 2.23 H new ATOM 0 HD3 LYS B 39 -15.734 5.005 -4.642 1.00 2.23 H new ATOM 0 HE2 LYS B 39 -16.360 4.581 -2.390 1.00 3.53 H new ATOM 0 HE3 LYS B 39 -14.662 4.158 -2.485 1.00 3.53 H new ATOM 0 HZ1 LYS B 39 -15.152 5.379 -0.491 1.00 5.34 H new ATOM 0 HZ2 LYS B 39 -14.106 6.280 -1.481 1.00 5.34 H new ATOM 0 HZ3 LYS B 39 -15.752 6.689 -1.389 1.00 5.34 H new ATOM 2259 N GLU B 40 -15.096 2.845 -6.240 1.00 1.15 N ATOM 2260 CA GLU B 40 -16.187 1.932 -5.943 1.00 1.25 C ATOM 2261 C GLU B 40 -15.661 0.512 -5.711 1.00 1.16 C ATOM 2262 O GLU B 40 -16.027 -0.128 -4.728 1.00 1.26 O ATOM 2263 CB GLU B 40 -17.267 2.011 -7.026 1.00 1.41 C ATOM 2264 CG GLU B 40 -17.787 3.453 -7.148 1.00 1.47 C ATOM 2265 CD GLU B 40 -19.177 3.502 -7.765 1.00 1.95 C ATOM 2266 OE1 GLU B 40 -20.105 3.012 -7.087 1.00 3.05 O ATOM 2267 OE2 GLU B 40 -19.292 4.043 -8.885 1.00 2.26 O ATOM 0 H GLU B 40 -15.160 3.291 -7.155 1.00 1.15 H new ATOM 0 HA GLU B 40 -16.664 2.235 -5.011 1.00 1.25 H new ATOM 0 HB2 GLU B 40 -16.860 1.681 -7.982 1.00 1.41 H new ATOM 0 HB3 GLU B 40 -18.089 1.339 -6.781 1.00 1.41 H new ATOM 0 HG2 GLU B 40 -17.811 3.916 -6.161 1.00 1.47 H new ATOM 0 HG3 GLU B 40 -17.098 4.038 -7.758 1.00 1.47 H new ATOM 2274 N LEU B 41 -14.757 0.025 -6.562 1.00 1.04 N ATOM 2275 CA LEU B 41 -14.181 -1.304 -6.388 1.00 0.97 C ATOM 2276 C LEU B 41 -13.438 -1.450 -5.054 1.00 0.82 C ATOM 2277 O LEU B 41 -13.587 -2.482 -4.406 1.00 0.81 O ATOM 2278 CB LEU B 41 -13.293 -1.689 -7.582 1.00 0.97 C ATOM 2279 CG LEU B 41 -14.031 -2.381 -8.745 1.00 1.42 C ATOM 2280 CD1 LEU B 41 -14.358 -3.845 -8.422 1.00 2.06 C ATOM 2281 CD2 LEU B 41 -15.309 -1.654 -9.175 1.00 3.16 C ATOM 0 H LEU B 41 -14.410 0.532 -7.376 1.00 1.04 H new ATOM 0 HA LEU B 41 -15.012 -2.008 -6.355 1.00 0.97 H new ATOM 0 HB2 LEU B 41 -12.810 -0.789 -7.962 1.00 0.97 H new ATOM 0 HB3 LEU B 41 -12.502 -2.350 -7.229 1.00 0.97 H new ATOM 0 HG LEU B 41 -13.335 -2.344 -9.583 1.00 1.42 H new ATOM 0 HD11 LEU B 41 -14.878 -4.297 -9.267 1.00 2.06 H new ATOM 0 HD12 LEU B 41 -13.434 -4.391 -8.231 1.00 2.06 H new ATOM 0 HD13 LEU B 41 -14.995 -3.889 -7.539 1.00 2.06 H new ATOM 0 HD21 LEU B 41 -15.777 -2.196 -9.997 1.00 3.16 H new ATOM 0 HD22 LEU B 41 -16.000 -1.604 -8.333 1.00 3.16 H new ATOM 0 HD23 LEU B 41 -15.061 -0.644 -9.501 1.00 3.16 H new ATOM 2293 N VAL B 42 -12.667 -0.456 -4.590 1.00 0.83 N ATOM 2294 CA VAL B 42 -11.963 -0.611 -3.312 1.00 0.76 C ATOM 2295 C VAL B 42 -13.012 -0.640 -2.204 1.00 0.85 C ATOM 2296 O VAL B 42 -12.973 -1.494 -1.322 1.00 0.87 O ATOM 2297 CB VAL B 42 -10.813 0.398 -3.079 1.00 0.75 C ATOM 2298 CG1 VAL B 42 -11.235 1.867 -3.029 1.00 2.38 C ATOM 2299 CG2 VAL B 42 -10.063 0.070 -1.784 1.00 2.30 C ATOM 0 H VAL B 42 -12.518 0.435 -5.063 1.00 0.83 H new ATOM 0 HA VAL B 42 -11.420 -1.556 -3.319 1.00 0.76 H new ATOM 0 HB VAL B 42 -10.175 0.284 -3.955 1.00 0.75 H new ATOM 0 HG11 VAL B 42 -10.358 2.492 -2.862 1.00 2.38 H new ATOM 0 HG12 VAL B 42 -11.703 2.143 -3.974 1.00 2.38 H new ATOM 0 HG13 VAL B 42 -11.945 2.014 -2.216 1.00 2.38 H new ATOM 0 HG21 VAL B 42 -9.258 0.790 -1.637 1.00 2.30 H new ATOM 0 HG22 VAL B 42 -10.753 0.120 -0.941 1.00 2.30 H new ATOM 0 HG23 VAL B 42 -9.644 -0.934 -1.851 1.00 2.30 H new ATOM 2309 N THR B 43 -14.001 0.250 -2.304 1.00 0.94 N ATOM 2310 CA THR B 43 -15.190 0.202 -1.471 1.00 0.98 C ATOM 2311 C THR B 43 -15.763 -1.227 -1.403 1.00 1.00 C ATOM 2312 O THR B 43 -15.916 -1.776 -0.314 1.00 1.16 O ATOM 2313 CB THR B 43 -16.172 1.298 -1.934 1.00 1.09 C ATOM 2314 OG1 THR B 43 -16.051 2.436 -1.101 1.00 1.73 O ATOM 2315 CG2 THR B 43 -17.634 0.874 -2.043 1.00 1.54 C ATOM 0 H THR B 43 -13.994 1.024 -2.969 1.00 0.94 H new ATOM 0 HA THR B 43 -14.952 0.432 -0.432 1.00 0.98 H new ATOM 0 HB THR B 43 -15.877 1.529 -2.957 1.00 1.09 H new ATOM 0 HG1 THR B 43 -16.913 2.900 -1.054 1.00 1.73 H new ATOM 0 HG21 THR B 43 -18.235 1.721 -2.376 1.00 1.54 H new ATOM 0 HG22 THR B 43 -17.724 0.060 -2.762 1.00 1.54 H new ATOM 0 HG23 THR B 43 -17.989 0.538 -1.069 1.00 1.54 H new ATOM 2323 N GLN B 44 -16.038 -1.861 -2.547 1.00 0.98 N ATOM 2324 CA GLN B 44 -16.564 -3.221 -2.587 1.00 1.04 C ATOM 2325 C GLN B 44 -15.593 -4.215 -1.945 1.00 0.98 C ATOM 2326 O GLN B 44 -16.019 -5.093 -1.200 1.00 1.02 O ATOM 2327 CB GLN B 44 -16.878 -3.633 -4.030 1.00 1.10 C ATOM 2328 CG GLN B 44 -18.076 -2.860 -4.593 1.00 1.67 C ATOM 2329 CD GLN B 44 -18.290 -3.169 -6.069 1.00 2.32 C ATOM 2330 OE1 GLN B 44 -18.169 -2.295 -6.918 1.00 3.56 O ATOM 2331 NE2 GLN B 44 -18.609 -4.419 -6.394 1.00 2.70 N ATOM 0 H GLN B 44 -15.901 -1.443 -3.467 1.00 0.98 H new ATOM 0 HA GLN B 44 -17.488 -3.238 -2.009 1.00 1.04 H new ATOM 0 HB2 GLN B 44 -16.004 -3.457 -4.657 1.00 1.10 H new ATOM 0 HB3 GLN B 44 -17.086 -4.702 -4.066 1.00 1.10 H new ATOM 0 HG2 GLN B 44 -18.974 -3.118 -4.031 1.00 1.67 H new ATOM 0 HG3 GLN B 44 -17.915 -1.790 -4.463 1.00 1.67 H new ATOM 0 HE21 GLN B 44 -18.703 -5.127 -5.666 1.00 2.70 H new ATOM 0 HE22 GLN B 44 -18.759 -4.669 -7.371 1.00 2.70 H new ATOM 2340 N GLN B 45 -14.300 -4.096 -2.253 1.00 0.94 N ATOM 2341 CA GLN B 45 -13.266 -4.985 -1.742 1.00 0.92 C ATOM 2342 C GLN B 45 -13.048 -4.821 -0.241 1.00 0.87 C ATOM 2343 O GLN B 45 -12.501 -5.734 0.357 1.00 0.91 O ATOM 2344 CB GLN B 45 -11.940 -4.772 -2.486 1.00 0.97 C ATOM 2345 CG GLN B 45 -11.752 -5.647 -3.728 1.00 0.78 C ATOM 2346 CD GLN B 45 -12.793 -5.440 -4.826 1.00 0.96 C ATOM 2347 OE1 GLN B 45 -12.500 -4.827 -5.846 1.00 1.74 O ATOM 2348 NE2 GLN B 45 -13.995 -5.985 -4.663 1.00 1.56 N ATOM 0 H GLN B 45 -13.942 -3.369 -2.872 1.00 0.94 H new ATOM 0 HA GLN B 45 -13.618 -6.002 -1.918 1.00 0.92 H new ATOM 0 HB2 GLN B 45 -11.870 -3.725 -2.782 1.00 0.97 H new ATOM 0 HB3 GLN B 45 -11.118 -4.963 -1.796 1.00 0.97 H new ATOM 0 HG2 GLN B 45 -10.763 -5.454 -4.144 1.00 0.78 H new ATOM 0 HG3 GLN B 45 -11.770 -6.693 -3.423 1.00 0.78 H new ATOM 0 HE21 GLN B 45 -14.214 -6.490 -3.804 1.00 1.56 H new ATOM 0 HE22 GLN B 45 -14.698 -5.898 -5.397 1.00 1.56 H new ATOM 2357 N LEU B 46 -13.418 -3.691 0.368 1.00 0.82 N ATOM 2358 CA LEU B 46 -13.359 -3.511 1.818 1.00 0.77 C ATOM 2359 C LEU B 46 -14.787 -3.459 2.382 1.00 0.75 C ATOM 2360 O LEU B 46 -15.198 -2.417 2.887 1.00 0.82 O ATOM 2361 CB LEU B 46 -12.587 -2.220 2.157 1.00 0.85 C ATOM 2362 CG LEU B 46 -11.054 -2.331 2.110 1.00 1.09 C ATOM 2363 CD1 LEU B 46 -10.505 -2.622 0.710 1.00 1.17 C ATOM 2364 CD2 LEU B 46 -10.468 -1.003 2.598 1.00 1.64 C ATOM 0 H LEU B 46 -13.767 -2.874 -0.133 1.00 0.82 H new ATOM 0 HA LEU B 46 -12.832 -4.350 2.272 1.00 0.77 H new ATOM 0 HB2 LEU B 46 -12.898 -1.439 1.463 1.00 0.85 H new ATOM 0 HB3 LEU B 46 -12.879 -1.895 3.155 1.00 0.85 H new ATOM 0 HG LEU B 46 -10.767 -3.171 2.743 1.00 1.09 H new ATOM 0 HD11 LEU B 46 -9.418 -2.687 0.752 1.00 1.17 H new ATOM 0 HD12 LEU B 46 -10.911 -3.567 0.349 1.00 1.17 H new ATOM 0 HD13 LEU B 46 -10.795 -1.820 0.032 1.00 1.17 H new ATOM 0 HD21 LEU B 46 -9.380 -1.055 2.575 1.00 1.64 H new ATOM 0 HD22 LEU B 46 -10.807 -0.195 1.949 1.00 1.64 H new ATOM 0 HD23 LEU B 46 -10.800 -0.812 3.618 1.00 1.64 H new ATOM 2376 N PRO B 47 -15.561 -4.557 2.374 1.00 0.73 N ATOM 2377 CA PRO B 47 -16.970 -4.532 2.748 1.00 0.77 C ATOM 2378 C PRO B 47 -17.226 -4.223 4.232 1.00 0.85 C ATOM 2379 O PRO B 47 -18.389 -4.169 4.625 1.00 1.15 O ATOM 2380 CB PRO B 47 -17.507 -5.916 2.366 1.00 0.86 C ATOM 2381 CG PRO B 47 -16.282 -6.814 2.526 1.00 0.84 C ATOM 2382 CD PRO B 47 -15.168 -5.908 2.010 1.00 0.75 C ATOM 0 HA PRO B 47 -17.478 -3.719 2.229 1.00 0.77 H new ATOM 0 HB2 PRO B 47 -18.323 -6.227 3.018 1.00 0.86 H new ATOM 0 HB3 PRO B 47 -17.890 -5.933 1.346 1.00 0.86 H new ATOM 0 HG2 PRO B 47 -16.123 -7.109 3.563 1.00 0.84 H new ATOM 0 HG3 PRO B 47 -16.367 -7.731 1.943 1.00 0.84 H new ATOM 0 HD2 PRO B 47 -14.210 -6.171 2.458 1.00 0.75 H new ATOM 0 HD3 PRO B 47 -15.053 -6.005 0.930 1.00 0.75 H new ATOM 2390 N HIS B 48 -16.185 -4.062 5.062 1.00 0.89 N ATOM 2391 CA HIS B 48 -16.246 -3.769 6.495 1.00 0.99 C ATOM 2392 C HIS B 48 -17.373 -2.765 6.804 1.00 1.21 C ATOM 2393 O HIS B 48 -18.392 -3.154 7.376 1.00 2.18 O ATOM 2394 CB HIS B 48 -14.859 -3.245 6.910 1.00 1.20 C ATOM 2395 CG HIS B 48 -14.571 -3.072 8.386 1.00 1.68 C ATOM 2396 ND1 HIS B 48 -15.456 -2.931 9.439 1.00 3.21 N ATOM 2397 CD2 HIS B 48 -13.309 -2.949 8.905 1.00 2.02 C ATOM 2398 CE1 HIS B 48 -14.730 -2.740 10.554 1.00 3.70 C ATOM 2399 NE2 HIS B 48 -13.415 -2.716 10.277 1.00 2.94 N ATOM 0 H HIS B 48 -15.224 -4.138 4.728 1.00 0.89 H new ATOM 0 HA HIS B 48 -16.484 -4.664 7.070 1.00 0.99 H new ATOM 0 HB2 HIS B 48 -14.111 -3.925 6.502 1.00 1.20 H new ATOM 0 HB3 HIS B 48 -14.710 -2.280 6.426 1.00 1.20 H new ATOM 0 HD1 HIS B 48 -16.474 -2.966 9.380 1.00 3.21 H new ATOM 0 HD2 HIS B 48 -12.387 -3.020 8.346 1.00 2.02 H new ATOM 0 HE1 HIS B 48 -15.148 -2.621 11.543 1.00 3.70 H new ATOM 2407 N LEU B 49 -17.207 -1.501 6.386 1.00 1.13 N ATOM 2408 CA LEU B 49 -18.148 -0.411 6.662 1.00 1.22 C ATOM 2409 C LEU B 49 -18.196 0.583 5.493 1.00 1.20 C ATOM 2410 O LEU B 49 -19.265 0.847 4.955 1.00 1.42 O ATOM 2411 CB LEU B 49 -17.755 0.288 7.979 1.00 1.27 C ATOM 2412 CG LEU B 49 -18.868 1.085 8.694 1.00 1.61 C ATOM 2413 CD1 LEU B 49 -19.614 2.089 7.813 1.00 3.03 C ATOM 2414 CD2 LEU B 49 -19.891 0.162 9.360 1.00 2.72 C ATOM 0 H LEU B 49 -16.400 -1.205 5.837 1.00 1.13 H new ATOM 0 HA LEU B 49 -19.150 -0.825 6.773 1.00 1.22 H new ATOM 0 HB2 LEU B 49 -17.380 -0.469 8.668 1.00 1.27 H new ATOM 0 HB3 LEU B 49 -16.928 0.967 7.771 1.00 1.27 H new ATOM 0 HG LEU B 49 -18.327 1.661 9.445 1.00 1.61 H new ATOM 0 HD11 LEU B 49 -20.375 2.598 8.405 1.00 3.03 H new ATOM 0 HD12 LEU B 49 -18.910 2.822 7.420 1.00 3.03 H new ATOM 0 HD13 LEU B 49 -20.090 1.563 6.985 1.00 3.03 H new ATOM 0 HD21 LEU B 49 -20.657 0.762 9.852 1.00 2.72 H new ATOM 0 HD22 LEU B 49 -20.356 -0.471 8.604 1.00 2.72 H new ATOM 0 HD23 LEU B 49 -19.390 -0.463 10.099 1.00 2.72 H new ATOM 2426 N LEU B 50 -17.039 1.148 5.121 1.00 1.10 N ATOM 2427 CA LEU B 50 -16.902 2.237 4.149 1.00 1.19 C ATOM 2428 C LEU B 50 -17.495 3.526 4.718 1.00 1.13 C ATOM 2429 O LEU B 50 -18.372 4.157 4.134 1.00 1.33 O ATOM 2430 CB LEU B 50 -17.471 1.908 2.757 1.00 1.56 C ATOM 2431 CG LEU B 50 -16.903 0.653 2.077 1.00 1.63 C ATOM 2432 CD1 LEU B 50 -15.382 0.556 2.242 1.00 3.25 C ATOM 2433 CD2 LEU B 50 -17.608 -0.635 2.515 1.00 2.31 C ATOM 0 H LEU B 50 -16.142 0.847 5.503 1.00 1.10 H new ATOM 0 HA LEU B 50 -15.834 2.379 3.985 1.00 1.19 H new ATOM 0 HB2 LEU B 50 -18.551 1.792 2.846 1.00 1.56 H new ATOM 0 HB3 LEU B 50 -17.295 2.762 2.103 1.00 1.56 H new ATOM 0 HG LEU B 50 -17.110 0.764 1.013 1.00 1.63 H new ATOM 0 HD11 LEU B 50 -15.019 -0.345 1.747 1.00 3.25 H new ATOM 0 HD12 LEU B 50 -14.911 1.431 1.794 1.00 3.25 H new ATOM 0 HD13 LEU B 50 -15.133 0.513 3.302 1.00 3.25 H new ATOM 0 HD21 LEU B 50 -17.163 -1.487 2.001 1.00 2.31 H new ATOM 0 HD22 LEU B 50 -17.497 -0.763 3.592 1.00 2.31 H new ATOM 0 HD23 LEU B 50 -18.667 -0.573 2.265 1.00 2.31 H new ATOM 2445 N LYS B 51 -16.998 3.904 5.896 1.00 0.96 N ATOM 2446 CA LYS B 51 -17.437 5.091 6.616 1.00 0.98 C ATOM 2447 C LYS B 51 -17.035 6.383 5.891 1.00 0.99 C ATOM 2448 O LYS B 51 -17.713 7.396 6.027 1.00 1.11 O ATOM 2449 CB LYS B 51 -16.868 5.017 8.042 1.00 0.99 C ATOM 2450 CG LYS B 51 -15.337 5.158 8.064 1.00 1.06 C ATOM 2451 CD LYS B 51 -14.931 6.629 8.255 1.00 1.38 C ATOM 2452 CE LYS B 51 -14.644 6.975 9.729 1.00 1.58 C ATOM 2453 NZ LYS B 51 -13.248 7.416 9.927 1.00 3.10 N ATOM 0 H LYS B 51 -16.268 3.383 6.381 1.00 0.96 H new ATOM 0 HA LYS B 51 -18.526 5.116 6.662 1.00 0.98 H new ATOM 0 HB2 LYS B 51 -17.313 5.805 8.650 1.00 0.99 H new ATOM 0 HB3 LYS B 51 -17.150 4.067 8.495 1.00 0.99 H new ATOM 0 HG2 LYS B 51 -14.922 4.553 8.870 1.00 1.06 H new ATOM 0 HG3 LYS B 51 -14.918 4.778 7.132 1.00 1.06 H new ATOM 0 HD2 LYS B 51 -14.044 6.839 7.657 1.00 1.38 H new ATOM 0 HD3 LYS B 51 -15.727 7.274 7.882 1.00 1.38 H new ATOM 0 HE2 LYS B 51 -15.324 7.762 10.057 1.00 1.58 H new ATOM 0 HE3 LYS B 51 -14.842 6.103 10.352 1.00 1.58 H new ATOM 0 HZ1 LYS B 51 -13.064 7.542 10.943 1.00 3.10 H new ATOM 0 HZ2 LYS B 51 -12.600 6.698 9.544 1.00 3.10 H new ATOM 0 HZ3 LYS B 51 -13.096 8.319 9.433 1.00 3.10 H new ATOM 2467 N ASP B 52 -15.887 6.339 5.206 1.00 0.96 N ATOM 2468 CA ASP B 52 -15.248 7.353 4.379 1.00 0.98 C ATOM 2469 C ASP B 52 -15.508 8.797 4.816 1.00 0.99 C ATOM 2470 O ASP B 52 -16.428 9.445 4.324 1.00 1.20 O ATOM 2471 CB ASP B 52 -15.528 7.088 2.890 1.00 1.30 C ATOM 2472 CG ASP B 52 -15.098 5.699 2.409 1.00 1.65 C ATOM 2473 OD1 ASP B 52 -14.844 4.825 3.273 1.00 2.10 O ATOM 2474 OD2 ASP B 52 -15.053 5.527 1.165 1.00 2.65 O ATOM 0 H ASP B 52 -15.323 5.490 5.225 1.00 0.96 H new ATOM 0 HA ASP B 52 -14.174 7.252 4.535 1.00 0.98 H new ATOM 0 HB2 ASP B 52 -16.595 7.210 2.705 1.00 1.30 H new ATOM 0 HB3 ASP B 52 -15.013 7.842 2.295 1.00 1.30 H new ATOM 2479 N VAL B 53 -14.639 9.326 5.692 1.00 0.97 N ATOM 2480 CA VAL B 53 -14.603 10.744 6.039 1.00 1.10 C ATOM 2481 C VAL B 53 -13.163 11.253 6.089 1.00 1.13 C ATOM 2482 O VAL B 53 -12.217 10.466 6.063 1.00 1.53 O ATOM 2483 CB VAL B 53 -15.364 11.053 7.345 1.00 1.64 C ATOM 2484 CG1 VAL B 53 -16.827 10.602 7.280 1.00 2.62 C ATOM 2485 CG2 VAL B 53 -14.680 10.429 8.564 1.00 2.55 C ATOM 0 H VAL B 53 -13.937 8.770 6.181 1.00 0.97 H new ATOM 0 HA VAL B 53 -15.126 11.283 5.249 1.00 1.10 H new ATOM 0 HB VAL B 53 -15.346 12.137 7.456 1.00 1.64 H new ATOM 0 HG11 VAL B 53 -17.323 10.840 8.221 1.00 2.62 H new ATOM 0 HG12 VAL B 53 -17.331 11.119 6.463 1.00 2.62 H new ATOM 0 HG13 VAL B 53 -16.869 9.526 7.109 1.00 2.62 H new ATOM 0 HG21 VAL B 53 -15.247 10.670 9.463 1.00 2.55 H new ATOM 0 HG22 VAL B 53 -14.636 9.347 8.442 1.00 2.55 H new ATOM 0 HG23 VAL B 53 -13.669 10.825 8.656 1.00 2.55 H new ATOM 2495 N GLY B 54 -12.999 12.576 6.160 1.00 1.27 N ATOM 2496 CA GLY B 54 -11.705 13.233 6.131 1.00 1.50 C ATOM 2497 C GLY B 54 -11.082 13.086 4.746 1.00 1.25 C ATOM 2498 O GLY B 54 -11.359 13.880 3.851 1.00 1.49 O ATOM 0 H GLY B 54 -13.781 13.226 6.241 1.00 1.27 H new ATOM 0 HA2 GLY B 54 -11.817 14.288 6.379 1.00 1.50 H new ATOM 0 HA3 GLY B 54 -11.048 12.796 6.884 1.00 1.50 H new ATOM 2502 N SER B 55 -10.288 12.034 4.546 1.00 1.03 N ATOM 2503 CA SER B 55 -9.610 11.804 3.276 1.00 0.97 C ATOM 2504 C SER B 55 -10.576 11.480 2.147 1.00 0.94 C ATOM 2505 O SER B 55 -10.196 11.555 0.979 1.00 1.04 O ATOM 2506 CB SER B 55 -8.517 10.752 3.383 1.00 1.08 C ATOM 2507 OG SER B 55 -7.297 11.401 3.642 1.00 1.67 O ATOM 0 H SER B 55 -10.100 11.325 5.254 1.00 1.03 H new ATOM 0 HA SER B 55 -9.128 12.748 3.024 1.00 0.97 H new ATOM 0 HB2 SER B 55 -8.747 10.046 4.181 1.00 1.08 H new ATOM 0 HB3 SER B 55 -8.452 10.178 2.459 1.00 1.08 H new ATOM 0 HG SER B 55 -6.963 11.811 2.817 1.00 1.67 H new ATOM 2513 N LEU B 56 -11.822 11.121 2.473 1.00 0.92 N ATOM 2514 CA LEU B 56 -12.867 11.119 1.464 1.00 1.03 C ATOM 2515 C LEU B 56 -12.779 12.383 0.610 1.00 1.09 C ATOM 2516 O LEU B 56 -12.925 12.281 -0.600 1.00 1.12 O ATOM 2517 CB LEU B 56 -14.260 10.846 2.061 1.00 1.10 C ATOM 2518 CG LEU B 56 -15.272 11.998 2.258 1.00 2.44 C ATOM 2519 CD1 LEU B 56 -14.781 13.148 3.142 1.00 3.79 C ATOM 2520 CD2 LEU B 56 -15.914 12.513 0.961 1.00 3.69 C ATOM 0 H LEU B 56 -12.120 10.836 3.406 1.00 0.92 H new ATOM 0 HA LEU B 56 -12.702 10.279 0.789 1.00 1.03 H new ATOM 0 HB2 LEU B 56 -14.741 10.101 1.427 1.00 1.10 H new ATOM 0 HB3 LEU B 56 -14.106 10.383 3.036 1.00 1.10 H new ATOM 0 HG LEU B 56 -16.068 11.511 2.821 1.00 2.44 H new ATOM 0 HD11 LEU B 56 -15.561 13.906 3.219 1.00 3.79 H new ATOM 0 HD12 LEU B 56 -14.545 12.768 4.136 1.00 3.79 H new ATOM 0 HD13 LEU B 56 -13.888 13.590 2.701 1.00 3.79 H new ATOM 0 HD21 LEU B 56 -16.609 13.319 1.194 1.00 3.69 H new ATOM 0 HD22 LEU B 56 -15.137 12.886 0.293 1.00 3.69 H new ATOM 0 HD23 LEU B 56 -16.452 11.700 0.473 1.00 3.69 H new ATOM 2532 N ASP B 57 -12.481 13.545 1.207 1.00 1.29 N ATOM 2533 CA ASP B 57 -12.406 14.791 0.460 1.00 1.46 C ATOM 2534 C ASP B 57 -11.191 14.777 -0.475 1.00 1.39 C ATOM 2535 O ASP B 57 -11.359 14.773 -1.696 1.00 1.42 O ATOM 2536 CB ASP B 57 -12.348 15.978 1.428 1.00 1.71 C ATOM 2537 CG ASP B 57 -12.020 17.256 0.681 1.00 2.84 C ATOM 2538 OD1 ASP B 57 -12.863 17.729 -0.114 1.00 3.19 O ATOM 2539 OD2 ASP B 57 -10.884 17.757 0.829 1.00 4.26 O ATOM 0 H ASP B 57 -12.289 13.640 2.204 1.00 1.29 H new ATOM 0 HA ASP B 57 -13.300 14.896 -0.155 1.00 1.46 H new ATOM 0 HB2 ASP B 57 -13.304 16.084 1.940 1.00 1.71 H new ATOM 0 HB3 ASP B 57 -11.595 15.794 2.194 1.00 1.71 H new ATOM 2544 N GLU B 58 -9.983 14.700 0.107 1.00 1.38 N ATOM 2545 CA GLU B 58 -8.698 14.589 -0.589 1.00 1.44 C ATOM 2546 C GLU B 58 -8.839 13.675 -1.810 1.00 1.30 C ATOM 2547 O GLU B 58 -8.467 14.035 -2.929 1.00 1.43 O ATOM 2548 CB GLU B 58 -7.624 14.010 0.356 1.00 1.42 C ATOM 2549 CG GLU B 58 -7.117 14.935 1.477 1.00 1.92 C ATOM 2550 CD GLU B 58 -5.887 14.354 2.197 1.00 3.48 C ATOM 2551 OE1 GLU B 58 -4.768 14.481 1.650 1.00 4.66 O ATOM 2552 OE2 GLU B 58 -6.057 13.819 3.318 1.00 4.48 O ATOM 0 H GLU B 58 -9.875 14.714 1.121 1.00 1.38 H new ATOM 0 HA GLU B 58 -8.395 15.585 -0.911 1.00 1.44 H new ATOM 0 HB2 GLU B 58 -8.027 13.107 0.816 1.00 1.42 H new ATOM 0 HB3 GLU B 58 -6.768 13.706 -0.247 1.00 1.42 H new ATOM 0 HG2 GLU B 58 -6.864 15.908 1.056 1.00 1.92 H new ATOM 0 HG3 GLU B 58 -7.916 15.098 2.200 1.00 1.92 H new ATOM 2559 N LYS B 59 -9.420 12.497 -1.596 1.00 1.09 N ATOM 2560 CA LYS B 59 -9.536 11.487 -2.622 1.00 1.05 C ATOM 2561 C LYS B 59 -10.643 11.841 -3.613 1.00 1.05 C ATOM 2562 O LYS B 59 -10.426 11.764 -4.819 1.00 1.05 O ATOM 2563 CB LYS B 59 -9.765 10.129 -1.957 1.00 1.03 C ATOM 2564 CG LYS B 59 -9.309 8.980 -2.865 1.00 0.82 C ATOM 2565 CD LYS B 59 -8.852 7.757 -2.064 1.00 0.86 C ATOM 2566 CE LYS B 59 -9.930 7.000 -1.291 1.00 1.10 C ATOM 2567 NZ LYS B 59 -10.444 7.776 -0.146 1.00 1.49 N ATOM 0 H LYS B 59 -9.822 12.224 -0.699 1.00 1.09 H new ATOM 0 HA LYS B 59 -8.613 11.437 -3.199 1.00 1.05 H new ATOM 0 HB2 LYS B 59 -9.221 10.087 -1.013 1.00 1.03 H new ATOM 0 HB3 LYS B 59 -10.823 10.011 -1.721 1.00 1.03 H new ATOM 0 HG2 LYS B 59 -10.127 8.694 -3.526 1.00 0.82 H new ATOM 0 HG3 LYS B 59 -8.492 9.323 -3.500 1.00 0.82 H new ATOM 0 HD2 LYS B 59 -8.374 7.060 -2.752 1.00 0.86 H new ATOM 0 HD3 LYS B 59 -8.089 8.080 -1.356 1.00 0.86 H new ATOM 0 HE2 LYS B 59 -10.754 6.758 -1.963 1.00 1.10 H new ATOM 0 HE3 LYS B 59 -9.522 6.055 -0.933 1.00 1.10 H new ATOM 0 HZ1 LYS B 59 -11.084 7.181 0.417 1.00 1.49 H new ATOM 0 HZ2 LYS B 59 -9.649 8.087 0.448 1.00 1.49 H new ATOM 0 HZ3 LYS B 59 -10.962 8.608 -0.495 1.00 1.49 H new ATOM 2581 N MET B 60 -11.828 12.215 -3.120 1.00 1.11 N ATOM 2582 CA MET B 60 -12.970 12.556 -3.956 1.00 1.15 C ATOM 2583 C MET B 60 -12.558 13.581 -5.000 1.00 1.16 C ATOM 2584 O MET B 60 -12.786 13.344 -6.182 1.00 1.14 O ATOM 2585 CB MET B 60 -14.152 13.058 -3.112 1.00 1.26 C ATOM 2586 CG MET B 60 -15.340 13.518 -3.965 1.00 1.51 C ATOM 2587 SD MET B 60 -16.790 14.002 -2.996 1.00 2.22 S ATOM 2588 CE MET B 60 -17.901 14.495 -4.332 1.00 2.47 C ATOM 0 H MET B 60 -12.017 12.288 -2.120 1.00 1.11 H new ATOM 0 HA MET B 60 -13.306 11.655 -4.469 1.00 1.15 H new ATOM 0 HB2 MET B 60 -14.478 12.262 -2.443 1.00 1.26 H new ATOM 0 HB3 MET B 60 -13.819 13.885 -2.485 1.00 1.26 H new ATOM 0 HG2 MET B 60 -15.028 14.361 -4.581 1.00 1.51 H new ATOM 0 HG3 MET B 60 -15.621 12.713 -4.645 1.00 1.51 H new ATOM 0 HE1 MET B 60 -18.851 14.825 -3.912 1.00 2.47 H new ATOM 0 HE2 MET B 60 -17.451 15.311 -4.897 1.00 2.47 H new ATOM 0 HE3 MET B 60 -18.072 13.647 -4.995 1.00 2.47 H new ATOM 2598 N LYS B 61 -11.941 14.697 -4.591 1.00 1.21 N ATOM 2599 CA LYS B 61 -11.527 15.679 -5.592 1.00 1.23 C ATOM 2600 C LYS B 61 -10.502 15.065 -6.552 1.00 1.21 C ATOM 2601 O LYS B 61 -10.620 15.221 -7.764 1.00 1.26 O ATOM 2602 CB LYS B 61 -11.087 17.026 -4.995 1.00 1.36 C ATOM 2603 CG LYS B 61 -10.004 16.931 -3.912 1.00 1.90 C ATOM 2604 CD LYS B 61 -10.534 17.412 -2.559 1.00 1.58 C ATOM 2605 CE LYS B 61 -10.518 18.935 -2.416 1.00 2.10 C ATOM 2606 NZ LYS B 61 -11.168 19.353 -1.161 1.00 2.34 N ATOM 0 H LYS B 61 -11.727 14.933 -3.622 1.00 1.21 H new ATOM 0 HA LYS B 61 -12.409 15.937 -6.178 1.00 1.23 H new ATOM 0 HB2 LYS B 61 -10.719 17.661 -5.801 1.00 1.36 H new ATOM 0 HB3 LYS B 61 -11.961 17.522 -4.572 1.00 1.36 H new ATOM 0 HG2 LYS B 61 -9.661 15.900 -3.826 1.00 1.90 H new ATOM 0 HG3 LYS B 61 -9.141 17.531 -4.202 1.00 1.90 H new ATOM 0 HD2 LYS B 61 -11.554 17.051 -2.426 1.00 1.58 H new ATOM 0 HD3 LYS B 61 -9.934 16.972 -1.763 1.00 1.58 H new ATOM 0 HE2 LYS B 61 -9.489 19.295 -2.435 1.00 2.10 H new ATOM 0 HE3 LYS B 61 -11.030 19.389 -3.264 1.00 2.10 H new ATOM 0 HZ1 LYS B 61 -11.236 20.390 -1.134 1.00 2.34 H new ATOM 0 HZ2 LYS B 61 -12.122 18.942 -1.111 1.00 2.34 H new ATOM 0 HZ3 LYS B 61 -10.605 19.022 -0.352 1.00 2.34 H new ATOM 2620 N SER B 62 -9.519 14.330 -6.020 1.00 1.16 N ATOM 2621 CA SER B 62 -8.515 13.665 -6.849 1.00 1.17 C ATOM 2622 C SER B 62 -9.170 12.818 -7.952 1.00 1.14 C ATOM 2623 O SER B 62 -8.748 12.877 -9.106 1.00 1.23 O ATOM 2624 CB SER B 62 -7.557 12.844 -5.973 1.00 1.17 C ATOM 2625 OG SER B 62 -6.355 12.563 -6.666 1.00 1.60 O ATOM 0 H SER B 62 -9.400 14.182 -5.018 1.00 1.16 H new ATOM 0 HA SER B 62 -7.924 14.427 -7.356 1.00 1.17 H new ATOM 0 HB2 SER B 62 -7.334 13.393 -5.058 1.00 1.17 H new ATOM 0 HB3 SER B 62 -8.037 11.911 -5.677 1.00 1.17 H new ATOM 0 HG SER B 62 -5.759 12.041 -6.089 1.00 1.60 H new ATOM 2631 N LEU B 63 -10.201 12.036 -7.612 1.00 1.08 N ATOM 2632 CA LEU B 63 -10.942 11.255 -8.597 1.00 1.09 C ATOM 2633 C LEU B 63 -11.715 12.196 -9.528 1.00 1.12 C ATOM 2634 O LEU B 63 -11.541 12.136 -10.743 1.00 1.18 O ATOM 2635 CB LEU B 63 -11.868 10.220 -7.920 1.00 1.13 C ATOM 2636 CG LEU B 63 -11.195 9.005 -7.249 1.00 1.18 C ATOM 2637 CD1 LEU B 63 -9.704 9.141 -6.911 1.00 1.20 C ATOM 2638 CD2 LEU B 63 -11.939 8.697 -5.946 1.00 1.51 C ATOM 0 H LEU B 63 -10.539 11.930 -6.655 1.00 1.08 H new ATOM 0 HA LEU B 63 -10.234 10.685 -9.198 1.00 1.09 H new ATOM 0 HB2 LEU B 63 -12.459 10.738 -7.165 1.00 1.13 H new ATOM 0 HB3 LEU B 63 -12.565 9.848 -8.671 1.00 1.13 H new ATOM 0 HG LEU B 63 -11.253 8.213 -7.995 1.00 1.18 H new ATOM 0 HD11 LEU B 63 -9.351 8.221 -6.444 1.00 1.20 H new ATOM 0 HD12 LEU B 63 -9.139 9.324 -7.825 1.00 1.20 H new ATOM 0 HD13 LEU B 63 -9.561 9.975 -6.223 1.00 1.20 H new ATOM 0 HD21 LEU B 63 -11.477 7.840 -5.457 1.00 1.51 H new ATOM 0 HD22 LEU B 63 -11.889 9.562 -5.285 1.00 1.51 H new ATOM 0 HD23 LEU B 63 -12.982 8.470 -6.167 1.00 1.51 H new ATOM 2650 N ASP B 64 -12.556 13.063 -8.959 1.00 1.11 N ATOM 2651 CA ASP B 64 -13.441 13.971 -9.683 1.00 1.18 C ATOM 2652 C ASP B 64 -12.720 14.695 -10.823 1.00 1.19 C ATOM 2653 O ASP B 64 -13.212 14.713 -11.952 1.00 1.26 O ATOM 2654 CB ASP B 64 -14.040 14.973 -8.691 1.00 1.22 C ATOM 2655 CG ASP B 64 -14.998 15.938 -9.373 1.00 1.36 C ATOM 2656 OD1 ASP B 64 -16.189 15.576 -9.471 1.00 1.82 O ATOM 2657 OD2 ASP B 64 -14.522 17.029 -9.752 1.00 1.80 O ATOM 0 H ASP B 64 -12.640 13.153 -7.947 1.00 1.11 H new ATOM 0 HA ASP B 64 -14.236 13.386 -10.145 1.00 1.18 H new ATOM 0 HB2 ASP B 64 -14.566 14.434 -7.903 1.00 1.22 H new ATOM 0 HB3 ASP B 64 -13.238 15.535 -8.212 1.00 1.22 H new ATOM 2662 N VAL B 65 -11.541 15.257 -10.522 1.00 1.16 N ATOM 2663 CA VAL B 65 -10.752 16.064 -11.452 1.00 1.20 C ATOM 2664 C VAL B 65 -10.600 15.361 -12.796 1.00 1.25 C ATOM 2665 O VAL B 65 -11.089 15.844 -13.814 1.00 1.29 O ATOM 2666 CB VAL B 65 -9.374 16.376 -10.837 1.00 1.24 C ATOM 2667 CG1 VAL B 65 -8.362 16.944 -11.845 1.00 1.64 C ATOM 2668 CG2 VAL B 65 -9.540 17.412 -9.732 1.00 1.69 C ATOM 0 H VAL B 65 -11.104 15.159 -9.606 1.00 1.16 H new ATOM 0 HA VAL B 65 -11.278 17.002 -11.629 1.00 1.20 H new ATOM 0 HB VAL B 65 -8.987 15.426 -10.467 1.00 1.24 H new ATOM 0 HG11 VAL B 65 -7.416 17.139 -11.340 1.00 1.64 H new ATOM 0 HG12 VAL B 65 -8.203 16.223 -12.647 1.00 1.64 H new ATOM 0 HG13 VAL B 65 -8.748 17.873 -12.264 1.00 1.64 H new ATOM 0 HG21 VAL B 65 -8.567 17.636 -9.294 1.00 1.69 H new ATOM 0 HG22 VAL B 65 -9.968 18.323 -10.149 1.00 1.69 H new ATOM 0 HG23 VAL B 65 -10.203 17.019 -8.961 1.00 1.69 H new ATOM 2678 N ASN B 66 -9.869 14.245 -12.796 1.00 1.31 N ATOM 2679 CA ASN B 66 -9.606 13.484 -14.015 1.00 1.40 C ATOM 2680 C ASN B 66 -9.374 12.013 -13.697 1.00 1.57 C ATOM 2681 O ASN B 66 -8.357 11.426 -14.077 1.00 1.66 O ATOM 2682 CB ASN B 66 -8.429 14.071 -14.819 1.00 1.40 C ATOM 2683 CG ASN B 66 -8.790 15.329 -15.601 1.00 1.58 C ATOM 2684 OD1 ASN B 66 -8.207 16.388 -15.389 1.00 2.90 O ATOM 2685 ND2 ASN B 66 -9.725 15.220 -16.544 1.00 1.88 N ATOM 0 H ASN B 66 -9.446 13.847 -11.957 1.00 1.31 H new ATOM 0 HA ASN B 66 -10.493 13.562 -14.644 1.00 1.40 H new ATOM 0 HB2 ASN B 66 -7.612 14.301 -14.135 1.00 1.40 H new ATOM 0 HB3 ASN B 66 -8.061 13.315 -15.513 1.00 1.40 H new ATOM 0 HD21 ASN B 66 -9.973 16.030 -17.112 1.00 1.88 H new ATOM 0 HD22 ASN B 66 -10.193 14.327 -16.698 1.00 1.88 H new ATOM 2692 N GLN B 67 -10.374 11.385 -13.078 1.00 1.62 N ATOM 2693 CA GLN B 67 -10.446 9.940 -12.927 1.00 1.58 C ATOM 2694 C GLN B 67 -10.092 9.203 -14.219 1.00 1.73 C ATOM 2695 O GLN B 67 -9.538 8.100 -14.224 1.00 1.84 O ATOM 2696 CB GLN B 67 -11.858 9.498 -12.521 1.00 1.50 C ATOM 2697 CG GLN B 67 -13.024 10.012 -13.399 1.00 1.60 C ATOM 2698 CD GLN B 67 -13.544 11.352 -12.907 1.00 2.42 C ATOM 2699 OE1 GLN B 67 -14.247 11.381 -11.899 1.00 3.20 O ATOM 2700 NE2 GLN B 67 -13.192 12.435 -13.594 1.00 3.28 N ATOM 0 H GLN B 67 -11.166 11.877 -12.663 1.00 1.62 H new ATOM 0 HA GLN B 67 -9.722 9.687 -12.152 1.00 1.58 H new ATOM 0 HB2 GLN B 67 -11.887 8.408 -12.520 1.00 1.50 H new ATOM 0 HB3 GLN B 67 -12.035 9.822 -11.496 1.00 1.50 H new ATOM 0 HG2 GLN B 67 -12.688 10.108 -14.432 1.00 1.60 H new ATOM 0 HG3 GLN B 67 -13.834 9.282 -13.394 1.00 1.60 H new ATOM 0 HE21 GLN B 67 -12.606 12.344 -14.424 1.00 3.28 H new ATOM 0 HE22 GLN B 67 -13.508 13.356 -13.291 1.00 3.28 H new ATOM 2709 N ASP B 68 -10.476 9.840 -15.319 1.00 1.80 N ATOM 2710 CA ASP B 68 -10.428 9.370 -16.678 1.00 1.85 C ATOM 2711 C ASP B 68 -8.996 8.960 -17.046 1.00 1.90 C ATOM 2712 O ASP B 68 -8.789 8.150 -17.946 1.00 2.06 O ATOM 2713 CB ASP B 68 -10.918 10.511 -17.592 1.00 1.99 C ATOM 2714 CG ASP B 68 -12.143 11.254 -17.057 1.00 2.90 C ATOM 2715 OD1 ASP B 68 -11.983 11.906 -15.993 1.00 4.51 O ATOM 2716 OD2 ASP B 68 -13.210 11.136 -17.690 1.00 3.12 O ATOM 0 H ASP B 68 -10.862 10.783 -15.266 1.00 1.80 H new ATOM 0 HA ASP B 68 -11.066 8.494 -16.801 1.00 1.85 H new ATOM 0 HB2 ASP B 68 -10.106 11.224 -17.733 1.00 1.99 H new ATOM 0 HB3 ASP B 68 -11.155 10.100 -18.573 1.00 1.99 H new ATOM 2721 N SER B 69 -8.005 9.510 -16.329 1.00 1.85 N ATOM 2722 CA SER B 69 -6.591 9.186 -16.468 1.00 1.94 C ATOM 2723 C SER B 69 -6.301 7.697 -16.280 1.00 1.81 C ATOM 2724 O SER B 69 -5.261 7.222 -16.744 1.00 3.27 O ATOM 2725 CB SER B 69 -5.794 10.048 -15.479 1.00 1.99 C ATOM 2726 OG SER B 69 -4.406 9.998 -15.746 1.00 2.75 O ATOM 0 H SER B 69 -8.180 10.216 -15.614 1.00 1.85 H new ATOM 0 HA SER B 69 -6.282 9.411 -17.489 1.00 1.94 H new ATOM 0 HB2 SER B 69 -6.139 11.080 -15.535 1.00 1.99 H new ATOM 0 HB3 SER B 69 -5.982 9.704 -14.462 1.00 1.99 H new ATOM 0 HG SER B 69 -3.928 10.558 -15.100 1.00 2.75 H new ATOM 2732 N GLU B 70 -7.220 6.963 -15.640 1.00 1.29 N ATOM 2733 CA GLU B 70 -7.143 5.521 -15.482 1.00 1.09 C ATOM 2734 C GLU B 70 -6.043 5.164 -14.476 1.00 0.99 C ATOM 2735 O GLU B 70 -4.970 5.763 -14.461 1.00 1.40 O ATOM 2736 CB GLU B 70 -7.064 4.821 -16.855 1.00 1.59 C ATOM 2737 CG GLU B 70 -6.512 3.397 -16.816 1.00 1.90 C ATOM 2738 CD GLU B 70 -5.993 2.988 -18.180 1.00 2.10 C ATOM 2739 OE1 GLU B 70 -4.841 3.381 -18.481 1.00 2.80 O ATOM 2740 OE2 GLU B 70 -6.732 2.305 -18.920 1.00 2.85 O ATOM 0 H GLU B 70 -8.051 7.371 -15.212 1.00 1.29 H new ATOM 0 HA GLU B 70 -8.060 5.129 -15.043 1.00 1.09 H new ATOM 0 HB2 GLU B 70 -8.062 4.797 -17.293 1.00 1.59 H new ATOM 0 HB3 GLU B 70 -6.439 5.420 -17.517 1.00 1.59 H new ATOM 0 HG2 GLU B 70 -5.709 3.332 -16.081 1.00 1.90 H new ATOM 0 HG3 GLU B 70 -7.293 2.707 -16.496 1.00 1.90 H new ATOM 2747 N LEU B 71 -6.324 4.185 -13.625 1.00 1.14 N ATOM 2748 CA LEU B 71 -5.618 3.930 -12.383 1.00 1.40 C ATOM 2749 C LEU B 71 -4.367 3.090 -12.669 1.00 1.32 C ATOM 2750 O LEU B 71 -4.345 2.299 -13.611 1.00 1.29 O ATOM 2751 CB LEU B 71 -6.645 3.251 -11.455 1.00 1.74 C ATOM 2752 CG LEU B 71 -6.507 3.353 -9.926 1.00 1.70 C ATOM 2753 CD1 LEU B 71 -6.177 1.980 -9.347 1.00 2.86 C ATOM 2754 CD2 LEU B 71 -5.542 4.412 -9.388 1.00 2.20 C ATOM 0 H LEU B 71 -7.081 3.522 -13.791 1.00 1.14 H new ATOM 0 HA LEU B 71 -5.245 4.830 -11.895 1.00 1.40 H new ATOM 0 HB2 LEU B 71 -7.626 3.648 -11.716 1.00 1.74 H new ATOM 0 HB3 LEU B 71 -6.653 2.190 -11.707 1.00 1.74 H new ATOM 0 HG LEU B 71 -7.481 3.706 -9.588 1.00 1.70 H new ATOM 0 HD11 LEU B 71 -6.080 2.056 -8.264 1.00 2.86 H new ATOM 0 HD12 LEU B 71 -6.976 1.280 -9.592 1.00 2.86 H new ATOM 0 HD13 LEU B 71 -5.239 1.622 -9.771 1.00 2.86 H new ATOM 0 HD21 LEU B 71 -5.537 4.380 -8.298 1.00 2.20 H new ATOM 0 HD22 LEU B 71 -4.538 4.212 -9.761 1.00 2.20 H new ATOM 0 HD23 LEU B 71 -5.863 5.399 -9.721 1.00 2.20 H new ATOM 2766 N LYS B 72 -3.307 3.307 -11.889 1.00 1.31 N ATOM 2767 CA LYS B 72 -2.044 2.591 -11.941 1.00 1.26 C ATOM 2768 C LYS B 72 -1.554 2.428 -10.502 1.00 1.03 C ATOM 2769 O LYS B 72 -2.005 3.162 -9.619 1.00 0.83 O ATOM 2770 CB LYS B 72 -1.004 3.351 -12.788 1.00 1.36 C ATOM 2771 CG LYS B 72 -1.278 3.262 -14.297 1.00 1.77 C ATOM 2772 CD LYS B 72 -2.063 4.452 -14.866 1.00 2.31 C ATOM 2773 CE LYS B 72 -2.753 4.011 -16.169 1.00 3.28 C ATOM 2774 NZ LYS B 72 -3.629 5.042 -16.763 1.00 4.03 N ATOM 0 H LYS B 72 -3.313 4.027 -11.167 1.00 1.31 H new ATOM 0 HA LYS B 72 -2.183 1.619 -12.414 1.00 1.26 H new ATOM 0 HB2 LYS B 72 -0.994 4.399 -12.487 1.00 1.36 H new ATOM 0 HB3 LYS B 72 -0.012 2.951 -12.580 1.00 1.36 H new ATOM 0 HG2 LYS B 72 -0.327 3.184 -14.823 1.00 1.77 H new ATOM 0 HG3 LYS B 72 -1.831 2.345 -14.501 1.00 1.77 H new ATOM 0 HD2 LYS B 72 -2.804 4.796 -14.144 1.00 2.31 H new ATOM 0 HD3 LYS B 72 -1.393 5.290 -15.058 1.00 2.31 H new ATOM 0 HE2 LYS B 72 -1.990 3.734 -16.896 1.00 3.28 H new ATOM 0 HE3 LYS B 72 -3.344 3.117 -15.971 1.00 3.28 H new ATOM 0 HZ1 LYS B 72 -4.269 4.598 -17.452 1.00 4.03 H new ATOM 0 HZ2 LYS B 72 -4.188 5.496 -16.013 1.00 4.03 H new ATOM 0 HZ3 LYS B 72 -3.047 5.758 -17.242 1.00 4.03 H new ATOM 2788 N PHE B 73 -0.647 1.473 -10.268 1.00 1.08 N ATOM 2789 CA PHE B 73 -0.145 1.114 -8.939 1.00 0.89 C ATOM 2790 C PHE B 73 0.233 2.333 -8.094 1.00 0.62 C ATOM 2791 O PHE B 73 -0.163 2.431 -6.937 1.00 0.53 O ATOM 2792 CB PHE B 73 0.992 0.083 -9.019 1.00 1.10 C ATOM 2793 CG PHE B 73 1.954 0.251 -10.179 1.00 0.80 C ATOM 2794 CD1 PHE B 73 1.675 -0.385 -11.402 1.00 1.98 C ATOM 2795 CD2 PHE B 73 3.127 1.016 -10.043 1.00 2.00 C ATOM 2796 CE1 PHE B 73 2.525 -0.208 -12.504 1.00 2.43 C ATOM 2797 CE2 PHE B 73 3.994 1.165 -11.141 1.00 2.55 C ATOM 2798 CZ PHE B 73 3.687 0.569 -12.375 1.00 2.27 C ATOM 0 H PHE B 73 -0.233 0.916 -11.015 1.00 1.08 H new ATOM 0 HA PHE B 73 -0.974 0.637 -8.415 1.00 0.89 H new ATOM 0 HB2 PHE B 73 1.561 0.125 -8.090 1.00 1.10 H new ATOM 0 HB3 PHE B 73 0.551 -0.912 -9.078 1.00 1.10 H new ATOM 0 HD1 PHE B 73 0.801 -1.013 -11.493 1.00 1.98 H new ATOM 0 HD2 PHE B 73 3.361 1.487 -9.100 1.00 2.00 H new ATOM 0 HE1 PHE B 73 2.286 -0.669 -13.451 1.00 2.43 H new ATOM 0 HE2 PHE B 73 4.901 1.741 -11.034 1.00 2.55 H new ATOM 0 HZ PHE B 73 4.343 0.708 -13.222 1.00 2.27 H new ATOM 2808 N ASN B 74 0.993 3.263 -8.669 1.00 0.76 N ATOM 2809 CA ASN B 74 1.401 4.491 -7.988 1.00 0.84 C ATOM 2810 C ASN B 74 0.209 5.220 -7.341 1.00 0.65 C ATOM 2811 O ASN B 74 0.178 5.371 -6.122 1.00 0.69 O ATOM 2812 CB ASN B 74 2.195 5.390 -8.948 1.00 1.29 C ATOM 2813 CG ASN B 74 1.527 5.512 -10.316 1.00 2.96 C ATOM 2814 OD1 ASN B 74 0.573 6.261 -10.486 1.00 4.05 O ATOM 2815 ND2 ASN B 74 1.987 4.735 -11.295 1.00 4.34 N ATOM 0 H ASN B 74 1.345 3.186 -9.623 1.00 0.76 H new ATOM 0 HA ASN B 74 2.061 4.222 -7.163 1.00 0.84 H new ATOM 0 HB2 ASN B 74 2.301 6.382 -8.509 1.00 1.29 H new ATOM 0 HB3 ASN B 74 3.200 4.987 -9.072 1.00 1.29 H new ATOM 0 HD21 ASN B 74 1.543 4.755 -12.213 1.00 4.34 H new ATOM 0 HD22 ASN B 74 2.783 4.120 -11.127 1.00 4.34 H new ATOM 2822 N GLU B 75 -0.782 5.651 -8.128 1.00 0.60 N ATOM 2823 CA GLU B 75 -1.964 6.331 -7.608 1.00 0.59 C ATOM 2824 C GLU B 75 -2.794 5.410 -6.714 1.00 0.59 C ATOM 2825 O GLU B 75 -3.197 5.819 -5.623 1.00 0.70 O ATOM 2826 CB GLU B 75 -2.813 6.880 -8.765 1.00 0.82 C ATOM 2827 CG GLU B 75 -2.289 8.246 -9.228 1.00 1.35 C ATOM 2828 CD GLU B 75 -2.553 9.318 -8.177 1.00 3.19 C ATOM 2829 OE1 GLU B 75 -3.742 9.548 -7.882 1.00 4.48 O ATOM 2830 OE2 GLU B 75 -1.552 9.859 -7.652 1.00 3.99 O ATOM 0 H GLU B 75 -0.784 5.537 -9.142 1.00 0.60 H new ATOM 0 HA GLU B 75 -1.629 7.166 -6.992 1.00 0.59 H new ATOM 0 HB2 GLU B 75 -2.796 6.178 -9.599 1.00 0.82 H new ATOM 0 HB3 GLU B 75 -3.851 6.973 -8.447 1.00 0.82 H new ATOM 0 HG2 GLU B 75 -1.219 8.181 -9.425 1.00 1.35 H new ATOM 0 HG3 GLU B 75 -2.770 8.525 -10.166 1.00 1.35 H new ATOM 2837 N TYR B 76 -3.048 4.175 -7.175 1.00 0.57 N ATOM 2838 CA TYR B 76 -3.744 3.146 -6.405 1.00 0.65 C ATOM 2839 C TYR B 76 -3.271 3.207 -4.964 1.00 0.58 C ATOM 2840 O TYR B 76 -4.082 3.341 -4.051 1.00 0.58 O ATOM 2841 CB TYR B 76 -3.448 1.756 -6.985 1.00 0.79 C ATOM 2842 CG TYR B 76 -3.730 0.587 -6.057 1.00 1.18 C ATOM 2843 CD1 TYR B 76 -2.722 0.128 -5.185 1.00 2.86 C ATOM 2844 CD2 TYR B 76 -4.935 -0.130 -6.156 1.00 2.04 C ATOM 2845 CE1 TYR B 76 -2.967 -0.951 -4.325 1.00 3.23 C ATOM 2846 CE2 TYR B 76 -5.160 -1.247 -5.332 1.00 2.21 C ATOM 2847 CZ TYR B 76 -4.177 -1.654 -4.414 1.00 2.08 C ATOM 2848 OH TYR B 76 -4.372 -2.759 -3.644 1.00 2.53 O ATOM 0 H TYR B 76 -2.770 3.865 -8.106 1.00 0.57 H new ATOM 0 HA TYR B 76 -4.818 3.323 -6.454 1.00 0.65 H new ATOM 0 HB2 TYR B 76 -4.037 1.627 -7.893 1.00 0.79 H new ATOM 0 HB3 TYR B 76 -2.399 1.720 -7.278 1.00 0.79 H new ATOM 0 HD1 TYR B 76 -1.756 0.610 -5.180 1.00 2.86 H new ATOM 0 HD2 TYR B 76 -5.689 0.177 -6.866 1.00 2.04 H new ATOM 0 HE1 TYR B 76 -2.225 -1.240 -3.595 1.00 3.23 H new ATOM 0 HE2 TYR B 76 -6.089 -1.793 -5.405 1.00 2.21 H new ATOM 0 HH TYR B 76 -5.148 -2.619 -3.062 1.00 2.53 H new ATOM 2858 N TRP B 77 -1.952 3.126 -4.789 1.00 0.54 N ATOM 2859 CA TRP B 77 -1.325 3.176 -3.488 1.00 0.50 C ATOM 2860 C TRP B 77 -1.876 4.324 -2.648 1.00 0.46 C ATOM 2861 O TRP B 77 -2.661 4.076 -1.737 1.00 0.48 O ATOM 2862 CB TRP B 77 0.197 3.220 -3.624 1.00 0.52 C ATOM 2863 CG TRP B 77 0.841 2.071 -2.956 1.00 0.43 C ATOM 2864 CD1 TRP B 77 1.273 2.102 -1.688 1.00 0.48 C ATOM 2865 CD2 TRP B 77 1.191 0.756 -3.472 1.00 0.40 C ATOM 2866 NE1 TRP B 77 1.784 0.884 -1.347 1.00 0.48 N ATOM 2867 CE2 TRP B 77 1.791 0.022 -2.412 1.00 0.44 C ATOM 2868 CE3 TRP B 77 1.135 0.127 -4.730 1.00 0.47 C ATOM 2869 CZ2 TRP B 77 2.276 -1.274 -2.578 1.00 0.54 C ATOM 2870 CZ3 TRP B 77 1.681 -1.154 -4.907 1.00 0.55 C ATOM 2871 CH2 TRP B 77 2.190 -1.877 -3.834 1.00 0.61 C ATOM 0 H TRP B 77 -1.291 3.023 -5.559 1.00 0.54 H new ATOM 0 HA TRP B 77 -1.571 2.260 -2.950 1.00 0.50 H new ATOM 0 HB2 TRP B 77 0.468 3.225 -4.680 1.00 0.52 H new ATOM 0 HB3 TRP B 77 0.574 4.148 -3.194 1.00 0.52 H new ATOM 0 HD1 TRP B 77 1.224 2.961 -1.035 1.00 0.48 H new ATOM 0 HE1 TRP B 77 2.120 0.644 -0.414 1.00 0.48 H new ATOM 0 HE3 TRP B 77 0.670 0.633 -5.563 1.00 0.47 H new ATOM 0 HZ2 TRP B 77 2.713 -1.805 -1.745 1.00 0.54 H new ATOM 0 HZ3 TRP B 77 1.706 -1.587 -5.896 1.00 0.55 H new ATOM 0 HH2 TRP B 77 2.516 -2.897 -3.971 1.00 0.61 H new ATOM 2882 N ARG B 78 -1.466 5.561 -2.939 1.00 0.46 N ATOM 2883 CA ARG B 78 -1.925 6.754 -2.243 1.00 0.50 C ATOM 2884 C ARG B 78 -3.424 6.654 -1.905 1.00 0.52 C ATOM 2885 O ARG B 78 -3.804 6.808 -0.745 1.00 0.56 O ATOM 2886 CB ARG B 78 -1.670 7.990 -3.130 1.00 0.66 C ATOM 2887 CG ARG B 78 -0.301 7.946 -3.834 1.00 1.21 C ATOM 2888 CD ARG B 78 0.240 9.328 -4.218 1.00 1.33 C ATOM 2889 NE ARG B 78 0.188 9.560 -5.675 1.00 2.18 N ATOM 2890 CZ ARG B 78 1.230 9.871 -6.463 1.00 3.30 C ATOM 2891 NH1 ARG B 78 2.482 9.687 -6.046 1.00 3.92 N ATOM 2892 NH2 ARG B 78 0.988 10.368 -7.676 1.00 4.38 N ATOM 0 H ARG B 78 -0.793 5.759 -3.680 1.00 0.46 H new ATOM 0 HA ARG B 78 -1.372 6.847 -1.308 1.00 0.50 H new ATOM 0 HB2 ARG B 78 -2.457 8.062 -3.880 1.00 0.66 H new ATOM 0 HB3 ARG B 78 -1.730 8.890 -2.518 1.00 0.66 H new ATOM 0 HG2 ARG B 78 0.418 7.453 -3.180 1.00 1.21 H new ATOM 0 HG3 ARG B 78 -0.384 7.336 -4.733 1.00 1.21 H new ATOM 0 HD2 ARG B 78 -0.339 10.098 -3.708 1.00 1.33 H new ATOM 0 HD3 ARG B 78 1.270 9.422 -3.873 1.00 1.33 H new ATOM 0 HE ARG B 78 -0.724 9.476 -6.125 1.00 2.18 H new ATOM 0 HH11 ARG B 78 2.659 9.305 -5.117 1.00 3.92 H new ATOM 0 HH12 ARG B 78 3.263 9.928 -6.656 1.00 3.92 H new ATOM 0 HH21 ARG B 78 0.027 10.505 -7.989 1.00 4.38 H new ATOM 0 HH22 ARG B 78 1.764 10.611 -8.292 1.00 4.38 H new ATOM 2906 N LEU B 79 -4.261 6.338 -2.903 1.00 0.50 N ATOM 2907 CA LEU B 79 -5.707 6.227 -2.725 1.00 0.53 C ATOM 2908 C LEU B 79 -6.086 5.193 -1.653 1.00 0.50 C ATOM 2909 O LEU B 79 -6.838 5.516 -0.730 1.00 0.52 O ATOM 2910 CB LEU B 79 -6.399 5.915 -4.064 1.00 0.63 C ATOM 2911 CG LEU B 79 -6.655 7.127 -4.989 1.00 0.87 C ATOM 2912 CD1 LEU B 79 -5.552 8.193 -5.021 1.00 1.11 C ATOM 2913 CD2 LEU B 79 -6.889 6.619 -6.415 1.00 1.30 C ATOM 0 H LEU B 79 -3.949 6.153 -3.856 1.00 0.50 H new ATOM 0 HA LEU B 79 -6.062 7.194 -2.369 1.00 0.53 H new ATOM 0 HB2 LEU B 79 -5.790 5.191 -4.606 1.00 0.63 H new ATOM 0 HB3 LEU B 79 -7.354 5.434 -3.854 1.00 0.63 H new ATOM 0 HG LEU B 79 -7.527 7.628 -4.568 1.00 0.87 H new ATOM 0 HD11 LEU B 79 -5.840 8.994 -5.702 1.00 1.11 H new ATOM 0 HD12 LEU B 79 -5.411 8.601 -4.020 1.00 1.11 H new ATOM 0 HD13 LEU B 79 -4.620 7.743 -5.364 1.00 1.11 H new ATOM 0 HD21 LEU B 79 -7.071 7.465 -7.077 1.00 1.30 H new ATOM 0 HD22 LEU B 79 -6.009 6.074 -6.756 1.00 1.30 H new ATOM 0 HD23 LEU B 79 -7.754 5.956 -6.428 1.00 1.30 H new ATOM 2925 N ILE B 80 -5.617 3.942 -1.742 1.00 0.48 N ATOM 2926 CA ILE B 80 -5.957 2.969 -0.702 1.00 0.48 C ATOM 2927 C ILE B 80 -5.313 3.355 0.634 1.00 0.46 C ATOM 2928 O ILE B 80 -5.846 3.031 1.689 1.00 0.46 O ATOM 2929 CB ILE B 80 -5.688 1.504 -1.093 1.00 0.49 C ATOM 2930 CG1 ILE B 80 -4.215 1.124 -0.931 1.00 0.54 C ATOM 2931 CG2 ILE B 80 -6.165 1.221 -2.509 1.00 0.58 C ATOM 2932 CD1 ILE B 80 -3.915 -0.366 -1.067 1.00 0.44 C ATOM 0 H ILE B 80 -5.024 3.591 -2.494 1.00 0.48 H new ATOM 0 HA ILE B 80 -7.039 3.015 -0.581 1.00 0.48 H new ATOM 0 HB ILE B 80 -6.260 0.881 -0.405 1.00 0.49 H new ATOM 0 HG12 ILE B 80 -3.631 1.666 -1.675 1.00 0.54 H new ATOM 0 HG13 ILE B 80 -3.874 1.460 0.048 1.00 0.54 H new ATOM 0 HG21 ILE B 80 -5.963 0.180 -2.760 1.00 0.58 H new ATOM 0 HG22 ILE B 80 -7.237 1.409 -2.576 1.00 0.58 H new ATOM 0 HG23 ILE B 80 -5.638 1.871 -3.207 1.00 0.58 H new ATOM 0 HD11 ILE B 80 -2.846 -0.535 -0.937 1.00 0.44 H new ATOM 0 HD12 ILE B 80 -4.465 -0.919 -0.306 1.00 0.44 H new ATOM 0 HD13 ILE B 80 -4.219 -0.710 -2.056 1.00 0.44 H new ATOM 2944 N GLY B 81 -4.166 4.035 0.601 1.00 0.46 N ATOM 2945 CA GLY B 81 -3.514 4.574 1.782 1.00 0.49 C ATOM 2946 C GLY B 81 -4.453 5.509 2.525 1.00 0.50 C ATOM 2947 O GLY B 81 -4.620 5.429 3.740 1.00 0.56 O ATOM 0 H GLY B 81 -3.661 4.227 -0.264 1.00 0.46 H new ATOM 0 HA2 GLY B 81 -3.206 3.760 2.439 1.00 0.49 H new ATOM 0 HA3 GLY B 81 -2.610 5.110 1.493 1.00 0.49 H new ATOM 2951 N GLU B 82 -5.069 6.420 1.779 1.00 0.50 N ATOM 2952 CA GLU B 82 -6.124 7.261 2.300 1.00 0.54 C ATOM 2953 C GLU B 82 -7.293 6.421 2.820 1.00 0.53 C ATOM 2954 O GLU B 82 -7.734 6.625 3.951 1.00 0.58 O ATOM 2955 CB GLU B 82 -6.559 8.216 1.203 1.00 0.61 C ATOM 2956 CG GLU B 82 -5.500 9.286 0.946 1.00 0.68 C ATOM 2957 CD GLU B 82 -6.171 10.519 0.387 1.00 1.78 C ATOM 2958 OE1 GLU B 82 -6.534 10.482 -0.808 1.00 2.46 O ATOM 2959 OE2 GLU B 82 -6.360 11.436 1.209 1.00 3.04 O ATOM 0 H GLU B 82 -4.846 6.591 0.798 1.00 0.50 H new ATOM 0 HA GLU B 82 -5.757 7.835 3.151 1.00 0.54 H new ATOM 0 HB2 GLU B 82 -6.745 7.658 0.285 1.00 0.61 H new ATOM 0 HB3 GLU B 82 -7.499 8.692 1.484 1.00 0.61 H new ATOM 0 HG2 GLU B 82 -4.978 9.529 1.871 1.00 0.68 H new ATOM 0 HG3 GLU B 82 -4.752 8.915 0.246 1.00 0.68 H new ATOM 2966 N LEU B 83 -7.758 5.441 2.038 1.00 0.50 N ATOM 2967 CA LEU B 83 -8.797 4.520 2.478 1.00 0.51 C ATOM 2968 C LEU B 83 -8.436 3.933 3.859 1.00 0.52 C ATOM 2969 O LEU B 83 -9.273 3.899 4.766 1.00 0.57 O ATOM 2970 CB LEU B 83 -9.049 3.458 1.393 1.00 0.55 C ATOM 2971 CG LEU B 83 -10.496 2.950 1.288 1.00 1.12 C ATOM 2972 CD1 LEU B 83 -11.060 2.566 2.652 1.00 2.60 C ATOM 2973 CD2 LEU B 83 -11.427 3.958 0.604 1.00 2.23 C ATOM 0 H LEU B 83 -7.424 5.269 1.090 1.00 0.50 H new ATOM 0 HA LEU B 83 -9.741 5.048 2.613 1.00 0.51 H new ATOM 0 HB2 LEU B 83 -8.757 3.873 0.428 1.00 0.55 H new ATOM 0 HB3 LEU B 83 -8.396 2.606 1.584 1.00 0.55 H new ATOM 0 HG LEU B 83 -10.453 2.058 0.662 1.00 1.12 H new ATOM 0 HD11 LEU B 83 -12.084 2.212 2.536 1.00 2.60 H new ATOM 0 HD12 LEU B 83 -10.450 1.775 3.088 1.00 2.60 H new ATOM 0 HD13 LEU B 83 -11.049 3.436 3.308 1.00 2.60 H new ATOM 0 HD21 LEU B 83 -12.436 3.548 0.557 1.00 2.23 H new ATOM 0 HD22 LEU B 83 -11.439 4.887 1.174 1.00 2.23 H new ATOM 0 HD23 LEU B 83 -11.069 4.157 -0.406 1.00 2.23 H new ATOM 2985 N ALA B 84 -7.174 3.524 4.063 1.00 0.51 N ATOM 2986 CA ALA B 84 -6.694 3.096 5.366 1.00 0.57 C ATOM 2987 C ALA B 84 -6.913 4.129 6.489 1.00 0.64 C ATOM 2988 O ALA B 84 -7.195 3.700 7.611 1.00 0.74 O ATOM 2989 CB ALA B 84 -5.236 2.629 5.292 1.00 0.58 C ATOM 0 H ALA B 84 -6.469 3.484 3.327 1.00 0.51 H new ATOM 0 HA ALA B 84 -7.313 2.243 5.646 1.00 0.57 H new ATOM 0 HB1 ALA B 84 -4.904 2.315 6.281 1.00 0.58 H new ATOM 0 HB2 ALA B 84 -5.157 1.791 4.600 1.00 0.58 H new ATOM 0 HB3 ALA B 84 -4.609 3.449 4.942 1.00 0.58 H new ATOM 2995 N LYS B 85 -6.794 5.443 6.223 1.00 0.68 N ATOM 2996 CA LYS B 85 -7.184 6.481 7.185 1.00 0.82 C ATOM 2997 C LYS B 85 -8.695 6.392 7.425 1.00 0.87 C ATOM 2998 O LYS B 85 -9.143 6.244 8.560 1.00 1.14 O ATOM 2999 CB LYS B 85 -6.932 7.928 6.700 1.00 1.11 C ATOM 3000 CG LYS B 85 -5.536 8.429 6.302 1.00 1.23 C ATOM 3001 CD LYS B 85 -5.807 9.809 5.658 1.00 1.34 C ATOM 3002 CE LYS B 85 -4.625 10.717 5.271 1.00 2.15 C ATOM 3003 NZ LYS B 85 -5.069 12.086 4.895 1.00 2.70 N ATOM 0 H LYS B 85 -6.428 5.809 5.344 1.00 0.68 H new ATOM 0 HA LYS B 85 -6.576 6.295 8.071 1.00 0.82 H new ATOM 0 HB2 LYS B 85 -7.579 8.086 5.837 1.00 1.11 H new ATOM 0 HB3 LYS B 85 -7.288 8.589 7.490 1.00 1.11 H new ATOM 0 HG2 LYS B 85 -4.880 8.514 7.168 1.00 1.23 H new ATOM 0 HG3 LYS B 85 -5.052 7.749 5.601 1.00 1.23 H new ATOM 0 HD2 LYS B 85 -6.394 9.637 4.756 1.00 1.34 H new ATOM 0 HD3 LYS B 85 -6.437 10.371 6.347 1.00 1.34 H new ATOM 0 HE2 LYS B 85 -3.928 10.779 6.107 1.00 2.15 H new ATOM 0 HE3 LYS B 85 -4.084 10.270 4.437 1.00 2.15 H new ATOM 0 HZ1 LYS B 85 -4.285 12.592 4.436 1.00 2.70 H new ATOM 0 HZ2 LYS B 85 -5.872 12.022 4.237 1.00 2.70 H new ATOM 0 HZ3 LYS B 85 -5.362 12.603 5.749 1.00 2.70 H new ATOM 3017 N GLU B 86 -9.460 6.561 6.340 1.00 0.75 N ATOM 3018 CA GLU B 86 -10.913 6.649 6.315 1.00 0.78 C ATOM 3019 C GLU B 86 -11.518 5.525 7.151 1.00 0.80 C ATOM 3020 O GLU B 86 -11.997 5.769 8.263 1.00 0.95 O ATOM 3021 CB GLU B 86 -11.356 6.591 4.850 1.00 0.76 C ATOM 3022 CG GLU B 86 -11.214 7.973 4.197 1.00 1.01 C ATOM 3023 CD GLU B 86 -10.944 7.862 2.712 1.00 1.36 C ATOM 3024 OE1 GLU B 86 -11.835 7.403 1.964 1.00 2.13 O ATOM 3025 OE2 GLU B 86 -9.829 8.231 2.283 1.00 2.35 O ATOM 0 H GLU B 86 -9.053 6.644 5.408 1.00 0.75 H new ATOM 0 HA GLU B 86 -11.263 7.584 6.753 1.00 0.78 H new ATOM 0 HB2 GLU B 86 -10.753 5.862 4.309 1.00 0.76 H new ATOM 0 HB3 GLU B 86 -12.392 6.257 4.789 1.00 0.76 H new ATOM 0 HG2 GLU B 86 -12.125 8.548 4.360 1.00 1.01 H new ATOM 0 HG3 GLU B 86 -10.402 8.520 4.675 1.00 1.01 H new ATOM 3032 N ILE B 87 -11.505 4.295 6.640 1.00 0.73 N ATOM 3033 CA ILE B 87 -12.058 3.172 7.379 1.00 0.78 C ATOM 3034 C ILE B 87 -10.972 2.713 8.354 1.00 0.84 C ATOM 3035 O ILE B 87 -10.016 2.030 7.980 1.00 0.92 O ATOM 3036 CB ILE B 87 -12.651 2.120 6.417 1.00 0.84 C ATOM 3037 CG1 ILE B 87 -13.840 1.358 7.031 1.00 1.19 C ATOM 3038 CG2 ILE B 87 -11.640 1.145 5.805 1.00 1.11 C ATOM 3039 CD1 ILE B 87 -13.556 0.689 8.380 1.00 1.64 C ATOM 0 H ILE B 87 -11.121 4.056 5.726 1.00 0.73 H new ATOM 0 HA ILE B 87 -12.926 3.429 7.986 1.00 0.78 H new ATOM 0 HB ILE B 87 -13.015 2.722 5.584 1.00 0.84 H new ATOM 0 HG12 ILE B 87 -14.671 2.052 7.155 1.00 1.19 H new ATOM 0 HG13 ILE B 87 -14.165 0.594 6.325 1.00 1.19 H new ATOM 0 HG21 ILE B 87 -12.159 0.449 5.146 1.00 1.11 H new ATOM 0 HG22 ILE B 87 -10.898 1.702 5.233 1.00 1.11 H new ATOM 0 HG23 ILE B 87 -11.143 0.590 6.600 1.00 1.11 H new ATOM 0 HD11 ILE B 87 -14.454 0.179 8.729 1.00 1.64 H new ATOM 0 HD12 ILE B 87 -12.749 -0.035 8.265 1.00 1.64 H new ATOM 0 HD13 ILE B 87 -13.263 1.446 9.107 1.00 1.64 H new ATOM 3051 N ARG B 88 -11.064 3.146 9.616 1.00 1.04 N ATOM 3052 CA ARG B 88 -10.004 2.957 10.602 1.00 1.27 C ATOM 3053 C ARG B 88 -10.090 1.551 11.212 1.00 1.21 C ATOM 3054 O ARG B 88 -10.218 1.392 12.421 1.00 1.72 O ATOM 3055 CB ARG B 88 -10.058 4.086 11.650 1.00 1.71 C ATOM 3056 CG ARG B 88 -8.680 4.336 12.285 1.00 3.00 C ATOM 3057 CD ARG B 88 -7.823 5.219 11.363 1.00 4.07 C ATOM 3058 NE ARG B 88 -6.382 4.991 11.538 1.00 5.61 N ATOM 3059 CZ ARG B 88 -5.523 5.728 12.261 1.00 6.50 C ATOM 3060 NH1 ARG B 88 -5.954 6.677 13.097 1.00 6.24 N ATOM 3061 NH2 ARG B 88 -4.221 5.497 12.131 1.00 8.07 N ATOM 0 H ARG B 88 -11.880 3.638 9.980 1.00 1.04 H new ATOM 0 HA ARG B 88 -9.028 3.022 10.122 1.00 1.27 H new ATOM 0 HB2 ARG B 88 -10.414 5.003 11.180 1.00 1.71 H new ATOM 0 HB3 ARG B 88 -10.776 3.827 12.428 1.00 1.71 H new ATOM 0 HG2 ARG B 88 -8.801 4.819 13.255 1.00 3.00 H new ATOM 0 HG3 ARG B 88 -8.176 3.386 12.463 1.00 3.00 H new ATOM 0 HD2 ARG B 88 -8.094 5.024 10.325 1.00 4.07 H new ATOM 0 HD3 ARG B 88 -8.047 6.267 11.560 1.00 4.07 H new ATOM 0 HE ARG B 88 -5.990 4.182 11.056 1.00 5.61 H new ATOM 0 HH11 ARG B 88 -6.954 6.854 13.196 1.00 6.24 H new ATOM 0 HH12 ARG B 88 -5.283 7.225 13.636 1.00 6.24 H new ATOM 0 HH21 ARG B 88 -3.893 4.773 11.492 1.00 8.07 H new ATOM 0 HH22 ARG B 88 -3.550 6.044 12.670 1.00 8.07 H new ATOM 3075 N LYS B 89 -9.973 0.537 10.349 1.00 1.00 N ATOM 3076 CA LYS B 89 -10.242 -0.882 10.585 1.00 1.04 C ATOM 3077 C LYS B 89 -9.709 -1.508 11.881 1.00 1.26 C ATOM 3078 O LYS B 89 -10.146 -2.602 12.219 1.00 1.32 O ATOM 3079 CB LYS B 89 -9.795 -1.690 9.359 1.00 1.58 C ATOM 3080 CG LYS B 89 -8.265 -1.758 9.198 1.00 1.32 C ATOM 3081 CD LYS B 89 -7.805 -1.684 7.731 1.00 1.50 C ATOM 3082 CE LYS B 89 -8.144 -0.362 7.022 1.00 2.22 C ATOM 3083 NZ LYS B 89 -7.726 0.831 7.787 1.00 4.02 N ATOM 0 H LYS B 89 -9.663 0.702 9.391 1.00 1.00 H new ATOM 0 HA LYS B 89 -11.320 -0.928 10.737 1.00 1.04 H new ATOM 0 HB2 LYS B 89 -10.190 -2.703 9.436 1.00 1.58 H new ATOM 0 HB3 LYS B 89 -10.228 -1.246 8.463 1.00 1.58 H new ATOM 0 HG2 LYS B 89 -7.811 -0.939 9.756 1.00 1.32 H new ATOM 0 HG3 LYS B 89 -7.901 -2.685 9.640 1.00 1.32 H new ATOM 0 HD2 LYS B 89 -6.726 -1.835 7.694 1.00 1.50 H new ATOM 0 HD3 LYS B 89 -8.261 -2.505 7.179 1.00 1.50 H new ATOM 0 HE2 LYS B 89 -7.661 -0.347 6.045 1.00 2.22 H new ATOM 0 HE3 LYS B 89 -9.219 -0.316 6.847 1.00 2.22 H new ATOM 0 HZ1 LYS B 89 -8.474 1.553 7.741 1.00 4.02 H new ATOM 0 HZ2 LYS B 89 -7.561 0.567 8.779 1.00 4.02 H new ATOM 0 HZ3 LYS B 89 -6.849 1.215 7.380 1.00 4.02 H new ATOM 3097 N LYS B 90 -8.740 -0.896 12.575 1.00 1.65 N ATOM 3098 CA LYS B 90 -8.168 -1.461 13.794 1.00 2.21 C ATOM 3099 C LYS B 90 -9.166 -1.452 14.963 1.00 1.90 C ATOM 3100 O LYS B 90 -8.975 -0.731 15.941 1.00 2.43 O ATOM 3101 CB LYS B 90 -6.851 -0.762 14.171 1.00 3.38 C ATOM 3102 CG LYS B 90 -5.676 -1.163 13.267 1.00 4.89 C ATOM 3103 CD LYS B 90 -4.369 -0.693 13.927 1.00 6.33 C ATOM 3104 CE LYS B 90 -3.109 -1.021 13.113 1.00 8.04 C ATOM 3105 NZ LYS B 90 -2.860 -2.471 12.972 1.00 9.37 N ATOM 0 H LYS B 90 -8.335 0.000 12.305 1.00 1.65 H new ATOM 0 HA LYS B 90 -7.940 -2.506 13.583 1.00 2.21 H new ATOM 0 HB2 LYS B 90 -6.991 0.318 14.117 1.00 3.38 H new ATOM 0 HB3 LYS B 90 -6.603 -1.000 15.206 1.00 3.38 H new ATOM 0 HG2 LYS B 90 -5.660 -2.243 13.123 1.00 4.89 H new ATOM 0 HG3 LYS B 90 -5.786 -0.712 12.281 1.00 4.89 H new ATOM 0 HD2 LYS B 90 -4.419 0.385 14.083 1.00 6.33 H new ATOM 0 HD3 LYS B 90 -4.284 -1.154 14.911 1.00 6.33 H new ATOM 0 HE2 LYS B 90 -3.201 -0.578 12.121 1.00 8.04 H new ATOM 0 HE3 LYS B 90 -2.246 -0.557 13.591 1.00 8.04 H new ATOM 0 HZ1 LYS B 90 -1.903 -2.624 12.595 1.00 9.37 H new ATOM 0 HZ2 LYS B 90 -2.944 -2.930 13.902 1.00 9.37 H new ATOM 0 HZ3 LYS B 90 -3.558 -2.881 12.320 1.00 9.37 H new ATOM 3119 N LYS B 91 -10.183 -2.312 14.888 1.00 2.08 N ATOM 3120 CA LYS B 91 -10.980 -2.747 16.020 1.00 3.00 C ATOM 3121 C LYS B 91 -11.603 -4.107 15.689 1.00 3.02 C ATOM 3122 O LYS B 91 -11.280 -5.099 16.338 1.00 3.55 O ATOM 3123 CB LYS B 91 -12.039 -1.687 16.364 1.00 4.00 C ATOM 3124 CG LYS B 91 -12.794 -2.051 17.651 1.00 4.68 C ATOM 3125 CD LYS B 91 -13.949 -1.084 17.936 1.00 5.59 C ATOM 3126 CE LYS B 91 -13.471 0.314 18.346 1.00 5.78 C ATOM 3127 NZ LYS B 91 -14.610 1.199 18.655 1.00 6.98 N ATOM 0 H LYS B 91 -10.478 -2.734 14.008 1.00 2.08 H new ATOM 0 HA LYS B 91 -10.354 -2.863 16.905 1.00 3.00 H new ATOM 0 HB2 LYS B 91 -11.559 -0.716 16.484 1.00 4.00 H new ATOM 0 HB3 LYS B 91 -12.745 -1.594 15.539 1.00 4.00 H new ATOM 0 HG2 LYS B 91 -13.184 -3.066 17.567 1.00 4.68 H new ATOM 0 HG3 LYS B 91 -12.100 -2.044 18.492 1.00 4.68 H new ATOM 0 HD2 LYS B 91 -14.575 -1.002 17.047 1.00 5.59 H new ATOM 0 HD3 LYS B 91 -14.573 -1.496 18.729 1.00 5.59 H new ATOM 0 HE2 LYS B 91 -12.820 0.238 19.217 1.00 5.78 H new ATOM 0 HE3 LYS B 91 -12.877 0.749 17.542 1.00 5.78 H new ATOM 0 HZ1 LYS B 91 -14.256 2.138 18.929 1.00 6.98 H new ATOM 0 HZ2 LYS B 91 -15.217 1.290 17.815 1.00 6.98 H new ATOM 0 HZ3 LYS B 91 -15.161 0.795 19.439 1.00 6.98 H new ATOM 3141 N ASP B 92 -12.450 -4.159 14.656 1.00 2.78 N ATOM 3142 CA ASP B 92 -13.339 -5.293 14.409 1.00 3.06 C ATOM 3143 C ASP B 92 -13.045 -5.894 13.030 1.00 2.23 C ATOM 3144 O ASP B 92 -13.936 -5.996 12.192 1.00 2.45 O ATOM 3145 CB ASP B 92 -14.793 -4.791 14.495 1.00 4.03 C ATOM 3146 CG ASP B 92 -15.129 -4.129 15.824 1.00 4.91 C ATOM 3147 OD1 ASP B 92 -15.119 -4.848 16.846 1.00 5.45 O ATOM 3148 OD2 ASP B 92 -15.359 -2.900 15.811 1.00 5.68 O ATOM 0 H ASP B 92 -12.537 -3.412 13.967 1.00 2.78 H new ATOM 0 HA ASP B 92 -13.181 -6.074 15.152 1.00 3.06 H new ATOM 0 HB2 ASP B 92 -14.972 -4.080 13.688 1.00 4.03 H new ATOM 0 HB3 ASP B 92 -15.469 -5.631 14.335 1.00 4.03 H new ATOM 3153 N LEU B 93 -11.798 -6.318 12.791 1.00 1.78 N ATOM 3154 CA LEU B 93 -11.343 -6.493 11.412 1.00 1.30 C ATOM 3155 C LEU B 93 -12.039 -7.688 10.763 1.00 1.20 C ATOM 3156 O LEU B 93 -12.856 -7.542 9.862 1.00 1.30 O ATOM 3157 CB LEU B 93 -9.824 -6.787 11.397 1.00 2.03 C ATOM 3158 CG LEU B 93 -8.843 -5.659 11.751 1.00 2.35 C ATOM 3159 CD1 LEU B 93 -8.928 -5.290 13.238 1.00 3.88 C ATOM 3160 CD2 LEU B 93 -7.405 -6.135 11.502 1.00 3.13 C ATOM 0 H LEU B 93 -11.108 -6.539 13.509 1.00 1.78 H new ATOM 0 HA LEU B 93 -11.574 -5.578 10.867 1.00 1.30 H new ATOM 0 HB2 LEU B 93 -9.641 -7.610 12.088 1.00 2.03 H new ATOM 0 HB3 LEU B 93 -9.568 -7.145 10.400 1.00 2.03 H new ATOM 0 HG LEU B 93 -9.103 -4.799 11.134 1.00 2.35 H new ATOM 0 HD11 LEU B 93 -8.221 -4.489 13.455 1.00 3.88 H new ATOM 0 HD12 LEU B 93 -9.939 -4.956 13.473 1.00 3.88 H new ATOM 0 HD13 LEU B 93 -8.685 -6.163 13.844 1.00 3.88 H new ATOM 0 HD21 LEU B 93 -6.708 -5.335 11.753 1.00 3.13 H new ATOM 0 HD22 LEU B 93 -7.197 -7.006 12.124 1.00 3.13 H new ATOM 0 HD23 LEU B 93 -7.287 -6.403 10.452 1.00 3.13 H new ATOM 3172 N LYS B 94 -11.767 -8.877 11.303 1.00 1.35 N ATOM 3173 CA LYS B 94 -12.293 -10.136 10.801 1.00 1.46 C ATOM 3174 C LYS B 94 -13.707 -10.383 11.307 1.00 1.65 C ATOM 3175 O LYS B 94 -14.434 -11.196 10.745 1.00 1.77 O ATOM 3176 CB LYS B 94 -11.322 -11.273 11.163 1.00 1.80 C ATOM 3177 CG LYS B 94 -10.222 -11.567 10.127 1.00 2.86 C ATOM 3178 CD LYS B 94 -9.613 -10.301 9.499 1.00 3.75 C ATOM 3179 CE LYS B 94 -8.630 -10.615 8.361 1.00 5.43 C ATOM 3180 NZ LYS B 94 -8.670 -9.571 7.317 1.00 6.79 N ATOM 0 H LYS B 94 -11.163 -8.988 12.117 1.00 1.35 H new ATOM 0 HA LYS B 94 -12.369 -10.094 9.714 1.00 1.46 H new ATOM 0 HB2 LYS B 94 -10.845 -11.030 12.113 1.00 1.80 H new ATOM 0 HB3 LYS B 94 -11.900 -12.184 11.320 1.00 1.80 H new ATOM 0 HG2 LYS B 94 -9.429 -12.143 10.605 1.00 2.86 H new ATOM 0 HG3 LYS B 94 -10.637 -12.191 9.336 1.00 2.86 H new ATOM 0 HD2 LYS B 94 -10.415 -9.669 9.117 1.00 3.75 H new ATOM 0 HD3 LYS B 94 -9.097 -9.730 10.271 1.00 3.75 H new ATOM 0 HE2 LYS B 94 -7.619 -10.694 8.761 1.00 5.43 H new ATOM 0 HE3 LYS B 94 -8.875 -11.582 7.922 1.00 5.43 H new ATOM 0 HZ1 LYS B 94 -8.087 -9.866 6.508 1.00 6.79 H new ATOM 0 HZ2 LYS B 94 -9.652 -9.431 7.003 1.00 6.79 H new ATOM 0 HZ3 LYS B 94 -8.300 -8.679 7.703 1.00 6.79 H new ATOM 3194 N ILE B 95 -14.097 -9.699 12.386 1.00 1.82 N ATOM 3195 CA ILE B 95 -15.457 -9.763 12.892 1.00 2.12 C ATOM 3196 C ILE B 95 -16.445 -9.468 11.756 1.00 2.15 C ATOM 3197 O ILE B 95 -17.537 -10.035 11.754 1.00 2.54 O ATOM 3198 CB ILE B 95 -15.606 -8.821 14.103 1.00 2.32 C ATOM 3199 CG1 ILE B 95 -14.674 -9.302 15.234 1.00 2.70 C ATOM 3200 CG2 ILE B 95 -17.063 -8.751 14.588 1.00 3.36 C ATOM 3201 CD1 ILE B 95 -14.792 -8.484 16.524 1.00 2.38 C ATOM 0 H ILE B 95 -13.479 -9.092 12.925 1.00 1.82 H new ATOM 0 HA ILE B 95 -15.689 -10.766 13.251 1.00 2.12 H new ATOM 0 HB ILE B 95 -15.322 -7.813 13.801 1.00 2.32 H new ATOM 0 HG12 ILE B 95 -14.896 -10.346 15.455 1.00 2.70 H new ATOM 0 HG13 ILE B 95 -13.643 -9.263 14.883 1.00 2.70 H new ATOM 0 HG21 ILE B 95 -17.130 -8.078 15.443 1.00 3.36 H new ATOM 0 HG22 ILE B 95 -17.697 -8.380 13.783 1.00 3.36 H new ATOM 0 HG23 ILE B 95 -17.397 -9.746 14.883 1.00 3.36 H new ATOM 0 HD11 ILE B 95 -14.106 -8.883 17.272 1.00 2.38 H new ATOM 0 HD12 ILE B 95 -14.541 -7.443 16.319 1.00 2.38 H new ATOM 0 HD13 ILE B 95 -15.813 -8.543 16.900 1.00 2.38 H new ATOM 3213 N ARG B 96 -16.060 -8.616 10.794 1.00 1.82 N ATOM 3214 CA ARG B 96 -16.829 -8.253 9.608 1.00 1.87 C ATOM 3215 C ARG B 96 -17.997 -7.356 9.992 1.00 2.22 C ATOM 3216 O ARG B 96 -18.070 -6.222 9.532 1.00 2.70 O ATOM 3217 CB ARG B 96 -17.260 -9.477 8.789 1.00 2.03 C ATOM 3218 CG ARG B 96 -17.830 -9.133 7.398 1.00 2.32 C ATOM 3219 CD ARG B 96 -19.360 -8.929 7.304 1.00 2.91 C ATOM 3220 NE ARG B 96 -19.842 -7.602 7.739 1.00 3.72 N ATOM 3221 CZ ARG B 96 -19.614 -6.428 7.122 1.00 4.98 C ATOM 3222 NH1 ARG B 96 -18.956 -6.418 5.965 1.00 5.67 N ATOM 3223 NH2 ARG B 96 -20.034 -5.279 7.659 1.00 6.43 N ATOM 0 H ARG B 96 -15.158 -8.141 10.830 1.00 1.82 H new ATOM 0 HA ARG B 96 -16.178 -7.683 8.945 1.00 1.87 H new ATOM 0 HB2 ARG B 96 -16.403 -10.139 8.665 1.00 2.03 H new ATOM 0 HB3 ARG B 96 -18.012 -10.031 9.351 1.00 2.03 H new ATOM 0 HG2 ARG B 96 -17.343 -8.223 7.047 1.00 2.32 H new ATOM 0 HG3 ARG B 96 -17.550 -9.930 6.709 1.00 2.32 H new ATOM 0 HD2 ARG B 96 -19.670 -9.091 6.272 1.00 2.91 H new ATOM 0 HD3 ARG B 96 -19.851 -9.693 7.907 1.00 2.91 H new ATOM 0 HE ARG B 96 -20.403 -7.573 8.591 1.00 3.72 H new ATOM 0 HH11 ARG B 96 -18.631 -7.294 5.556 1.00 5.67 H new ATOM 0 HH12 ARG B 96 -18.777 -5.535 5.488 1.00 5.67 H new ATOM 0 HH21 ARG B 96 -20.534 -5.284 8.548 1.00 6.43 H new ATOM 0 HH22 ARG B 96 -19.854 -4.396 7.180 1.00 6.43 H new ATOM 3237 N LYS B 97 -18.930 -7.915 10.776 1.00 2.86 N ATOM 3238 CA LYS B 97 -20.239 -7.424 11.186 1.00 3.36 C ATOM 3239 C LYS B 97 -20.458 -5.939 10.907 1.00 2.48 C ATOM 3240 O LYS B 97 -21.290 -5.600 10.065 1.00 3.36 O ATOM 3241 CB LYS B 97 -20.414 -7.759 12.676 1.00 4.95 C ATOM 3242 CG LYS B 97 -21.828 -7.496 13.206 1.00 5.85 C ATOM 3243 CD LYS B 97 -21.891 -7.928 14.678 1.00 7.81 C ATOM 3244 CE LYS B 97 -23.289 -7.695 15.264 1.00 8.79 C ATOM 3245 NZ LYS B 97 -23.373 -8.119 16.678 1.00 10.55 N ATOM 0 H LYS B 97 -18.756 -8.834 11.183 1.00 2.86 H new ATOM 0 HA LYS B 97 -21.001 -7.921 10.586 1.00 3.36 H new ATOM 0 HB2 LYS B 97 -20.166 -8.808 12.835 1.00 4.95 H new ATOM 0 HB3 LYS B 97 -19.703 -7.172 13.257 1.00 4.95 H new ATOM 0 HG2 LYS B 97 -22.076 -6.439 13.112 1.00 5.85 H new ATOM 0 HG3 LYS B 97 -22.561 -8.049 12.618 1.00 5.85 H new ATOM 0 HD2 LYS B 97 -21.630 -8.983 14.762 1.00 7.81 H new ATOM 0 HD3 LYS B 97 -21.154 -7.370 15.256 1.00 7.81 H new ATOM 0 HE2 LYS B 97 -23.543 -6.638 15.186 1.00 8.79 H new ATOM 0 HE3 LYS B 97 -24.025 -8.244 14.676 1.00 8.79 H new ATOM 0 HZ1 LYS B 97 -24.334 -7.945 17.036 1.00 10.55 H new ATOM 0 HZ2 LYS B 97 -23.155 -9.133 16.750 1.00 10.55 H new ATOM 0 HZ3 LYS B 97 -22.689 -7.577 17.244 1.00 10.55 H new ATOM 3259 N LYS B 98 -19.672 -5.076 11.544 1.00 3.03 N ATOM 3260 CA LYS B 98 -19.671 -3.644 11.364 1.00 4.70 C ATOM 3261 C LYS B 98 -18.196 -3.282 11.235 1.00 6.12 C ATOM 3262 O LYS B 98 -17.870 -2.415 10.398 1.00 7.36 O ATOM 3263 CB LYS B 98 -20.319 -3.014 12.603 1.00 5.64 C ATOM 3264 CG LYS B 98 -20.378 -1.487 12.520 1.00 7.14 C ATOM 3265 CD LYS B 98 -21.021 -0.921 13.791 1.00 8.41 C ATOM 3266 CE LYS B 98 -21.079 0.610 13.717 1.00 9.92 C ATOM 3267 NZ LYS B 98 -21.725 1.196 14.910 1.00 11.14 N ATOM 3268 OXT LYS B 98 -17.414 -3.914 11.977 1.00 6.47 O ATOM 0 H LYS B 98 -18.986 -5.382 12.234 1.00 3.03 H new ATOM 0 HA LYS B 98 -20.228 -3.292 10.496 1.00 4.70 H new ATOM 0 HB2 LYS B 98 -21.329 -3.408 12.721 1.00 5.64 H new ATOM 0 HB3 LYS B 98 -19.757 -3.305 13.491 1.00 5.64 H new ATOM 0 HG2 LYS B 98 -19.374 -1.081 12.398 1.00 7.14 H new ATOM 0 HG3 LYS B 98 -20.953 -1.183 11.645 1.00 7.14 H new ATOM 0 HD2 LYS B 98 -22.026 -1.325 13.910 1.00 8.41 H new ATOM 0 HD3 LYS B 98 -20.448 -1.229 14.666 1.00 8.41 H new ATOM 0 HE2 LYS B 98 -20.069 1.007 13.620 1.00 9.92 H new ATOM 0 HE3 LYS B 98 -21.627 0.910 12.824 1.00 9.92 H new ATOM 0 HZ1 LYS B 98 -21.744 2.232 14.821 1.00 11.14 H new ATOM 0 HZ2 LYS B 98 -22.698 0.837 14.989 1.00 11.14 H new ATOM 0 HZ3 LYS B 98 -21.188 0.932 15.761 1.00 11.14 H new TER 3282 LYS B 98