USER MOD reduce.3.24.130724 H: found=0, std=0, add=1205, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1205 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 71 GLN : amide:sc= 0.563 K(o=2.2,f=0.76) USER MOD Set 1.2: B 75 THR OG1 : rot 76:sc= 1.64 USER MOD Set 2.1: A 19 TYR OH : rot 180:sc= 0.855 USER MOD Set 2.2: A 40 LYS NZ :NH3+ 170:sc= 0.99 (180deg=0) USER MOD Single : A 3 SER OG : rot 17:sc= 0.83 USER MOD Single : A 7 GLN : amide:sc= 0.405 X(o=0.4,f=0) USER MOD Single : A 17 HIS : no HE2:sc= 0.842 K(o=0.84,f=-2.9!) USER MOD Single : A 18 LYS NZ :NH3+ 162:sc= 1.05 (180deg=0.656) USER MOD Single : A 20 SER OG : rot 80:sc= 0.878 USER MOD Single : A 22 LYS NZ :NH3+ 170:sc= 0.663 (180deg=0.462) USER MOD Single : A 26 LYS NZ :NH3+ 162:sc= 0.384 (180deg=-0.546) USER MOD Single : A 27 HIS : no HE2:sc= -0.236 K(o=-0.24,f=-2.4) USER MOD Single : A 28 THR OG1 : rot 160:sc= 1.33 USER MOD Single : A 30 SER OG : rot -153:sc= 0.969 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 LYS NZ :NH3+ -169:sc=-0.00583 (180deg=-0.125) USER MOD Single : A 39 GLN : amide:sc= 0.0436 X(o=0.044,f=-0.0077) USER MOD Single : A 55 LYS NZ :NH3+ -166:sc= -0.275 (180deg=-0.606) USER MOD Single : A 57 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 63 ASN : amide:sc= -0.371 X(o=-0.37,f=-0.37) USER MOD Single : A 64 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.11) USER MOD Single : A 66 GLN : amide:sc= -0.66 K(o=-0.66,f=-1.3) USER MOD Single : A 69 ASN : amide:sc= 0.199 K(o=0.2,f=-9.3!) USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 73 TYR OH : rot 144:sc= 0.793 USER MOD Single : A 75 THR OG1 : rot 81:sc= 1.16 USER MOD Single : A 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= 0.99 K(o=0.99,f=0) USER MOD Single : B 3 SER OG : rot -23:sc= 0.362 USER MOD Single : B 7 GLN : amide:sc= 0.401 X(o=0.4,f=-0.026) USER MOD Single : B 17 HIS : no HE2:sc= 0.268 K(o=0.27,f=-2.6!) USER MOD Single : B 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 19 TYR OH : rot -2:sc= 1.22 USER MOD Single : B 20 SER OG : rot 170:sc= 1.28 USER MOD Single : B 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 27 HIS : no HD1:sc= 0 X(o=0,f=-0.02) USER MOD Single : B 28 THR OG1 : rot -67:sc= 0.882 USER MOD Single : B 30 SER OG : rot -162:sc= 1.83 USER MOD Single : B 31 LYS NZ :NH3+ 174:sc= 1.21 (180deg=1.1) USER MOD Single : B 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 35 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.026) USER MOD Single : B 39 GLN : amide:sc= 0.0333 X(o=0.033,f=0) USER MOD Single : B 40 LYS NZ :NH3+ -173:sc= -0.0885 (180deg=-0.233) USER MOD Single : B 57 MET CE :methyl -164:sc= -0.0447 (180deg=-0.301) USER MOD Single : B 63 ASN : amide:sc= 0.865 K(o=0.87,f=-3.5!) USER MOD Single : B 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 66 GLN : amide:sc= -1.16 K(o=-1.2,f=-7.7!) USER MOD Single : B 69 ASN : amide:sc= -0.389 K(o=-0.39,f=-4.4!) USER MOD Single : B 73 TYR OH : rot 180:sc= 0 USER MOD Single : B 82 MET CE :methyl -173:sc= 0 (180deg=-0.0602) USER MOD Single : B 84 TYR OH : rot 30:sc= 0 USER MOD Single : B 85 ASN : amide:sc= 1.03 K(o=1,f=-0.12) USER MOD ----------------------------------------------------------------- ATOM 30 N SER A 3 -15.604 8.260 4.378 1.00 0.00 N ATOM 31 CA SER A 3 -16.341 7.159 3.785 1.00 0.00 C ATOM 32 C SER A 3 -15.680 6.558 2.537 1.00 0.00 C ATOM 33 O SER A 3 -15.631 5.332 2.426 1.00 0.00 O ATOM 34 CB SER A 3 -17.802 7.577 3.571 1.00 0.00 C ATOM 35 OG SER A 3 -18.145 8.622 4.470 1.00 0.00 O ATOM 0 HA SER A 3 -16.323 6.329 4.491 1.00 0.00 H new ATOM 0 HB2 SER A 3 -17.947 7.908 2.543 1.00 0.00 H new ATOM 0 HB3 SER A 3 -18.460 6.722 3.726 1.00 0.00 H new ATOM 0 HG SER A 3 -17.328 9.020 4.836 1.00 0.00 H new ATOM 41 N PRO A 4 -15.172 7.359 1.584 1.00 0.00 N ATOM 42 CA PRO A 4 -14.419 6.837 0.452 1.00 0.00 C ATOM 43 C PRO A 4 -13.240 5.963 0.902 1.00 0.00 C ATOM 44 O PRO A 4 -13.126 4.802 0.506 1.00 0.00 O ATOM 45 CB PRO A 4 -13.962 8.074 -0.330 1.00 0.00 C ATOM 46 CG PRO A 4 -15.029 9.113 0.006 1.00 0.00 C ATOM 47 CD PRO A 4 -15.303 8.804 1.476 1.00 0.00 C ATOM 0 HA PRO A 4 -15.026 6.178 -0.168 1.00 0.00 H new ATOM 0 HB2 PRO A 4 -12.969 8.402 -0.021 1.00 0.00 H new ATOM 0 HB3 PRO A 4 -13.914 7.878 -1.401 1.00 0.00 H new ATOM 0 HG2 PRO A 4 -14.669 10.132 -0.139 1.00 0.00 H new ATOM 0 HG3 PRO A 4 -15.921 8.999 -0.610 1.00 0.00 H new ATOM 0 HD2 PRO A 4 -14.593 9.315 2.126 1.00 0.00 H new ATOM 0 HD3 PRO A 4 -16.299 9.134 1.770 1.00 0.00 H new ATOM 55 N LEU A 5 -12.370 6.512 1.757 1.00 0.00 N ATOM 56 CA LEU A 5 -11.227 5.775 2.272 1.00 0.00 C ATOM 57 C LEU A 5 -11.722 4.557 3.041 1.00 0.00 C ATOM 58 O LEU A 5 -11.192 3.467 2.870 1.00 0.00 O ATOM 59 CB LEU A 5 -10.349 6.671 3.157 1.00 0.00 C ATOM 60 CG LEU A 5 -9.127 5.943 3.747 1.00 0.00 C ATOM 61 CD1 LEU A 5 -8.198 5.390 2.659 1.00 0.00 C ATOM 62 CD2 LEU A 5 -8.344 6.923 4.626 1.00 0.00 C ATOM 0 H LEU A 5 -12.443 7.468 2.104 1.00 0.00 H new ATOM 0 HA LEU A 5 -10.609 5.442 1.438 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -10.006 7.523 2.570 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -10.954 7.068 3.972 1.00 0.00 H new ATOM 0 HG LEU A 5 -9.491 5.097 4.330 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -7.352 4.886 3.125 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -8.746 4.681 2.039 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -7.835 6.210 2.039 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -7.476 6.418 5.050 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -8.014 7.769 4.023 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -8.985 7.281 5.432 1.00 0.00 H new ATOM 74 N ASP A 6 -12.746 4.729 3.878 1.00 0.00 N ATOM 75 CA ASP A 6 -13.260 3.642 4.698 1.00 0.00 C ATOM 76 C ASP A 6 -13.700 2.469 3.824 1.00 0.00 C ATOM 77 O ASP A 6 -13.332 1.327 4.087 1.00 0.00 O ATOM 78 CB ASP A 6 -14.403 4.117 5.607 1.00 0.00 C ATOM 79 CG ASP A 6 -14.032 5.289 6.514 1.00 0.00 C ATOM 80 OD1 ASP A 6 -12.826 5.450 6.798 1.00 0.00 O ATOM 81 OD2 ASP A 6 -14.971 6.013 6.912 1.00 0.00 O ATOM 0 H ASP A 6 -13.234 5.616 4.003 1.00 0.00 H new ATOM 0 HA ASP A 6 -12.452 3.299 5.345 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -15.251 4.406 4.986 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -14.732 3.282 6.226 1.00 0.00 H new ATOM 86 N GLN A 7 -14.458 2.751 2.764 1.00 0.00 N ATOM 87 CA GLN A 7 -14.831 1.736 1.788 1.00 0.00 C ATOM 88 C GLN A 7 -13.586 1.119 1.147 1.00 0.00 C ATOM 89 O GLN A 7 -13.535 -0.095 0.961 1.00 0.00 O ATOM 90 CB GLN A 7 -15.757 2.345 0.732 1.00 0.00 C ATOM 91 CG GLN A 7 -17.151 2.607 1.316 1.00 0.00 C ATOM 92 CD GLN A 7 -17.953 3.543 0.423 1.00 0.00 C ATOM 93 OE1 GLN A 7 -18.911 3.141 -0.226 1.00 0.00 O ATOM 94 NE2 GLN A 7 -17.555 4.808 0.392 1.00 0.00 N ATOM 0 H GLN A 7 -14.826 3.681 2.562 1.00 0.00 H new ATOM 0 HA GLN A 7 -15.369 0.936 2.296 1.00 0.00 H new ATOM 0 HB2 GLN A 7 -15.331 3.278 0.363 1.00 0.00 H new ATOM 0 HB3 GLN A 7 -15.836 1.671 -0.121 1.00 0.00 H new ATOM 0 HG2 GLN A 7 -17.684 1.663 1.430 1.00 0.00 H new ATOM 0 HG3 GLN A 7 -17.056 3.042 2.311 1.00 0.00 H new ATOM 0 HE21 GLN A 7 -16.752 5.104 0.947 1.00 0.00 H new ATOM 0 HE22 GLN A 7 -18.052 5.485 -0.187 1.00 0.00 H new ATOM 103 N ALA A 8 -12.579 1.933 0.810 1.00 0.00 N ATOM 104 CA ALA A 8 -11.371 1.420 0.169 1.00 0.00 C ATOM 105 C ALA A 8 -10.653 0.432 1.094 1.00 0.00 C ATOM 106 O ALA A 8 -10.357 -0.694 0.697 1.00 0.00 O ATOM 107 CB ALA A 8 -10.456 2.571 -0.262 1.00 0.00 C ATOM 0 H ALA A 8 -12.579 2.940 0.970 1.00 0.00 H new ATOM 0 HA ALA A 8 -11.654 0.878 -0.733 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -9.562 2.167 -0.737 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -10.985 3.211 -0.968 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -10.169 3.155 0.613 1.00 0.00 H new ATOM 113 N ILE A 9 -10.403 0.845 2.338 1.00 0.00 N ATOM 114 CA ILE A 9 -9.839 0.004 3.385 1.00 0.00 C ATOM 115 C ILE A 9 -10.677 -1.266 3.508 1.00 0.00 C ATOM 116 O ILE A 9 -10.138 -2.366 3.430 1.00 0.00 O ATOM 117 CB ILE A 9 -9.777 0.783 4.718 1.00 0.00 C ATOM 118 CG1 ILE A 9 -8.818 1.988 4.660 1.00 0.00 C ATOM 119 CG2 ILE A 9 -9.405 -0.131 5.896 1.00 0.00 C ATOM 120 CD1 ILE A 9 -7.336 1.606 4.658 1.00 0.00 C ATOM 0 H ILE A 9 -10.593 1.798 2.649 1.00 0.00 H new ATOM 0 HA ILE A 9 -8.818 -0.280 3.129 1.00 0.00 H new ATOM 0 HB ILE A 9 -10.783 1.170 4.881 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -9.034 2.568 3.763 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -9.014 2.637 5.514 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -9.372 0.455 6.815 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -10.151 -0.919 5.995 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -8.427 -0.578 5.715 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -6.727 2.509 4.616 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -7.102 1.053 5.567 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -7.122 0.983 3.789 1.00 0.00 H new ATOM 132 N GLY A 10 -11.994 -1.112 3.681 1.00 0.00 N ATOM 133 CA GLY A 10 -12.934 -2.216 3.780 1.00 0.00 C ATOM 134 C GLY A 10 -12.731 -3.223 2.651 1.00 0.00 C ATOM 135 O GLY A 10 -12.586 -4.417 2.905 1.00 0.00 O ATOM 0 H GLY A 10 -12.437 -0.196 3.757 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -12.811 -2.715 4.741 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -13.954 -1.832 3.748 1.00 0.00 H new ATOM 139 N LEU A 11 -12.701 -2.744 1.406 1.00 0.00 N ATOM 140 CA LEU A 11 -12.491 -3.575 0.231 1.00 0.00 C ATOM 141 C LEU A 11 -11.144 -4.292 0.332 1.00 0.00 C ATOM 142 O LEU A 11 -11.095 -5.517 0.271 1.00 0.00 O ATOM 143 CB LEU A 11 -12.625 -2.705 -1.030 1.00 0.00 C ATOM 144 CG LEU A 11 -12.747 -3.487 -2.352 1.00 0.00 C ATOM 145 CD1 LEU A 11 -13.286 -2.535 -3.428 1.00 0.00 C ATOM 146 CD2 LEU A 11 -11.412 -4.075 -2.831 1.00 0.00 C ATOM 0 H LEU A 11 -12.824 -1.755 1.188 1.00 0.00 H new ATOM 0 HA LEU A 11 -13.249 -4.355 0.168 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -13.502 -2.067 -0.921 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -11.758 -2.048 -1.093 1.00 0.00 H new ATOM 0 HG LEU A 11 -13.420 -4.326 -2.177 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -13.380 -3.070 -4.373 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -14.263 -2.159 -3.125 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -12.598 -1.698 -3.551 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -11.566 -4.613 -3.766 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -10.696 -3.269 -2.990 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -11.025 -4.761 -2.077 1.00 0.00 H new ATOM 158 N LEU A 12 -10.050 -3.537 0.483 1.00 0.00 N ATOM 159 CA LEU A 12 -8.692 -4.077 0.480 1.00 0.00 C ATOM 160 C LEU A 12 -8.508 -5.144 1.567 1.00 0.00 C ATOM 161 O LEU A 12 -7.989 -6.235 1.292 1.00 0.00 O ATOM 162 CB LEU A 12 -7.682 -2.933 0.654 1.00 0.00 C ATOM 163 CG LEU A 12 -7.623 -1.993 -0.563 1.00 0.00 C ATOM 164 CD1 LEU A 12 -6.931 -0.684 -0.165 1.00 0.00 C ATOM 165 CD2 LEU A 12 -6.865 -2.628 -1.736 1.00 0.00 C ATOM 0 H LEU A 12 -10.086 -2.526 0.612 1.00 0.00 H new ATOM 0 HA LEU A 12 -8.515 -4.564 -0.479 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -7.945 -2.355 1.540 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -6.692 -3.353 0.830 1.00 0.00 H new ATOM 0 HG LEU A 12 -8.646 -1.800 -0.885 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -6.889 -0.018 -1.027 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -7.493 -0.205 0.637 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -5.919 -0.897 0.178 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -6.846 -1.933 -2.575 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -5.844 -2.855 -1.429 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -7.366 -3.548 -2.038 1.00 0.00 H new ATOM 177 N ILE A 13 -8.927 -4.817 2.794 1.00 0.00 N ATOM 178 CA ILE A 13 -8.962 -5.744 3.916 1.00 0.00 C ATOM 179 C ILE A 13 -9.802 -6.950 3.514 1.00 0.00 C ATOM 180 O ILE A 13 -9.319 -8.072 3.583 1.00 0.00 O ATOM 181 CB ILE A 13 -9.529 -5.059 5.176 1.00 0.00 C ATOM 182 CG1 ILE A 13 -8.568 -4.003 5.754 1.00 0.00 C ATOM 183 CG2 ILE A 13 -9.912 -6.075 6.265 1.00 0.00 C ATOM 184 CD1 ILE A 13 -7.356 -4.588 6.487 1.00 0.00 C ATOM 0 H ILE A 13 -9.256 -3.882 3.033 1.00 0.00 H new ATOM 0 HA ILE A 13 -7.952 -6.071 4.162 1.00 0.00 H new ATOM 0 HB ILE A 13 -10.435 -4.547 4.851 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -8.215 -3.367 4.942 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -9.121 -3.364 6.443 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -10.306 -5.547 7.133 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -10.671 -6.754 5.878 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -9.030 -6.645 6.557 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -6.732 -3.777 6.862 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -7.696 -5.200 7.322 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -6.777 -5.203 5.799 1.00 0.00 H new ATOM 196 N GLY A 14 -11.048 -6.720 3.097 1.00 0.00 N ATOM 197 CA GLY A 14 -11.997 -7.761 2.745 1.00 0.00 C ATOM 198 C GLY A 14 -11.392 -8.772 1.777 1.00 0.00 C ATOM 199 O GLY A 14 -11.334 -9.961 2.083 1.00 0.00 O ATOM 0 H GLY A 14 -11.428 -5.779 2.994 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -12.326 -8.274 3.649 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -12.881 -7.310 2.295 1.00 0.00 H new ATOM 203 N ILE A 15 -10.941 -8.312 0.608 1.00 0.00 N ATOM 204 CA ILE A 15 -10.383 -9.209 -0.391 1.00 0.00 C ATOM 205 C ILE A 15 -9.168 -9.942 0.180 1.00 0.00 C ATOM 206 O ILE A 15 -9.127 -11.171 0.135 1.00 0.00 O ATOM 207 CB ILE A 15 -10.121 -8.489 -1.731 1.00 0.00 C ATOM 208 CG1 ILE A 15 -9.760 -9.523 -2.808 1.00 0.00 C ATOM 209 CG2 ILE A 15 -9.029 -7.418 -1.651 1.00 0.00 C ATOM 210 CD1 ILE A 15 -9.645 -8.899 -4.199 1.00 0.00 C ATOM 0 H ILE A 15 -10.953 -7.329 0.336 1.00 0.00 H new ATOM 0 HA ILE A 15 -11.119 -9.975 -0.635 1.00 0.00 H new ATOM 0 HB ILE A 15 -11.042 -7.968 -1.991 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -8.815 -10.000 -2.548 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -10.518 -10.306 -2.825 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -8.901 -6.956 -2.630 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -9.318 -6.658 -0.925 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -8.091 -7.878 -1.341 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -9.388 -9.671 -4.924 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -10.597 -8.445 -4.474 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -8.867 -8.135 -4.192 1.00 0.00 H new ATOM 222 N PHE A 16 -8.204 -9.216 0.762 1.00 0.00 N ATOM 223 CA PHE A 16 -7.004 -9.854 1.301 1.00 0.00 C ATOM 224 C PHE A 16 -7.365 -10.907 2.361 1.00 0.00 C ATOM 225 O PHE A 16 -6.764 -11.983 2.446 1.00 0.00 O ATOM 226 CB PHE A 16 -6.063 -8.776 1.852 1.00 0.00 C ATOM 227 CG PHE A 16 -4.652 -9.266 2.102 1.00 0.00 C ATOM 228 CD1 PHE A 16 -4.345 -9.929 3.302 1.00 0.00 C ATOM 229 CD2 PHE A 16 -3.672 -9.153 1.097 1.00 0.00 C ATOM 230 CE1 PHE A 16 -3.072 -10.489 3.490 1.00 0.00 C ATOM 231 CE2 PHE A 16 -2.377 -9.654 1.315 1.00 0.00 C ATOM 232 CZ PHE A 16 -2.074 -10.316 2.518 1.00 0.00 C ATOM 0 H PHE A 16 -8.233 -8.202 0.869 1.00 0.00 H new ATOM 0 HA PHE A 16 -6.486 -10.387 0.504 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -6.029 -7.943 1.150 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -6.474 -8.390 2.785 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -5.089 -10.008 4.081 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -3.916 -8.680 0.157 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -2.859 -11.055 4.385 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -1.615 -9.531 0.559 1.00 0.00 H new ATOM 0 HZ PHE A 16 -1.076 -10.690 2.694 1.00 0.00 H new ATOM 242 N HIS A 17 -8.376 -10.594 3.172 1.00 0.00 N ATOM 243 CA HIS A 17 -8.848 -11.444 4.242 1.00 0.00 C ATOM 244 C HIS A 17 -9.386 -12.772 3.713 1.00 0.00 C ATOM 245 O HIS A 17 -9.221 -13.782 4.387 1.00 0.00 O ATOM 246 CB HIS A 17 -9.878 -10.720 5.119 1.00 0.00 C ATOM 247 CG HIS A 17 -10.443 -11.621 6.187 1.00 0.00 C ATOM 248 ND1 HIS A 17 -9.701 -12.414 7.032 1.00 0.00 N ATOM 249 CD2 HIS A 17 -11.747 -12.026 6.282 1.00 0.00 C ATOM 250 CE1 HIS A 17 -10.545 -13.280 7.615 1.00 0.00 C ATOM 251 NE2 HIS A 17 -11.805 -13.082 7.195 1.00 0.00 N ATOM 0 H HIS A 17 -8.895 -9.720 3.093 1.00 0.00 H new ATOM 0 HA HIS A 17 -7.992 -11.678 4.875 1.00 0.00 H new ATOM 0 HB2 HIS A 17 -9.411 -9.853 5.586 1.00 0.00 H new ATOM 0 HB3 HIS A 17 -10.689 -10.347 4.493 1.00 0.00 H new ATOM 0 HD1 HIS A 17 -8.695 -12.355 7.187 1.00 0.00 H new ATOM 0 HD2 HIS A 17 -12.584 -11.604 5.746 1.00 0.00 H new ATOM 0 HE1 HIS A 17 -10.250 -14.036 8.328 1.00 0.00 H new ATOM 259 N LYS A 18 -10.008 -12.815 2.529 1.00 0.00 N ATOM 260 CA LYS A 18 -10.485 -14.090 1.992 1.00 0.00 C ATOM 261 C LYS A 18 -9.323 -15.077 1.881 1.00 0.00 C ATOM 262 O LYS A 18 -9.401 -16.217 2.343 1.00 0.00 O ATOM 263 CB LYS A 18 -11.158 -13.901 0.627 1.00 0.00 C ATOM 264 CG LYS A 18 -12.369 -12.958 0.625 1.00 0.00 C ATOM 265 CD LYS A 18 -13.533 -13.417 1.522 1.00 0.00 C ATOM 266 CE LYS A 18 -13.526 -12.820 2.939 1.00 0.00 C ATOM 267 NZ LYS A 18 -13.673 -11.354 2.926 1.00 0.00 N ATOM 0 H LYS A 18 -10.189 -12.003 1.939 1.00 0.00 H new ATOM 0 HA LYS A 18 -11.231 -14.492 2.678 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -10.418 -13.519 -0.076 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -11.475 -14.876 0.257 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -12.045 -11.969 0.949 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -12.733 -12.855 -0.397 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -14.473 -13.155 1.037 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -13.507 -14.504 1.600 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -14.336 -13.260 3.521 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -12.594 -13.086 3.439 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -13.966 -11.026 3.868 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -12.764 -10.916 2.674 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -14.393 -11.083 2.226 1.00 0.00 H new ATOM 281 N TYR A 19 -8.234 -14.628 1.259 1.00 0.00 N ATOM 282 CA TYR A 19 -7.059 -15.456 1.047 1.00 0.00 C ATOM 283 C TYR A 19 -6.382 -15.760 2.379 1.00 0.00 C ATOM 284 O TYR A 19 -6.022 -16.903 2.643 1.00 0.00 O ATOM 285 CB TYR A 19 -6.126 -14.786 0.038 1.00 0.00 C ATOM 286 CG TYR A 19 -6.813 -14.559 -1.291 1.00 0.00 C ATOM 287 CD1 TYR A 19 -7.104 -15.659 -2.122 1.00 0.00 C ATOM 288 CD2 TYR A 19 -7.443 -13.325 -1.524 1.00 0.00 C ATOM 289 CE1 TYR A 19 -8.063 -15.536 -3.142 1.00 0.00 C ATOM 290 CE2 TYR A 19 -8.424 -13.212 -2.524 1.00 0.00 C ATOM 291 CZ TYR A 19 -8.751 -14.323 -3.317 1.00 0.00 C ATOM 292 OH TYR A 19 -9.777 -14.247 -4.211 1.00 0.00 O ATOM 0 H TYR A 19 -8.146 -13.681 0.890 1.00 0.00 H new ATOM 0 HA TYR A 19 -7.350 -16.416 0.620 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -5.782 -13.832 0.438 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -5.243 -15.407 -0.110 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -6.590 -16.597 -1.975 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -7.173 -12.462 -0.934 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -8.271 -16.374 -3.791 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -8.927 -12.269 -2.682 1.00 0.00 H new ATOM 0 HH TYR A 19 -10.146 -13.339 -4.209 1.00 0.00 H new ATOM 302 N SER A 20 -6.244 -14.752 3.243 1.00 0.00 N ATOM 303 CA SER A 20 -5.733 -14.968 4.596 1.00 0.00 C ATOM 304 C SER A 20 -6.520 -16.070 5.321 1.00 0.00 C ATOM 305 O SER A 20 -5.942 -16.972 5.931 1.00 0.00 O ATOM 306 CB SER A 20 -5.777 -13.663 5.393 1.00 0.00 C ATOM 307 OG SER A 20 -5.141 -12.628 4.667 1.00 0.00 O ATOM 0 H SER A 20 -6.478 -13.782 3.030 1.00 0.00 H new ATOM 0 HA SER A 20 -4.697 -15.298 4.517 1.00 0.00 H new ATOM 0 HB2 SER A 20 -6.811 -13.389 5.601 1.00 0.00 H new ATOM 0 HB3 SER A 20 -5.284 -13.799 6.355 1.00 0.00 H new ATOM 0 HG SER A 20 -5.755 -12.280 3.987 1.00 0.00 H new ATOM 313 N GLY A 21 -7.848 -15.973 5.245 1.00 0.00 N ATOM 314 CA GLY A 21 -8.808 -16.757 5.993 1.00 0.00 C ATOM 315 C GLY A 21 -8.710 -18.246 5.692 1.00 0.00 C ATOM 316 O GLY A 21 -8.755 -19.052 6.619 1.00 0.00 O ATOM 0 H GLY A 21 -8.299 -15.304 4.621 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -8.652 -16.595 7.059 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -9.815 -16.409 5.762 1.00 0.00 H new ATOM 320 N LYS A 22 -8.563 -18.633 4.419 1.00 0.00 N ATOM 321 CA LYS A 22 -8.522 -20.044 4.020 1.00 0.00 C ATOM 322 C LYS A 22 -7.162 -20.708 4.318 1.00 0.00 C ATOM 323 O LYS A 22 -6.606 -21.427 3.490 1.00 0.00 O ATOM 324 CB LYS A 22 -9.008 -20.202 2.568 1.00 0.00 C ATOM 325 CG LYS A 22 -8.132 -19.496 1.522 1.00 0.00 C ATOM 326 CD LYS A 22 -8.618 -19.761 0.088 1.00 0.00 C ATOM 327 CE LYS A 22 -9.957 -19.093 -0.254 1.00 0.00 C ATOM 328 NZ LYS A 22 -9.875 -17.624 -0.169 1.00 0.00 N ATOM 0 H LYS A 22 -8.470 -17.980 3.641 1.00 0.00 H new ATOM 0 HA LYS A 22 -9.222 -20.602 4.642 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -9.054 -21.264 2.327 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -10.024 -19.814 2.494 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -8.134 -18.423 1.713 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -7.101 -19.836 1.624 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -7.860 -19.410 -0.612 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -8.713 -20.837 -0.059 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -10.261 -19.382 -1.260 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -10.727 -19.454 0.427 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -10.739 -17.204 -0.567 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -9.778 -17.339 0.826 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -9.049 -17.291 -0.706 1.00 0.00 H new ATOM 342 N GLU A 23 -6.659 -20.486 5.534 1.00 0.00 N ATOM 343 CA GLU A 23 -5.432 -20.996 6.137 1.00 0.00 C ATOM 344 C GLU A 23 -5.386 -20.423 7.560 1.00 0.00 C ATOM 345 O GLU A 23 -5.036 -21.113 8.515 1.00 0.00 O ATOM 346 CB GLU A 23 -4.183 -20.578 5.343 1.00 0.00 C ATOM 347 CG GLU A 23 -3.010 -21.542 5.561 1.00 0.00 C ATOM 348 CD GLU A 23 -1.739 -21.068 4.856 1.00 0.00 C ATOM 349 OE1 GLU A 23 -1.819 -20.773 3.641 1.00 0.00 O ATOM 350 OE2 GLU A 23 -0.700 -20.994 5.544 1.00 0.00 O ATOM 0 H GLU A 23 -7.156 -19.880 6.187 1.00 0.00 H new ATOM 0 HA GLU A 23 -5.433 -22.086 6.140 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -4.426 -20.538 4.281 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -3.885 -19.572 5.640 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -2.816 -21.641 6.629 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -3.281 -22.532 5.193 1.00 0.00 H new ATOM 357 N GLY A 24 -5.758 -19.145 7.698 1.00 0.00 N ATOM 358 CA GLY A 24 -5.993 -18.498 8.976 1.00 0.00 C ATOM 359 C GLY A 24 -4.687 -18.053 9.615 1.00 0.00 C ATOM 360 O GLY A 24 -4.463 -16.861 9.817 1.00 0.00 O ATOM 0 H GLY A 24 -5.905 -18.526 6.901 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -6.645 -17.636 8.836 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -6.513 -19.185 9.644 1.00 0.00 H new ATOM 364 N ASP A 25 -3.817 -19.009 9.942 1.00 0.00 N ATOM 365 CA ASP A 25 -2.585 -18.755 10.679 1.00 0.00 C ATOM 366 C ASP A 25 -1.514 -18.135 9.775 1.00 0.00 C ATOM 367 O ASP A 25 -0.455 -18.726 9.574 1.00 0.00 O ATOM 368 CB ASP A 25 -2.098 -20.049 11.345 1.00 0.00 C ATOM 369 CG ASP A 25 -3.071 -20.529 12.415 1.00 0.00 C ATOM 370 OD1 ASP A 25 -2.995 -19.983 13.537 1.00 0.00 O ATOM 371 OD2 ASP A 25 -3.882 -21.423 12.089 1.00 0.00 O ATOM 0 H ASP A 25 -3.952 -19.990 9.699 1.00 0.00 H new ATOM 0 HA ASP A 25 -2.788 -18.027 11.465 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -1.976 -20.825 10.589 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -1.118 -19.882 11.792 1.00 0.00 H new ATOM 376 N LYS A 26 -1.774 -16.931 9.262 1.00 0.00 N ATOM 377 CA LYS A 26 -0.793 -16.115 8.563 1.00 0.00 C ATOM 378 C LYS A 26 -1.116 -14.625 8.748 1.00 0.00 C ATOM 379 O LYS A 26 -1.297 -14.202 9.888 1.00 0.00 O ATOM 380 CB LYS A 26 -0.585 -16.606 7.117 1.00 0.00 C ATOM 381 CG LYS A 26 -1.841 -16.700 6.233 1.00 0.00 C ATOM 382 CD LYS A 26 -1.409 -17.272 4.873 1.00 0.00 C ATOM 383 CE LYS A 26 -2.427 -17.015 3.759 1.00 0.00 C ATOM 384 NZ LYS A 26 -3.691 -17.735 3.965 1.00 0.00 N ATOM 0 H LYS A 26 -2.692 -16.492 9.325 1.00 0.00 H new ATOM 0 HA LYS A 26 0.195 -16.235 9.008 1.00 0.00 H new ATOM 0 HB2 LYS A 26 0.125 -15.938 6.630 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -0.121 -17.592 7.155 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -2.590 -17.341 6.698 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -2.296 -15.717 6.108 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -0.452 -16.834 4.590 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -1.251 -18.346 4.971 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -2.629 -15.946 3.698 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -1.996 -17.313 2.803 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -4.434 -17.307 3.377 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -3.570 -18.733 3.697 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -3.965 -17.676 4.967 1.00 0.00 H new ATOM 398 N HIS A 27 -1.132 -13.845 7.660 1.00 0.00 N ATOM 399 CA HIS A 27 -1.242 -12.382 7.540 1.00 0.00 C ATOM 400 C HIS A 27 -0.520 -11.942 6.259 1.00 0.00 C ATOM 401 O HIS A 27 -0.787 -10.873 5.715 1.00 0.00 O ATOM 402 CB HIS A 27 -0.738 -11.586 8.755 1.00 0.00 C ATOM 403 CG HIS A 27 0.691 -11.863 9.141 1.00 0.00 C ATOM 404 ND1 HIS A 27 1.107 -12.833 10.020 1.00 0.00 N ATOM 405 CD2 HIS A 27 1.802 -11.199 8.696 1.00 0.00 C ATOM 406 CE1 HIS A 27 2.446 -12.763 10.096 1.00 0.00 C ATOM 407 NE2 HIS A 27 2.916 -11.782 9.307 1.00 0.00 N ATOM 0 H HIS A 27 -1.060 -14.271 6.736 1.00 0.00 H new ATOM 0 HA HIS A 27 -2.306 -12.151 7.495 1.00 0.00 H new ATOM 0 HB2 HIS A 27 -0.843 -10.522 8.544 1.00 0.00 H new ATOM 0 HB3 HIS A 27 -1.380 -11.807 9.608 1.00 0.00 H new ATOM 0 HD1 HIS A 27 0.508 -13.487 10.523 1.00 0.00 H new ATOM 0 HD2 HIS A 27 1.816 -10.374 7.999 1.00 0.00 H new ATOM 0 HE1 HIS A 27 3.061 -13.407 10.707 1.00 0.00 H new ATOM 415 N THR A 28 0.394 -12.781 5.776 1.00 0.00 N ATOM 416 CA THR A 28 0.993 -12.737 4.470 1.00 0.00 C ATOM 417 C THR A 28 0.103 -13.658 3.623 1.00 0.00 C ATOM 418 O THR A 28 -0.788 -14.319 4.158 1.00 0.00 O ATOM 419 CB THR A 28 2.405 -13.323 4.619 1.00 0.00 C ATOM 420 OG1 THR A 28 2.291 -14.586 5.251 1.00 0.00 O ATOM 421 CG2 THR A 28 3.294 -12.443 5.501 1.00 0.00 C ATOM 0 H THR A 28 0.751 -13.557 6.334 1.00 0.00 H new ATOM 0 HA THR A 28 1.069 -11.745 4.025 1.00 0.00 H new ATOM 0 HB THR A 28 2.854 -13.393 3.628 1.00 0.00 H new ATOM 0 HG1 THR A 28 3.097 -15.114 5.074 1.00 0.00 H new ATOM 0 HG21 THR A 28 4.284 -12.891 5.582 1.00 0.00 H new ATOM 0 HG22 THR A 28 3.380 -11.451 5.057 1.00 0.00 H new ATOM 0 HG23 THR A 28 2.852 -12.358 6.494 1.00 0.00 H new ATOM 429 N LEU A 29 0.313 -13.692 2.313 1.00 0.00 N ATOM 430 CA LEU A 29 -0.292 -14.693 1.438 1.00 0.00 C ATOM 431 C LEU A 29 0.759 -15.767 1.186 1.00 0.00 C ATOM 432 O LEU A 29 1.941 -15.446 1.102 1.00 0.00 O ATOM 433 CB LEU A 29 -0.749 -14.088 0.105 1.00 0.00 C ATOM 434 CG LEU A 29 -1.728 -12.917 0.253 1.00 0.00 C ATOM 435 CD1 LEU A 29 -2.218 -12.489 -1.135 1.00 0.00 C ATOM 436 CD2 LEU A 29 -2.931 -13.274 1.135 1.00 0.00 C ATOM 0 H LEU A 29 0.910 -13.025 1.824 1.00 0.00 H new ATOM 0 HA LEU A 29 -1.179 -15.106 1.918 1.00 0.00 H new ATOM 0 HB2 LEU A 29 0.127 -13.748 -0.447 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -1.220 -14.868 -0.494 1.00 0.00 H new ATOM 0 HG LEU A 29 -1.197 -12.099 0.740 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -2.914 -11.657 -1.034 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -1.367 -12.179 -1.742 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -2.721 -13.327 -1.617 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -3.596 -12.413 1.210 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -3.470 -14.112 0.693 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -2.583 -13.551 2.130 1.00 0.00 H new ATOM 448 N SER A 30 0.344 -17.028 1.062 1.00 0.00 N ATOM 449 CA SER A 30 1.216 -18.137 0.714 1.00 0.00 C ATOM 450 C SER A 30 1.062 -18.448 -0.775 1.00 0.00 C ATOM 451 O SER A 30 0.039 -18.118 -1.379 1.00 0.00 O ATOM 452 CB SER A 30 0.841 -19.333 1.600 1.00 0.00 C ATOM 453 OG SER A 30 -0.550 -19.570 1.500 1.00 0.00 O ATOM 0 H SER A 30 -0.627 -17.307 1.204 1.00 0.00 H new ATOM 0 HA SER A 30 2.264 -17.894 0.888 1.00 0.00 H new ATOM 0 HB2 SER A 30 1.396 -20.218 1.290 1.00 0.00 H new ATOM 0 HB3 SER A 30 1.114 -19.133 2.636 1.00 0.00 H new ATOM 0 HG SER A 30 -0.869 -19.999 2.321 1.00 0.00 H new ATOM 459 N LYS A 31 2.056 -19.116 -1.369 1.00 0.00 N ATOM 460 CA LYS A 31 1.972 -19.615 -2.739 1.00 0.00 C ATOM 461 C LYS A 31 0.657 -20.373 -2.967 1.00 0.00 C ATOM 462 O LYS A 31 0.043 -20.258 -4.026 1.00 0.00 O ATOM 463 CB LYS A 31 3.196 -20.498 -3.023 1.00 0.00 C ATOM 464 CG LYS A 31 3.228 -21.113 -4.431 1.00 0.00 C ATOM 465 CD LYS A 31 3.144 -20.050 -5.536 1.00 0.00 C ATOM 466 CE LYS A 31 3.403 -20.648 -6.923 1.00 0.00 C ATOM 467 NZ LYS A 31 2.353 -21.607 -7.309 1.00 0.00 N ATOM 0 H LYS A 31 2.942 -19.325 -0.909 1.00 0.00 H new ATOM 0 HA LYS A 31 1.975 -18.777 -3.436 1.00 0.00 H new ATOM 0 HB2 LYS A 31 4.098 -19.903 -2.880 1.00 0.00 H new ATOM 0 HB3 LYS A 31 3.225 -21.303 -2.288 1.00 0.00 H new ATOM 0 HG2 LYS A 31 4.146 -21.688 -4.553 1.00 0.00 H new ATOM 0 HG3 LYS A 31 2.398 -21.811 -4.538 1.00 0.00 H new ATOM 0 HD2 LYS A 31 2.158 -19.585 -5.519 1.00 0.00 H new ATOM 0 HD3 LYS A 31 3.871 -19.262 -5.338 1.00 0.00 H new ATOM 0 HE2 LYS A 31 3.453 -19.847 -7.661 1.00 0.00 H new ATOM 0 HE3 LYS A 31 4.372 -21.148 -6.929 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 2.563 -21.990 -8.253 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 2.322 -22.384 -6.619 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 1.432 -21.124 -7.328 1.00 0.00 H new ATOM 481 N LYS A 32 0.214 -21.125 -1.954 1.00 0.00 N ATOM 482 CA LYS A 32 -1.069 -21.811 -1.957 1.00 0.00 C ATOM 483 C LYS A 32 -2.209 -20.856 -2.325 1.00 0.00 C ATOM 484 O LYS A 32 -3.043 -21.194 -3.162 1.00 0.00 O ATOM 485 CB LYS A 32 -1.328 -22.462 -0.589 1.00 0.00 C ATOM 486 CG LYS A 32 -0.213 -23.403 -0.103 1.00 0.00 C ATOM 487 CD LYS A 32 0.167 -24.513 -1.095 1.00 0.00 C ATOM 488 CE LYS A 32 -1.022 -25.417 -1.438 1.00 0.00 C ATOM 489 NZ LYS A 32 -0.606 -26.550 -2.283 1.00 0.00 N ATOM 0 H LYS A 32 0.750 -21.272 -1.099 1.00 0.00 H new ATOM 0 HA LYS A 32 -1.033 -22.593 -2.716 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -1.469 -21.675 0.152 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -2.261 -23.023 -0.640 1.00 0.00 H new ATOM 0 HG2 LYS A 32 0.675 -22.810 0.115 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -0.527 -23.863 0.834 1.00 0.00 H new ATOM 0 HD2 LYS A 32 0.555 -24.063 -2.009 1.00 0.00 H new ATOM 0 HD3 LYS A 32 0.970 -25.117 -0.672 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -1.473 -25.792 -0.519 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -1.786 -24.836 -1.955 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -1.432 -27.144 -2.499 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -0.197 -26.190 -3.169 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 0.105 -27.116 -1.778 1.00 0.00 H new ATOM 503 N GLU A 33 -2.246 -19.660 -1.727 1.00 0.00 N ATOM 504 CA GLU A 33 -3.283 -18.685 -2.031 1.00 0.00 C ATOM 505 C GLU A 33 -3.204 -18.251 -3.487 1.00 0.00 C ATOM 506 O GLU A 33 -4.230 -18.143 -4.152 1.00 0.00 O ATOM 507 CB GLU A 33 -3.185 -17.454 -1.124 1.00 0.00 C ATOM 508 CG GLU A 33 -3.349 -17.790 0.361 1.00 0.00 C ATOM 509 CD GLU A 33 -4.613 -18.588 0.656 1.00 0.00 C ATOM 510 OE1 GLU A 33 -5.645 -18.262 0.030 1.00 0.00 O ATOM 511 OE2 GLU A 33 -4.517 -19.512 1.491 1.00 0.00 O ATOM 0 H GLU A 33 -1.568 -19.350 -1.031 1.00 0.00 H new ATOM 0 HA GLU A 33 -4.242 -19.170 -1.850 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -2.219 -16.973 -1.277 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -3.950 -16.734 -1.414 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -2.481 -18.357 0.697 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -3.368 -16.865 0.937 1.00 0.00 H new ATOM 518 N LEU A 34 -1.994 -17.995 -3.988 1.00 0.00 N ATOM 519 CA LEU A 34 -1.842 -17.621 -5.386 1.00 0.00 C ATOM 520 C LEU A 34 -2.372 -18.737 -6.283 1.00 0.00 C ATOM 521 O LEU A 34 -3.154 -18.480 -7.190 1.00 0.00 O ATOM 522 CB LEU A 34 -0.388 -17.306 -5.737 1.00 0.00 C ATOM 523 CG LEU A 34 0.261 -16.227 -4.861 1.00 0.00 C ATOM 524 CD1 LEU A 34 1.604 -15.895 -5.508 1.00 0.00 C ATOM 525 CD2 LEU A 34 -0.581 -14.948 -4.760 1.00 0.00 C ATOM 0 H LEU A 34 -1.125 -18.039 -3.456 1.00 0.00 H new ATOM 0 HA LEU A 34 -2.422 -16.713 -5.553 1.00 0.00 H new ATOM 0 HB2 LEU A 34 0.198 -18.222 -5.657 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -0.340 -16.987 -6.778 1.00 0.00 H new ATOM 0 HG LEU A 34 0.362 -16.607 -3.844 1.00 0.00 H new ATOM 0 HD11 LEU A 34 2.111 -15.128 -4.922 1.00 0.00 H new ATOM 0 HD12 LEU A 34 2.222 -16.792 -5.544 1.00 0.00 H new ATOM 0 HD13 LEU A 34 1.439 -15.528 -6.521 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -0.068 -14.224 -4.127 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -0.721 -14.525 -5.755 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -1.552 -15.185 -4.326 1.00 0.00 H new ATOM 537 N LYS A 35 -1.959 -19.979 -6.027 1.00 0.00 N ATOM 538 CA LYS A 35 -2.407 -21.130 -6.796 1.00 0.00 C ATOM 539 C LYS A 35 -3.936 -21.259 -6.730 1.00 0.00 C ATOM 540 O LYS A 35 -4.592 -21.525 -7.739 1.00 0.00 O ATOM 541 CB LYS A 35 -1.661 -22.376 -6.291 1.00 0.00 C ATOM 542 CG LYS A 35 -1.979 -23.682 -7.033 1.00 0.00 C ATOM 543 CD LYS A 35 -1.811 -23.571 -8.556 1.00 0.00 C ATOM 544 CE LYS A 35 -2.055 -24.913 -9.256 1.00 0.00 C ATOM 545 NZ LYS A 35 -1.033 -25.918 -8.909 1.00 0.00 N ATOM 0 H LYS A 35 -1.304 -20.210 -5.280 1.00 0.00 H new ATOM 0 HA LYS A 35 -2.169 -21.009 -7.853 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -0.589 -22.190 -6.362 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -1.892 -22.513 -5.235 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -1.328 -24.472 -6.659 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -3.003 -23.980 -6.808 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -2.506 -22.827 -8.945 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -0.805 -23.219 -8.786 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -3.040 -25.290 -8.981 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -2.061 -24.762 -10.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -1.126 -26.740 -9.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -0.086 -25.503 -9.020 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -1.165 -26.221 -7.923 1.00 0.00 H new ATOM 559 N GLU A 36 -4.518 -21.071 -5.543 1.00 0.00 N ATOM 560 CA GLU A 36 -5.963 -21.056 -5.354 1.00 0.00 C ATOM 561 C GLU A 36 -6.595 -19.980 -6.244 1.00 0.00 C ATOM 562 O GLU A 36 -7.487 -20.276 -7.034 1.00 0.00 O ATOM 563 CB GLU A 36 -6.280 -20.881 -3.858 1.00 0.00 C ATOM 564 CG GLU A 36 -7.739 -21.203 -3.499 1.00 0.00 C ATOM 565 CD GLU A 36 -8.719 -20.108 -3.912 1.00 0.00 C ATOM 566 OE1 GLU A 36 -8.498 -18.955 -3.483 1.00 0.00 O ATOM 567 OE2 GLU A 36 -9.682 -20.445 -4.633 1.00 0.00 O ATOM 0 H GLU A 36 -3.992 -20.924 -4.682 1.00 0.00 H new ATOM 0 HA GLU A 36 -6.403 -22.005 -5.662 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -5.620 -21.526 -3.277 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -6.060 -19.854 -3.566 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -8.026 -22.138 -3.980 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -7.815 -21.362 -2.423 1.00 0.00 H new ATOM 574 N LEU A 37 -6.124 -18.736 -6.141 1.00 0.00 N ATOM 575 CA LEU A 37 -6.645 -17.624 -6.921 1.00 0.00 C ATOM 576 C LEU A 37 -6.541 -17.908 -8.422 1.00 0.00 C ATOM 577 O LEU A 37 -7.526 -17.780 -9.144 1.00 0.00 O ATOM 578 CB LEU A 37 -5.917 -16.330 -6.538 1.00 0.00 C ATOM 579 CG LEU A 37 -6.416 -15.110 -7.330 1.00 0.00 C ATOM 580 CD1 LEU A 37 -7.914 -14.862 -7.117 1.00 0.00 C ATOM 581 CD2 LEU A 37 -5.626 -13.874 -6.882 1.00 0.00 C ATOM 0 H LEU A 37 -5.367 -18.476 -5.509 1.00 0.00 H new ATOM 0 HA LEU A 37 -7.704 -17.500 -6.693 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -6.050 -16.145 -5.472 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -4.848 -16.456 -6.708 1.00 0.00 H new ATOM 0 HG LEU A 37 -6.262 -15.305 -8.391 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -8.224 -13.991 -7.695 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -8.478 -15.735 -7.446 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -8.106 -14.683 -6.059 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -5.971 -13.001 -7.437 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -5.780 -13.710 -5.815 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -4.565 -14.031 -7.075 1.00 0.00 H new ATOM 593 N ILE A 38 -5.356 -18.295 -8.903 1.00 0.00 N ATOM 594 CA ILE A 38 -5.175 -18.665 -10.302 1.00 0.00 C ATOM 595 C ILE A 38 -6.212 -19.717 -10.712 1.00 0.00 C ATOM 596 O ILE A 38 -6.877 -19.543 -11.729 1.00 0.00 O ATOM 597 CB ILE A 38 -3.707 -19.065 -10.572 1.00 0.00 C ATOM 598 CG1 ILE A 38 -2.883 -17.844 -11.027 1.00 0.00 C ATOM 599 CG2 ILE A 38 -3.571 -20.136 -11.666 1.00 0.00 C ATOM 600 CD1 ILE A 38 -2.871 -16.673 -10.038 1.00 0.00 C ATOM 0 H ILE A 38 -4.508 -18.359 -8.339 1.00 0.00 H new ATOM 0 HA ILE A 38 -5.361 -17.805 -10.945 1.00 0.00 H new ATOM 0 HB ILE A 38 -3.336 -19.466 -9.629 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -1.856 -18.162 -11.204 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -3.277 -17.492 -11.980 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -2.518 -20.376 -11.811 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -4.110 -21.034 -11.365 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -3.989 -19.758 -12.599 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -2.267 -15.861 -10.443 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -3.890 -16.322 -9.877 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -2.447 -17.002 -9.089 1.00 0.00 H new ATOM 612 N GLN A 39 -6.399 -20.782 -9.925 1.00 0.00 N ATOM 613 CA GLN A 39 -7.433 -21.770 -10.223 1.00 0.00 C ATOM 614 C GLN A 39 -8.835 -21.148 -10.227 1.00 0.00 C ATOM 615 O GLN A 39 -9.651 -21.501 -11.073 1.00 0.00 O ATOM 616 CB GLN A 39 -7.353 -22.939 -9.242 1.00 0.00 C ATOM 617 CG GLN A 39 -6.120 -23.808 -9.520 1.00 0.00 C ATOM 618 CD GLN A 39 -5.861 -24.754 -8.358 1.00 0.00 C ATOM 619 OE1 GLN A 39 -5.976 -25.969 -8.482 1.00 0.00 O ATOM 620 NE2 GLN A 39 -5.500 -24.190 -7.213 1.00 0.00 N ATOM 0 H GLN A 39 -5.853 -20.978 -9.086 1.00 0.00 H new ATOM 0 HA GLN A 39 -7.249 -22.148 -11.229 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -7.312 -22.559 -8.221 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -8.255 -23.546 -9.320 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -6.270 -24.380 -10.436 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -5.249 -23.173 -9.680 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -5.415 -23.176 -7.149 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -5.307 -24.771 -6.397 1.00 0.00 H new ATOM 629 N LYS A 40 -9.123 -20.229 -9.301 1.00 0.00 N ATOM 630 CA LYS A 40 -10.405 -19.539 -9.228 1.00 0.00 C ATOM 631 C LYS A 40 -10.681 -18.766 -10.523 1.00 0.00 C ATOM 632 O LYS A 40 -11.763 -18.879 -11.094 1.00 0.00 O ATOM 633 CB LYS A 40 -10.431 -18.630 -7.989 1.00 0.00 C ATOM 634 CG LYS A 40 -11.835 -18.107 -7.662 1.00 0.00 C ATOM 635 CD LYS A 40 -11.802 -17.055 -6.541 1.00 0.00 C ATOM 636 CE LYS A 40 -11.192 -17.609 -5.247 1.00 0.00 C ATOM 637 NZ LYS A 40 -11.333 -16.660 -4.130 1.00 0.00 N ATOM 0 H LYS A 40 -8.464 -19.944 -8.577 1.00 0.00 H new ATOM 0 HA LYS A 40 -11.207 -20.270 -9.124 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -10.046 -19.182 -7.132 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -9.762 -17.785 -8.151 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -12.279 -17.671 -8.557 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -12.473 -18.939 -7.362 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -11.226 -16.191 -6.872 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -12.815 -16.705 -6.343 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -11.678 -18.550 -4.989 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -10.136 -17.829 -5.407 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -11.066 -17.129 -3.241 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -10.712 -15.841 -4.290 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -12.320 -16.339 -4.070 1.00 0.00 H new ATOM 651 N GLU A 41 -9.704 -17.987 -10.997 1.00 0.00 N ATOM 652 CA GLU A 41 -9.795 -17.339 -12.302 1.00 0.00 C ATOM 653 C GLU A 41 -9.868 -18.374 -13.433 1.00 0.00 C ATOM 654 O GLU A 41 -10.521 -18.148 -14.459 1.00 0.00 O ATOM 655 CB GLU A 41 -8.588 -16.413 -12.498 1.00 0.00 C ATOM 656 CG GLU A 41 -8.490 -15.315 -11.431 1.00 0.00 C ATOM 657 CD GLU A 41 -9.792 -14.543 -11.261 1.00 0.00 C ATOM 658 OE1 GLU A 41 -10.261 -13.987 -12.279 1.00 0.00 O ATOM 659 OE2 GLU A 41 -10.295 -14.519 -10.117 1.00 0.00 O ATOM 0 H GLU A 41 -8.840 -17.792 -10.492 1.00 0.00 H new ATOM 0 HA GLU A 41 -10.712 -16.751 -12.335 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -7.675 -17.008 -12.483 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -8.650 -15.950 -13.483 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -8.212 -15.764 -10.478 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -7.694 -14.621 -11.701 1.00 0.00 H new ATOM 816 N GLU A 52 -6.117 -8.351 -15.095 1.00 0.00 N ATOM 817 CA GLU A 52 -5.797 -7.721 -13.827 1.00 0.00 C ATOM 818 C GLU A 52 -5.115 -8.732 -12.903 1.00 0.00 C ATOM 819 O GLU A 52 -4.069 -8.415 -12.339 1.00 0.00 O ATOM 820 CB GLU A 52 -7.065 -7.115 -13.202 1.00 0.00 C ATOM 821 CG GLU A 52 -6.793 -6.357 -11.895 1.00 0.00 C ATOM 822 CD GLU A 52 -8.098 -5.973 -11.202 1.00 0.00 C ATOM 823 OE1 GLU A 52 -8.603 -4.868 -11.498 1.00 0.00 O ATOM 824 OE2 GLU A 52 -8.571 -6.788 -10.382 1.00 0.00 O ATOM 0 HA GLU A 52 -5.096 -6.901 -13.987 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -7.526 -6.436 -13.919 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -7.784 -7.912 -13.009 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -6.193 -6.977 -11.229 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -6.211 -5.460 -12.105 1.00 0.00 H new ATOM 831 N ILE A 53 -5.681 -9.932 -12.720 1.00 0.00 N ATOM 832 CA ILE A 53 -5.140 -10.836 -11.705 1.00 0.00 C ATOM 833 C ILE A 53 -3.803 -11.460 -12.131 1.00 0.00 C ATOM 834 O ILE A 53 -2.931 -11.677 -11.293 1.00 0.00 O ATOM 835 CB ILE A 53 -6.214 -11.829 -11.233 1.00 0.00 C ATOM 836 CG1 ILE A 53 -7.166 -11.055 -10.299 1.00 0.00 C ATOM 837 CG2 ILE A 53 -5.591 -13.018 -10.484 1.00 0.00 C ATOM 838 CD1 ILE A 53 -8.482 -11.781 -10.032 1.00 0.00 C ATOM 0 H ILE A 53 -6.483 -10.287 -13.241 1.00 0.00 H new ATOM 0 HA ILE A 53 -4.876 -10.257 -10.820 1.00 0.00 H new ATOM 0 HB ILE A 53 -6.746 -12.238 -12.092 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -6.662 -10.873 -9.350 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -7.380 -10.081 -10.738 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -6.379 -13.700 -10.165 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -4.902 -13.544 -11.145 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -5.050 -12.655 -9.611 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -9.102 -11.179 -9.368 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -9.007 -11.940 -10.974 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -8.278 -12.744 -9.564 1.00 0.00 H new ATOM 850 N VAL A 54 -3.603 -11.721 -13.422 1.00 0.00 N ATOM 851 CA VAL A 54 -2.338 -12.204 -13.957 1.00 0.00 C ATOM 852 C VAL A 54 -1.279 -11.116 -13.783 1.00 0.00 C ATOM 853 O VAL A 54 -0.198 -11.389 -13.261 1.00 0.00 O ATOM 854 CB VAL A 54 -2.517 -12.630 -15.427 1.00 0.00 C ATOM 855 CG1 VAL A 54 -1.172 -12.945 -16.095 1.00 0.00 C ATOM 856 CG2 VAL A 54 -3.399 -13.884 -15.510 1.00 0.00 C ATOM 0 H VAL A 54 -4.326 -11.600 -14.132 1.00 0.00 H new ATOM 0 HA VAL A 54 -2.002 -13.087 -13.413 1.00 0.00 H new ATOM 0 HB VAL A 54 -2.986 -11.795 -15.947 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -1.341 -13.241 -17.130 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -0.537 -12.059 -16.070 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -0.682 -13.758 -15.560 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -3.519 -14.176 -16.553 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -2.928 -14.697 -14.957 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -4.377 -13.670 -15.078 1.00 0.00 H new ATOM 866 N LYS A 55 -1.590 -9.881 -14.197 1.00 0.00 N ATOM 867 CA LYS A 55 -0.701 -8.747 -13.983 1.00 0.00 C ATOM 868 C LYS A 55 -0.352 -8.635 -12.497 1.00 0.00 C ATOM 869 O LYS A 55 0.820 -8.498 -12.142 1.00 0.00 O ATOM 870 CB LYS A 55 -1.363 -7.466 -14.506 1.00 0.00 C ATOM 871 CG LYS A 55 -0.432 -6.249 -14.376 1.00 0.00 C ATOM 872 CD LYS A 55 -1.111 -4.945 -14.822 1.00 0.00 C ATOM 873 CE LYS A 55 -1.807 -4.197 -13.675 1.00 0.00 C ATOM 874 NZ LYS A 55 -2.906 -4.970 -13.070 1.00 0.00 N ATOM 0 H LYS A 55 -2.456 -9.648 -14.683 1.00 0.00 H new ATOM 0 HA LYS A 55 0.228 -8.895 -14.534 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -1.641 -7.601 -15.551 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -2.284 -7.280 -13.953 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -0.108 -6.151 -13.340 1.00 0.00 H new ATOM 0 HG3 LYS A 55 0.463 -6.413 -14.976 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -0.364 -4.291 -15.272 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -1.844 -5.172 -15.596 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -1.073 -3.957 -12.906 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -2.198 -3.251 -14.049 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -3.486 -4.343 -12.476 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -3.497 -5.379 -13.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -2.512 -5.734 -12.485 1.00 0.00 H new ATOM 888 N LEU A 56 -1.377 -8.695 -11.637 1.00 0.00 N ATOM 889 CA LEU A 56 -1.210 -8.665 -10.195 1.00 0.00 C ATOM 890 C LEU A 56 -0.211 -9.726 -9.770 1.00 0.00 C ATOM 891 O LEU A 56 0.823 -9.379 -9.213 1.00 0.00 O ATOM 892 CB LEU A 56 -2.559 -8.798 -9.476 1.00 0.00 C ATOM 893 CG LEU A 56 -2.467 -8.717 -7.939 1.00 0.00 C ATOM 894 CD1 LEU A 56 -3.769 -8.123 -7.398 1.00 0.00 C ATOM 895 CD2 LEU A 56 -2.262 -10.089 -7.278 1.00 0.00 C ATOM 0 H LEU A 56 -2.350 -8.766 -11.934 1.00 0.00 H new ATOM 0 HA LEU A 56 -0.806 -7.696 -9.901 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -3.226 -8.012 -9.831 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -3.013 -9.750 -9.752 1.00 0.00 H new ATOM 0 HG LEU A 56 -1.602 -8.097 -7.702 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -3.716 -8.060 -6.311 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -3.913 -7.125 -7.812 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -4.606 -8.760 -7.685 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -2.205 -9.967 -6.196 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -3.100 -10.741 -7.526 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -1.336 -10.534 -7.642 1.00 0.00 H new ATOM 907 N MET A 57 -0.507 -11.001 -10.041 1.00 0.00 N ATOM 908 CA MET A 57 0.351 -12.108 -9.655 1.00 0.00 C ATOM 909 C MET A 57 1.778 -11.829 -10.114 1.00 0.00 C ATOM 910 O MET A 57 2.682 -11.791 -9.286 1.00 0.00 O ATOM 911 CB MET A 57 -0.207 -13.434 -10.198 1.00 0.00 C ATOM 912 CG MET A 57 0.582 -14.651 -9.688 1.00 0.00 C ATOM 913 SD MET A 57 2.174 -14.979 -10.493 1.00 0.00 S ATOM 914 CE MET A 57 2.743 -16.393 -9.524 1.00 0.00 C ATOM 0 H MET A 57 -1.352 -11.287 -10.536 1.00 0.00 H new ATOM 0 HA MET A 57 0.372 -12.206 -8.570 1.00 0.00 H new ATOM 0 HB2 MET A 57 -1.252 -13.533 -9.905 1.00 0.00 H new ATOM 0 HB3 MET A 57 -0.181 -13.418 -11.288 1.00 0.00 H new ATOM 0 HG2 MET A 57 0.760 -14.519 -8.621 1.00 0.00 H new ATOM 0 HG3 MET A 57 -0.045 -15.535 -9.800 1.00 0.00 H new ATOM 0 HE1 MET A 57 3.715 -16.720 -9.893 1.00 0.00 H new ATOM 0 HE2 MET A 57 2.831 -16.105 -8.477 1.00 0.00 H new ATOM 0 HE3 MET A 57 2.027 -17.209 -9.617 1.00 0.00 H new ATOM 924 N ASP A 58 1.970 -11.602 -11.416 1.00 0.00 N ATOM 925 CA ASP A 58 3.286 -11.347 -11.983 1.00 0.00 C ATOM 926 C ASP A 58 4.029 -10.265 -11.198 1.00 0.00 C ATOM 927 O ASP A 58 5.098 -10.524 -10.648 1.00 0.00 O ATOM 928 CB ASP A 58 3.159 -10.962 -13.462 1.00 0.00 C ATOM 929 CG ASP A 58 4.513 -10.538 -14.025 1.00 0.00 C ATOM 930 OD1 ASP A 58 5.346 -11.440 -14.259 1.00 0.00 O ATOM 931 OD2 ASP A 58 4.717 -9.314 -14.174 1.00 0.00 O ATOM 0 H ASP A 58 1.215 -11.591 -12.102 1.00 0.00 H new ATOM 0 HA ASP A 58 3.872 -12.263 -11.911 1.00 0.00 H new ATOM 0 HB2 ASP A 58 2.771 -11.807 -14.031 1.00 0.00 H new ATOM 0 HB3 ASP A 58 2.443 -10.148 -13.571 1.00 0.00 H new ATOM 936 N ASP A 59 3.476 -9.051 -11.169 1.00 0.00 N ATOM 937 CA ASP A 59 4.178 -7.897 -10.625 1.00 0.00 C ATOM 938 C ASP A 59 4.355 -8.004 -9.109 1.00 0.00 C ATOM 939 O ASP A 59 5.422 -7.697 -8.586 1.00 0.00 O ATOM 940 CB ASP A 59 3.442 -6.616 -11.022 1.00 0.00 C ATOM 941 CG ASP A 59 4.189 -5.378 -10.536 1.00 0.00 C ATOM 942 OD1 ASP A 59 5.303 -5.151 -11.055 1.00 0.00 O ATOM 943 OD2 ASP A 59 3.629 -4.679 -9.665 1.00 0.00 O ATOM 0 H ASP A 59 2.540 -8.846 -11.518 1.00 0.00 H new ATOM 0 HA ASP A 59 5.182 -7.867 -11.049 1.00 0.00 H new ATOM 0 HB2 ASP A 59 3.334 -6.577 -12.106 1.00 0.00 H new ATOM 0 HB3 ASP A 59 2.436 -6.626 -10.601 1.00 0.00 H new ATOM 948 N LEU A 60 3.304 -8.422 -8.401 1.00 0.00 N ATOM 949 CA LEU A 60 3.319 -8.572 -6.953 1.00 0.00 C ATOM 950 C LEU A 60 4.316 -9.656 -6.541 1.00 0.00 C ATOM 951 O LEU A 60 5.100 -9.461 -5.616 1.00 0.00 O ATOM 952 CB LEU A 60 1.900 -8.910 -6.467 1.00 0.00 C ATOM 953 CG LEU A 60 1.776 -9.157 -4.958 1.00 0.00 C ATOM 954 CD1 LEU A 60 2.216 -7.956 -4.119 1.00 0.00 C ATOM 955 CD2 LEU A 60 0.314 -9.483 -4.631 1.00 0.00 C ATOM 0 H LEU A 60 2.410 -8.668 -8.826 1.00 0.00 H new ATOM 0 HA LEU A 60 3.637 -7.638 -6.490 1.00 0.00 H new ATOM 0 HB2 LEU A 60 1.233 -8.093 -6.743 1.00 0.00 H new ATOM 0 HB3 LEU A 60 1.552 -9.798 -6.996 1.00 0.00 H new ATOM 0 HG LEU A 60 2.437 -9.986 -4.707 1.00 0.00 H new ATOM 0 HD11 LEU A 60 2.105 -8.191 -3.061 1.00 0.00 H new ATOM 0 HD12 LEU A 60 3.260 -7.726 -4.332 1.00 0.00 H new ATOM 0 HD13 LEU A 60 1.597 -7.094 -4.365 1.00 0.00 H new ATOM 0 HD21 LEU A 60 0.212 -9.661 -3.561 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -0.319 -8.645 -4.922 1.00 0.00 H new ATOM 0 HD23 LEU A 60 0.009 -10.375 -5.178 1.00 0.00 H new ATOM 967 N ASP A 61 4.253 -10.816 -7.200 1.00 0.00 N ATOM 968 CA ASP A 61 5.079 -11.960 -6.857 1.00 0.00 C ATOM 969 C ASP A 61 6.522 -11.711 -7.288 1.00 0.00 C ATOM 970 O ASP A 61 7.430 -11.745 -6.458 1.00 0.00 O ATOM 971 CB ASP A 61 4.515 -13.233 -7.505 1.00 0.00 C ATOM 972 CG ASP A 61 5.253 -14.488 -7.060 1.00 0.00 C ATOM 973 OD1 ASP A 61 6.441 -14.612 -7.425 1.00 0.00 O ATOM 974 OD2 ASP A 61 4.612 -15.306 -6.368 1.00 0.00 O ATOM 0 H ASP A 61 3.625 -10.981 -7.986 1.00 0.00 H new ATOM 0 HA ASP A 61 5.068 -12.100 -5.776 1.00 0.00 H new ATOM 0 HB2 ASP A 61 3.459 -13.328 -7.253 1.00 0.00 H new ATOM 0 HB3 ASP A 61 4.578 -13.144 -8.590 1.00 0.00 H new ATOM 979 N ARG A 62 6.733 -11.515 -8.592 1.00 0.00 N ATOM 980 CA ARG A 62 8.031 -11.473 -9.256 1.00 0.00 C ATOM 981 C ARG A 62 8.815 -12.783 -9.088 1.00 0.00 C ATOM 982 O ARG A 62 9.033 -13.495 -10.067 1.00 0.00 O ATOM 983 CB ARG A 62 8.817 -10.212 -8.860 1.00 0.00 C ATOM 984 CG ARG A 62 10.141 -10.049 -9.624 1.00 0.00 C ATOM 985 CD ARG A 62 9.993 -10.151 -11.149 1.00 0.00 C ATOM 986 NE ARG A 62 8.959 -9.231 -11.653 1.00 0.00 N ATOM 987 CZ ARG A 62 7.946 -9.526 -12.485 1.00 0.00 C ATOM 988 NH1 ARG A 62 7.779 -10.760 -12.979 1.00 0.00 N ATOM 989 NH2 ARG A 62 7.085 -8.561 -12.825 1.00 0.00 N ATOM 0 H ARG A 62 5.961 -11.374 -9.244 1.00 0.00 H new ATOM 0 HA ARG A 62 7.859 -11.392 -10.329 1.00 0.00 H new ATOM 0 HB2 ARG A 62 8.194 -9.335 -9.037 1.00 0.00 H new ATOM 0 HB3 ARG A 62 9.025 -10.244 -7.791 1.00 0.00 H new ATOM 0 HG2 ARG A 62 10.577 -9.082 -9.375 1.00 0.00 H new ATOM 0 HG3 ARG A 62 10.842 -10.812 -9.284 1.00 0.00 H new ATOM 0 HD2 ARG A 62 10.947 -9.923 -11.624 1.00 0.00 H new ATOM 0 HD3 ARG A 62 9.736 -11.174 -11.423 1.00 0.00 H new ATOM 0 HE ARG A 62 9.019 -8.264 -11.335 1.00 0.00 H new ATOM 0 HH11 ARG A 62 8.430 -11.503 -12.725 1.00 0.00 H new ATOM 0 HH12 ARG A 62 7.001 -10.956 -13.609 1.00 0.00 H new ATOM 0 HH21 ARG A 62 7.203 -7.618 -12.454 1.00 0.00 H new ATOM 0 HH22 ARG A 62 6.310 -8.768 -13.456 1.00 0.00 H new ATOM 1003 N ASN A 63 9.245 -13.101 -7.865 1.00 0.00 N ATOM 1004 CA ASN A 63 9.839 -14.390 -7.504 1.00 0.00 C ATOM 1005 C ASN A 63 9.433 -14.845 -6.092 1.00 0.00 C ATOM 1006 O ASN A 63 9.914 -15.860 -5.585 1.00 0.00 O ATOM 1007 CB ASN A 63 11.362 -14.309 -7.669 1.00 0.00 C ATOM 1008 CG ASN A 63 12.054 -15.654 -7.449 1.00 0.00 C ATOM 1009 OD1 ASN A 63 12.939 -15.770 -6.609 1.00 0.00 O ATOM 1010 ND2 ASN A 63 11.677 -16.676 -8.213 1.00 0.00 N ATOM 0 H ASN A 63 9.188 -12.453 -7.079 1.00 0.00 H new ATOM 0 HA ASN A 63 9.452 -15.153 -8.179 1.00 0.00 H new ATOM 0 HB2 ASN A 63 11.596 -13.945 -8.669 1.00 0.00 H new ATOM 0 HB3 ASN A 63 11.761 -13.580 -6.963 1.00 0.00 H new ATOM 0 HD21 ASN A 63 12.128 -17.585 -8.108 1.00 0.00 H new ATOM 0 HD22 ASN A 63 10.937 -16.550 -8.904 1.00 0.00 H new ATOM 1017 N LYS A 64 8.509 -14.137 -5.437 1.00 0.00 N ATOM 1018 CA LYS A 64 7.987 -14.498 -4.129 1.00 0.00 C ATOM 1019 C LYS A 64 6.981 -15.651 -4.238 1.00 0.00 C ATOM 1020 O LYS A 64 5.931 -15.626 -3.595 1.00 0.00 O ATOM 1021 CB LYS A 64 7.350 -13.259 -3.487 1.00 0.00 C ATOM 1022 CG LYS A 64 8.324 -12.099 -3.248 1.00 0.00 C ATOM 1023 CD LYS A 64 9.474 -12.495 -2.312 1.00 0.00 C ATOM 1024 CE LYS A 64 10.178 -11.264 -1.730 1.00 0.00 C ATOM 1025 NZ LYS A 64 10.619 -10.329 -2.781 1.00 0.00 N ATOM 0 H LYS A 64 8.099 -13.282 -5.813 1.00 0.00 H new ATOM 0 HA LYS A 64 8.803 -14.847 -3.496 1.00 0.00 H new ATOM 0 HB2 LYS A 64 6.538 -12.910 -4.126 1.00 0.00 H new ATOM 0 HB3 LYS A 64 6.905 -13.546 -2.534 1.00 0.00 H new ATOM 0 HG2 LYS A 64 8.732 -11.766 -4.202 1.00 0.00 H new ATOM 0 HG3 LYS A 64 7.784 -11.254 -2.821 1.00 0.00 H new ATOM 0 HD2 LYS A 64 9.087 -13.111 -1.500 1.00 0.00 H new ATOM 0 HD3 LYS A 64 10.195 -13.103 -2.858 1.00 0.00 H new ATOM 0 HE2 LYS A 64 9.502 -10.749 -1.048 1.00 0.00 H new ATOM 0 HE3 LYS A 64 11.040 -11.583 -1.144 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 11.274 -9.632 -2.373 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 11.102 -10.857 -3.535 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 9.793 -9.837 -3.177 1.00 0.00 H new ATOM 1039 N ASP A 65 7.311 -16.710 -4.984 1.00 0.00 N ATOM 1040 CA ASP A 65 6.463 -17.884 -5.169 1.00 0.00 C ATOM 1041 C ASP A 65 6.533 -18.800 -3.942 1.00 0.00 C ATOM 1042 O ASP A 65 6.585 -20.021 -4.070 1.00 0.00 O ATOM 1043 CB ASP A 65 6.899 -18.635 -6.437 1.00 0.00 C ATOM 1044 CG ASP A 65 6.757 -17.787 -7.694 1.00 0.00 C ATOM 1045 OD1 ASP A 65 5.620 -17.730 -8.212 1.00 0.00 O ATOM 1046 OD2 ASP A 65 7.790 -17.225 -8.117 1.00 0.00 O ATOM 0 H ASP A 65 8.197 -16.773 -5.486 1.00 0.00 H new ATOM 0 HA ASP A 65 5.428 -17.563 -5.285 1.00 0.00 H new ATOM 0 HB2 ASP A 65 7.937 -18.950 -6.330 1.00 0.00 H new ATOM 0 HB3 ASP A 65 6.301 -19.540 -6.543 1.00 0.00 H new ATOM 1051 N GLN A 66 6.554 -18.205 -2.747 1.00 0.00 N ATOM 1052 CA GLN A 66 6.724 -18.870 -1.470 1.00 0.00 C ATOM 1053 C GLN A 66 5.668 -18.293 -0.532 1.00 0.00 C ATOM 1054 O GLN A 66 4.652 -18.925 -0.238 1.00 0.00 O ATOM 1055 CB GLN A 66 8.164 -18.690 -0.950 1.00 0.00 C ATOM 1056 CG GLN A 66 9.232 -19.388 -1.815 1.00 0.00 C ATOM 1057 CD GLN A 66 9.544 -18.698 -3.146 1.00 0.00 C ATOM 1058 OE1 GLN A 66 9.635 -19.346 -4.182 1.00 0.00 O ATOM 1059 NE2 GLN A 66 9.720 -17.381 -3.138 1.00 0.00 N ATOM 0 H GLN A 66 6.447 -17.195 -2.648 1.00 0.00 H new ATOM 0 HA GLN A 66 6.583 -19.948 -1.551 1.00 0.00 H new ATOM 0 HB2 GLN A 66 8.391 -17.625 -0.899 1.00 0.00 H new ATOM 0 HB3 GLN A 66 8.224 -19.078 0.067 1.00 0.00 H new ATOM 0 HG2 GLN A 66 10.153 -19.462 -1.237 1.00 0.00 H new ATOM 0 HG3 GLN A 66 8.902 -20.406 -2.020 1.00 0.00 H new ATOM 0 HE21 GLN A 66 9.640 -16.861 -2.264 1.00 0.00 H new ATOM 0 HE22 GLN A 66 9.935 -16.890 -4.006 1.00 0.00 H new ATOM 1068 N GLU A 67 5.909 -17.048 -0.129 1.00 0.00 N ATOM 1069 CA GLU A 67 4.977 -16.183 0.564 1.00 0.00 C ATOM 1070 C GLU A 67 5.148 -14.778 -0.002 1.00 0.00 C ATOM 1071 O GLU A 67 6.272 -14.376 -0.298 1.00 0.00 O ATOM 1072 CB GLU A 67 5.237 -16.149 2.075 1.00 0.00 C ATOM 1073 CG GLU A 67 4.905 -17.467 2.784 1.00 0.00 C ATOM 1074 CD GLU A 67 4.989 -17.311 4.300 1.00 0.00 C ATOM 1075 OE1 GLU A 67 4.323 -16.384 4.814 1.00 0.00 O ATOM 1076 OE2 GLU A 67 5.720 -18.116 4.916 1.00 0.00 O ATOM 0 H GLU A 67 6.810 -16.598 -0.289 1.00 0.00 H new ATOM 0 HA GLU A 67 3.966 -16.562 0.416 1.00 0.00 H new ATOM 0 HB2 GLU A 67 6.285 -15.906 2.250 1.00 0.00 H new ATOM 0 HB3 GLU A 67 4.646 -15.348 2.519 1.00 0.00 H new ATOM 0 HG2 GLU A 67 3.903 -17.792 2.504 1.00 0.00 H new ATOM 0 HG3 GLU A 67 5.596 -18.244 2.456 1.00 0.00 H new ATOM 1083 N VAL A 68 4.042 -14.044 -0.110 1.00 0.00 N ATOM 1084 CA VAL A 68 3.981 -12.639 -0.478 1.00 0.00 C ATOM 1085 C VAL A 68 3.535 -11.879 0.770 1.00 0.00 C ATOM 1086 O VAL A 68 2.619 -12.318 1.465 1.00 0.00 O ATOM 1087 CB VAL A 68 2.973 -12.460 -1.623 1.00 0.00 C ATOM 1088 CG1 VAL A 68 2.735 -10.982 -1.950 1.00 0.00 C ATOM 1089 CG2 VAL A 68 3.443 -13.182 -2.892 1.00 0.00 C ATOM 0 H VAL A 68 3.118 -14.438 0.067 1.00 0.00 H new ATOM 0 HA VAL A 68 4.945 -12.264 -0.823 1.00 0.00 H new ATOM 0 HB VAL A 68 2.036 -12.898 -1.280 1.00 0.00 H new ATOM 0 HG11 VAL A 68 2.016 -10.901 -2.765 1.00 0.00 H new ATOM 0 HG12 VAL A 68 2.344 -10.473 -1.069 1.00 0.00 H new ATOM 0 HG13 VAL A 68 3.676 -10.519 -2.249 1.00 0.00 H new ATOM 0 HG21 VAL A 68 2.710 -13.038 -3.685 1.00 0.00 H new ATOM 0 HG22 VAL A 68 4.404 -12.775 -3.207 1.00 0.00 H new ATOM 0 HG23 VAL A 68 3.550 -14.247 -2.686 1.00 0.00 H new ATOM 1099 N ASN A 69 4.160 -10.740 1.065 1.00 0.00 N ATOM 1100 CA ASN A 69 3.906 -10.004 2.295 1.00 0.00 C ATOM 1101 C ASN A 69 2.816 -8.958 2.048 1.00 0.00 C ATOM 1102 O ASN A 69 2.780 -8.335 0.988 1.00 0.00 O ATOM 1103 CB ASN A 69 5.223 -9.367 2.768 1.00 0.00 C ATOM 1104 CG ASN A 69 5.148 -8.765 4.172 1.00 0.00 C ATOM 1105 OD1 ASN A 69 4.147 -8.172 4.559 1.00 0.00 O ATOM 1106 ND2 ASN A 69 6.215 -8.898 4.952 1.00 0.00 N ATOM 0 H ASN A 69 4.854 -10.305 0.457 1.00 0.00 H new ATOM 0 HA ASN A 69 3.547 -10.669 3.080 1.00 0.00 H new ATOM 0 HB2 ASN A 69 6.009 -10.122 2.748 1.00 0.00 H new ATOM 0 HB3 ASN A 69 5.512 -8.587 2.063 1.00 0.00 H new ATOM 0 HD21 ASN A 69 6.212 -8.503 5.892 1.00 0.00 H new ATOM 0 HD22 ASN A 69 7.038 -9.395 4.611 1.00 0.00 H new ATOM 1113 N PHE A 70 1.937 -8.737 3.029 1.00 0.00 N ATOM 1114 CA PHE A 70 0.972 -7.640 2.994 1.00 0.00 C ATOM 1115 C PHE A 70 1.653 -6.309 2.628 1.00 0.00 C ATOM 1116 O PHE A 70 1.131 -5.528 1.837 1.00 0.00 O ATOM 1117 CB PHE A 70 0.241 -7.535 4.338 1.00 0.00 C ATOM 1118 CG PHE A 70 -0.876 -6.512 4.324 1.00 0.00 C ATOM 1119 CD1 PHE A 70 -2.064 -6.797 3.629 1.00 0.00 C ATOM 1120 CD2 PHE A 70 -0.714 -5.258 4.941 1.00 0.00 C ATOM 1121 CE1 PHE A 70 -3.100 -5.853 3.574 1.00 0.00 C ATOM 1122 CE2 PHE A 70 -1.746 -4.306 4.874 1.00 0.00 C ATOM 1123 CZ PHE A 70 -2.931 -4.597 4.177 1.00 0.00 C ATOM 0 H PHE A 70 1.876 -9.314 3.868 1.00 0.00 H new ATOM 0 HA PHE A 70 0.238 -7.854 2.217 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -0.170 -8.510 4.599 1.00 0.00 H new ATOM 0 HB3 PHE A 70 0.958 -7.272 5.116 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -2.180 -7.750 3.134 1.00 0.00 H new ATOM 0 HD2 PHE A 70 0.202 -5.027 5.465 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -4.025 -6.092 3.069 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -1.628 -3.348 5.359 1.00 0.00 H new ATOM 0 HZ PHE A 70 -3.712 -3.854 4.105 1.00 0.00 H new ATOM 1133 N GLN A 71 2.856 -6.070 3.157 1.00 0.00 N ATOM 1134 CA GLN A 71 3.685 -4.932 2.778 1.00 0.00 C ATOM 1135 C GLN A 71 3.825 -4.825 1.252 1.00 0.00 C ATOM 1136 O GLN A 71 3.727 -3.735 0.687 1.00 0.00 O ATOM 1137 CB GLN A 71 5.056 -5.073 3.455 1.00 0.00 C ATOM 1138 CG GLN A 71 5.957 -3.856 3.210 1.00 0.00 C ATOM 1139 CD GLN A 71 7.300 -4.021 3.911 1.00 0.00 C ATOM 1140 OE1 GLN A 71 8.313 -4.286 3.274 1.00 0.00 O ATOM 1141 NE2 GLN A 71 7.323 -3.878 5.233 1.00 0.00 N ATOM 0 H GLN A 71 3.282 -6.668 3.865 1.00 0.00 H new ATOM 0 HA GLN A 71 3.208 -4.011 3.114 1.00 0.00 H new ATOM 0 HB2 GLN A 71 4.916 -5.208 4.528 1.00 0.00 H new ATOM 0 HB3 GLN A 71 5.552 -5.969 3.083 1.00 0.00 H new ATOM 0 HG2 GLN A 71 6.115 -3.726 2.139 1.00 0.00 H new ATOM 0 HG3 GLN A 71 5.463 -2.954 3.571 1.00 0.00 H new ATOM 0 HE21 GLN A 71 6.464 -3.657 5.737 1.00 0.00 H new ATOM 0 HE22 GLN A 71 8.199 -3.989 5.743 1.00 0.00 H new ATOM 1150 N GLU A 72 4.058 -5.954 0.578 1.00 0.00 N ATOM 1151 CA GLU A 72 4.187 -5.991 -0.868 1.00 0.00 C ATOM 1152 C GLU A 72 2.836 -5.722 -1.526 1.00 0.00 C ATOM 1153 O GLU A 72 2.796 -4.999 -2.512 1.00 0.00 O ATOM 1154 CB GLU A 72 4.798 -7.317 -1.334 1.00 0.00 C ATOM 1155 CG GLU A 72 6.226 -7.479 -0.795 1.00 0.00 C ATOM 1156 CD GLU A 72 6.795 -8.851 -1.136 1.00 0.00 C ATOM 1157 OE1 GLU A 72 6.227 -9.840 -0.620 1.00 0.00 O ATOM 1158 OE2 GLU A 72 7.786 -8.885 -1.895 1.00 0.00 O ATOM 0 H GLU A 72 4.161 -6.865 1.026 1.00 0.00 H new ATOM 0 HA GLU A 72 4.871 -5.201 -1.178 1.00 0.00 H new ATOM 0 HB2 GLU A 72 4.180 -8.147 -0.993 1.00 0.00 H new ATOM 0 HB3 GLU A 72 4.809 -7.354 -2.423 1.00 0.00 H new ATOM 0 HG2 GLU A 72 6.866 -6.703 -1.215 1.00 0.00 H new ATOM 0 HG3 GLU A 72 6.227 -7.341 0.286 1.00 0.00 H new ATOM 1165 N TYR A 73 1.733 -6.260 -0.991 1.00 0.00 N ATOM 1166 CA TYR A 73 0.388 -5.937 -1.479 1.00 0.00 C ATOM 1167 C TYR A 73 0.158 -4.419 -1.452 1.00 0.00 C ATOM 1168 O TYR A 73 -0.261 -3.823 -2.446 1.00 0.00 O ATOM 1169 CB TYR A 73 -0.657 -6.716 -0.666 1.00 0.00 C ATOM 1170 CG TYR A 73 -2.109 -6.321 -0.870 1.00 0.00 C ATOM 1171 CD1 TYR A 73 -2.835 -6.839 -1.958 1.00 0.00 C ATOM 1172 CD2 TYR A 73 -2.782 -5.596 0.133 1.00 0.00 C ATOM 1173 CE1 TYR A 73 -4.234 -6.696 -2.000 1.00 0.00 C ATOM 1174 CE2 TYR A 73 -4.184 -5.485 0.107 1.00 0.00 C ATOM 1175 CZ TYR A 73 -4.912 -6.058 -0.948 1.00 0.00 C ATOM 1176 OH TYR A 73 -6.275 -6.073 -0.919 1.00 0.00 O ATOM 0 H TYR A 73 1.747 -6.924 -0.217 1.00 0.00 H new ATOM 0 HA TYR A 73 0.285 -6.246 -2.519 1.00 0.00 H new ATOM 0 HB2 TYR A 73 -0.555 -7.775 -0.905 1.00 0.00 H new ATOM 0 HB3 TYR A 73 -0.419 -6.604 0.392 1.00 0.00 H new ATOM 0 HD1 TYR A 73 -2.319 -7.346 -2.760 1.00 0.00 H new ATOM 0 HD2 TYR A 73 -2.219 -5.124 0.925 1.00 0.00 H new ATOM 0 HE1 TYR A 73 -4.789 -7.078 -2.844 1.00 0.00 H new ATOM 0 HE2 TYR A 73 -4.700 -4.960 0.897 1.00 0.00 H new ATOM 0 HH TYR A 73 -6.582 -6.138 0.009 1.00 0.00 H new ATOM 1186 N ILE A 74 0.472 -3.778 -0.327 1.00 0.00 N ATOM 1187 CA ILE A 74 0.384 -2.330 -0.199 1.00 0.00 C ATOM 1188 C ILE A 74 1.281 -1.637 -1.234 1.00 0.00 C ATOM 1189 O ILE A 74 0.816 -0.813 -2.026 1.00 0.00 O ATOM 1190 CB ILE A 74 0.744 -1.922 1.240 1.00 0.00 C ATOM 1191 CG1 ILE A 74 -0.273 -2.425 2.278 1.00 0.00 C ATOM 1192 CG2 ILE A 74 0.897 -0.405 1.352 1.00 0.00 C ATOM 1193 CD1 ILE A 74 -1.668 -1.800 2.150 1.00 0.00 C ATOM 0 H ILE A 74 0.794 -4.250 0.518 1.00 0.00 H new ATOM 0 HA ILE A 74 -0.637 -2.007 -0.400 1.00 0.00 H new ATOM 0 HB ILE A 74 1.697 -2.401 1.464 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -0.363 -3.507 2.186 1.00 0.00 H new ATOM 0 HG13 ILE A 74 0.113 -2.221 3.277 1.00 0.00 H new ATOM 0 HG21 ILE A 74 1.152 -0.140 2.378 1.00 0.00 H new ATOM 0 HG22 ILE A 74 1.689 -0.069 0.683 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -0.041 0.077 1.075 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -2.322 -2.210 2.919 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -1.595 -0.719 2.273 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -2.079 -2.026 1.166 1.00 0.00 H new ATOM 1205 N THR A 75 2.577 -1.954 -1.229 1.00 0.00 N ATOM 1206 CA THR A 75 3.537 -1.307 -2.118 1.00 0.00 C ATOM 1207 C THR A 75 3.116 -1.487 -3.581 1.00 0.00 C ATOM 1208 O THR A 75 3.229 -0.561 -4.377 1.00 0.00 O ATOM 1209 CB THR A 75 4.950 -1.846 -1.847 1.00 0.00 C ATOM 1210 OG1 THR A 75 5.243 -1.737 -0.468 1.00 0.00 O ATOM 1211 CG2 THR A 75 6.010 -1.051 -2.612 1.00 0.00 C ATOM 0 H THR A 75 2.985 -2.659 -0.615 1.00 0.00 H new ATOM 0 HA THR A 75 3.552 -0.235 -1.919 1.00 0.00 H new ATOM 0 HB THR A 75 4.972 -2.885 -2.175 1.00 0.00 H new ATOM 0 HG1 THR A 75 4.830 -2.483 0.014 1.00 0.00 H new ATOM 0 HG21 THR A 75 6.997 -1.460 -2.397 1.00 0.00 H new ATOM 0 HG22 THR A 75 5.814 -1.120 -3.682 1.00 0.00 H new ATOM 0 HG23 THR A 75 5.975 -0.006 -2.303 1.00 0.00 H new ATOM 1219 N PHE A 76 2.597 -2.665 -3.923 1.00 0.00 N ATOM 1220 CA PHE A 76 2.020 -2.988 -5.219 1.00 0.00 C ATOM 1221 C PHE A 76 0.875 -2.031 -5.565 1.00 0.00 C ATOM 1222 O PHE A 76 0.832 -1.517 -6.682 1.00 0.00 O ATOM 1223 CB PHE A 76 1.575 -4.457 -5.208 1.00 0.00 C ATOM 1224 CG PHE A 76 0.611 -4.855 -6.300 1.00 0.00 C ATOM 1225 CD1 PHE A 76 1.094 -5.296 -7.542 1.00 0.00 C ATOM 1226 CD2 PHE A 76 -0.774 -4.756 -6.077 1.00 0.00 C ATOM 1227 CE1 PHE A 76 0.193 -5.603 -8.573 1.00 0.00 C ATOM 1228 CE2 PHE A 76 -1.675 -5.060 -7.110 1.00 0.00 C ATOM 1229 CZ PHE A 76 -1.192 -5.475 -8.361 1.00 0.00 C ATOM 0 H PHE A 76 2.568 -3.451 -3.274 1.00 0.00 H new ATOM 0 HA PHE A 76 2.767 -2.859 -6.002 1.00 0.00 H new ATOM 0 HB2 PHE A 76 2.461 -5.087 -5.283 1.00 0.00 H new ATOM 0 HB3 PHE A 76 1.113 -4.671 -4.244 1.00 0.00 H new ATOM 0 HD1 PHE A 76 2.157 -5.399 -7.704 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -1.145 -4.446 -5.111 1.00 0.00 H new ATOM 0 HE1 PHE A 76 0.563 -5.938 -9.531 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -2.738 -4.975 -6.942 1.00 0.00 H new ATOM 0 HZ PHE A 76 -1.883 -5.696 -9.161 1.00 0.00 H new ATOM 1239 N LEU A 77 -0.033 -1.759 -4.617 1.00 0.00 N ATOM 1240 CA LEU A 77 -1.088 -0.769 -4.830 1.00 0.00 C ATOM 1241 C LEU A 77 -0.426 0.550 -5.241 1.00 0.00 C ATOM 1242 O LEU A 77 -0.748 1.134 -6.280 1.00 0.00 O ATOM 1243 CB LEU A 77 -1.929 -0.623 -3.548 1.00 0.00 C ATOM 1244 CG LEU A 77 -3.340 -0.047 -3.757 1.00 0.00 C ATOM 1245 CD1 LEU A 77 -4.032 0.058 -2.396 1.00 0.00 C ATOM 1246 CD2 LEU A 77 -3.351 1.347 -4.396 1.00 0.00 C ATOM 0 H LEU A 77 -0.055 -2.210 -3.702 1.00 0.00 H new ATOM 0 HA LEU A 77 -1.767 -1.081 -5.623 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -2.019 -1.602 -3.077 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -1.391 0.018 -2.850 1.00 0.00 H new ATOM 0 HG LEU A 77 -3.854 -0.724 -4.440 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -5.034 0.465 -2.528 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -4.099 -0.932 -1.945 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -3.456 0.716 -1.745 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -4.380 1.686 -4.511 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -2.809 2.044 -3.757 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -2.872 1.303 -5.374 1.00 0.00 H new ATOM 1258 N GLY A 78 0.550 0.977 -4.433 1.00 0.00 N ATOM 1259 CA GLY A 78 1.369 2.143 -4.720 1.00 0.00 C ATOM 1260 C GLY A 78 1.914 2.117 -6.149 1.00 0.00 C ATOM 1261 O GLY A 78 1.729 3.073 -6.897 1.00 0.00 O ATOM 0 H GLY A 78 0.790 0.514 -3.556 1.00 0.00 H new ATOM 0 HA2 GLY A 78 0.778 3.047 -4.573 1.00 0.00 H new ATOM 0 HA3 GLY A 78 2.199 2.186 -4.015 1.00 0.00 H new ATOM 1265 N ALA A 79 2.574 1.022 -6.531 1.00 0.00 N ATOM 1266 CA ALA A 79 3.186 0.853 -7.837 1.00 0.00 C ATOM 1267 C ALA A 79 2.154 1.026 -8.950 1.00 0.00 C ATOM 1268 O ALA A 79 2.357 1.833 -9.852 1.00 0.00 O ATOM 1269 CB ALA A 79 3.880 -0.510 -7.925 1.00 0.00 C ATOM 0 H ALA A 79 2.697 0.213 -5.922 1.00 0.00 H new ATOM 0 HA ALA A 79 3.942 1.627 -7.970 1.00 0.00 H new ATOM 0 HB1 ALA A 79 4.335 -0.624 -8.909 1.00 0.00 H new ATOM 0 HB2 ALA A 79 4.652 -0.575 -7.159 1.00 0.00 H new ATOM 0 HB3 ALA A 79 3.147 -1.302 -7.770 1.00 0.00 H new ATOM 1275 N LEU A 80 1.042 0.286 -8.896 1.00 0.00 N ATOM 1276 CA LEU A 80 0.001 0.394 -9.913 1.00 0.00 C ATOM 1277 C LEU A 80 -0.466 1.842 -10.045 1.00 0.00 C ATOM 1278 O LEU A 80 -0.490 2.384 -11.147 1.00 0.00 O ATOM 1279 CB LEU A 80 -1.177 -0.540 -9.603 1.00 0.00 C ATOM 1280 CG LEU A 80 -1.055 -1.878 -10.348 1.00 0.00 C ATOM 1281 CD1 LEU A 80 0.228 -2.630 -9.977 1.00 0.00 C ATOM 1282 CD2 LEU A 80 -2.278 -2.741 -10.027 1.00 0.00 C ATOM 0 H LEU A 80 0.843 -0.391 -8.160 1.00 0.00 H new ATOM 0 HA LEU A 80 0.424 0.082 -10.868 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -1.222 -0.724 -8.530 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -2.111 -0.052 -9.882 1.00 0.00 H new ATOM 0 HG LEU A 80 -1.008 -1.669 -11.417 1.00 0.00 H new ATOM 0 HD11 LEU A 80 0.271 -3.570 -10.528 1.00 0.00 H new ATOM 0 HD12 LEU A 80 1.094 -2.020 -10.232 1.00 0.00 H new ATOM 0 HD13 LEU A 80 0.232 -2.836 -8.907 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -2.199 -3.693 -10.552 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -2.324 -2.922 -8.953 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -3.182 -2.224 -10.347 1.00 0.00 H new ATOM 1294 N ALA A 81 -0.814 2.479 -8.926 1.00 0.00 N ATOM 1295 CA ALA A 81 -1.239 3.871 -8.952 1.00 0.00 C ATOM 1296 C ALA A 81 -0.162 4.772 -9.573 1.00 0.00 C ATOM 1297 O ALA A 81 -0.458 5.583 -10.451 1.00 0.00 O ATOM 1298 CB ALA A 81 -1.607 4.306 -7.536 1.00 0.00 C ATOM 0 H ALA A 81 -0.809 2.053 -7.999 1.00 0.00 H new ATOM 0 HA ALA A 81 -2.120 3.970 -9.586 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -1.927 5.348 -7.547 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -2.419 3.681 -7.163 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -0.739 4.200 -6.885 1.00 0.00 H new ATOM 1304 N MET A 82 1.090 4.621 -9.141 1.00 0.00 N ATOM 1305 CA MET A 82 2.222 5.382 -9.653 1.00 0.00 C ATOM 1306 C MET A 82 2.374 5.202 -11.166 1.00 0.00 C ATOM 1307 O MET A 82 2.642 6.174 -11.872 1.00 0.00 O ATOM 1308 CB MET A 82 3.491 4.980 -8.889 1.00 0.00 C ATOM 1309 CG MET A 82 4.707 5.823 -9.286 1.00 0.00 C ATOM 1310 SD MET A 82 6.200 5.451 -8.330 1.00 0.00 S ATOM 1311 CE MET A 82 7.358 6.603 -9.101 1.00 0.00 C ATOM 0 H MET A 82 1.347 3.954 -8.413 1.00 0.00 H new ATOM 0 HA MET A 82 2.046 6.445 -9.489 1.00 0.00 H new ATOM 0 HB2 MET A 82 3.315 5.084 -7.818 1.00 0.00 H new ATOM 0 HB3 MET A 82 3.706 3.928 -9.076 1.00 0.00 H new ATOM 0 HG2 MET A 82 4.916 5.666 -10.344 1.00 0.00 H new ATOM 0 HG3 MET A 82 4.462 6.878 -9.163 1.00 0.00 H new ATOM 0 HE1 MET A 82 8.336 6.506 -8.629 1.00 0.00 H new ATOM 0 HE2 MET A 82 7.444 6.376 -10.164 1.00 0.00 H new ATOM 0 HE3 MET A 82 6.994 7.623 -8.976 1.00 0.00 H new ATOM 1321 N ILE A 83 2.215 3.970 -11.656 1.00 0.00 N ATOM 1322 CA ILE A 83 2.284 3.640 -13.075 1.00 0.00 C ATOM 1323 C ILE A 83 1.109 4.272 -13.828 1.00 0.00 C ATOM 1324 O ILE A 83 1.316 4.846 -14.893 1.00 0.00 O ATOM 1325 CB ILE A 83 2.361 2.110 -13.260 1.00 0.00 C ATOM 1326 CG1 ILE A 83 3.706 1.538 -12.766 1.00 0.00 C ATOM 1327 CG2 ILE A 83 2.102 1.683 -14.712 1.00 0.00 C ATOM 1328 CD1 ILE A 83 4.904 1.822 -13.681 1.00 0.00 C ATOM 0 H ILE A 83 2.031 3.161 -11.063 1.00 0.00 H new ATOM 0 HA ILE A 83 3.193 4.060 -13.505 1.00 0.00 H new ATOM 0 HB ILE A 83 1.565 1.692 -12.644 1.00 0.00 H new ATOM 0 HG12 ILE A 83 3.917 1.947 -11.778 1.00 0.00 H new ATOM 0 HG13 ILE A 83 3.604 0.459 -12.649 1.00 0.00 H new ATOM 0 HG21 ILE A 83 2.167 0.598 -14.789 1.00 0.00 H new ATOM 0 HG22 ILE A 83 1.107 2.009 -15.015 1.00 0.00 H new ATOM 0 HG23 ILE A 83 2.847 2.139 -15.364 1.00 0.00 H new ATOM 0 HD11 ILE A 83 5.803 1.381 -13.251 1.00 0.00 H new ATOM 0 HD12 ILE A 83 4.722 1.388 -14.664 1.00 0.00 H new ATOM 0 HD13 ILE A 83 5.039 2.899 -13.779 1.00 0.00 H new ATOM 1340 N TYR A 84 -0.116 4.184 -13.292 1.00 0.00 N ATOM 1341 CA TYR A 84 -1.269 4.866 -13.880 1.00 0.00 C ATOM 1342 C TYR A 84 -0.954 6.360 -14.004 1.00 0.00 C ATOM 1343 O TYR A 84 -1.215 6.981 -15.033 1.00 0.00 O ATOM 1344 CB TYR A 84 -2.538 4.635 -13.045 1.00 0.00 C ATOM 1345 CG TYR A 84 -2.976 3.199 -12.796 1.00 0.00 C ATOM 1346 CD1 TYR A 84 -2.496 2.126 -13.575 1.00 0.00 C ATOM 1347 CD2 TYR A 84 -3.939 2.950 -11.799 1.00 0.00 C ATOM 1348 CE1 TYR A 84 -2.956 0.818 -13.339 1.00 0.00 C ATOM 1349 CE2 TYR A 84 -4.414 1.646 -11.581 1.00 0.00 C ATOM 1350 CZ TYR A 84 -3.919 0.580 -12.345 1.00 0.00 C ATOM 1351 OH TYR A 84 -4.405 -0.677 -12.145 1.00 0.00 O ATOM 0 H TYR A 84 -0.330 3.646 -12.452 1.00 0.00 H new ATOM 0 HA TYR A 84 -1.461 4.455 -14.871 1.00 0.00 H new ATOM 0 HB2 TYR A 84 -2.392 5.113 -12.076 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -3.361 5.155 -13.536 1.00 0.00 H new ATOM 0 HD1 TYR A 84 -1.773 2.309 -14.356 1.00 0.00 H new ATOM 0 HD2 TYR A 84 -4.314 3.766 -11.199 1.00 0.00 H new ATOM 0 HE1 TYR A 84 -2.568 -0.004 -13.923 1.00 0.00 H new ATOM 0 HE2 TYR A 84 -5.162 1.464 -10.823 1.00 0.00 H new ATOM 0 HH TYR A 84 -5.062 -0.662 -11.418 1.00 0.00 H new ATOM 1361 N ASN A 85 -0.377 6.922 -12.939 1.00 0.00 N ATOM 1362 CA ASN A 85 0.247 8.236 -12.886 1.00 0.00 C ATOM 1363 C ASN A 85 -0.729 9.399 -13.054 1.00 0.00 C ATOM 1364 O ASN A 85 -0.963 10.146 -12.109 1.00 0.00 O ATOM 1365 CB ASN A 85 1.411 8.328 -13.883 1.00 0.00 C ATOM 1366 CG ASN A 85 2.442 9.322 -13.372 1.00 0.00 C ATOM 1367 OD1 ASN A 85 2.444 10.488 -13.751 1.00 0.00 O ATOM 1368 ND2 ASN A 85 3.315 8.859 -12.482 1.00 0.00 N ATOM 0 H ASN A 85 -0.333 6.440 -12.041 1.00 0.00 H new ATOM 0 HA ASN A 85 0.640 8.340 -11.875 1.00 0.00 H new ATOM 0 HB2 ASN A 85 1.870 7.348 -14.014 1.00 0.00 H new ATOM 0 HB3 ASN A 85 1.043 8.641 -14.860 1.00 0.00 H new ATOM 0 HD21 ASN A 85 4.021 9.482 -12.088 1.00 0.00 H new ATOM 0 HD22 ASN A 85 3.279 7.881 -12.193 1.00 0.00 H new ATOM 1375 N GLU A 86 -1.308 9.559 -14.244 1.00 0.00 N ATOM 1376 CA GLU A 86 -2.261 10.620 -14.539 1.00 0.00 C ATOM 1377 C GLU A 86 -3.444 10.512 -13.574 1.00 0.00 C ATOM 1378 O GLU A 86 -3.813 11.480 -12.912 1.00 0.00 O ATOM 1379 CB GLU A 86 -2.692 10.507 -16.008 1.00 0.00 C ATOM 1380 CG GLU A 86 -3.598 11.668 -16.435 1.00 0.00 C ATOM 1381 CD GLU A 86 -3.984 11.545 -17.906 1.00 0.00 C ATOM 1382 OE1 GLU A 86 -3.193 12.030 -18.743 1.00 0.00 O ATOM 1383 OE2 GLU A 86 -5.052 10.950 -18.164 1.00 0.00 O ATOM 0 H GLU A 86 -1.124 8.946 -15.038 1.00 0.00 H new ATOM 0 HA GLU A 86 -1.811 11.603 -14.399 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -1.807 10.486 -16.644 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -3.217 9.564 -16.160 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -4.497 11.679 -15.819 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -3.085 12.615 -16.267 1.00 0.00 H new ATOM 1390 N ALA A 87 -4.010 9.303 -13.482 1.00 0.00 N ATOM 1391 CA ALA A 87 -5.097 9.005 -12.563 1.00 0.00 C ATOM 1392 C ALA A 87 -4.696 9.375 -11.135 1.00 0.00 C ATOM 1393 O ALA A 87 -5.419 10.100 -10.458 1.00 0.00 O ATOM 1394 CB ALA A 87 -5.473 7.525 -12.666 1.00 0.00 C ATOM 0 H ALA A 87 -3.720 8.506 -14.048 1.00 0.00 H new ATOM 0 HA ALA A 87 -5.970 9.599 -12.831 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -6.288 7.308 -11.975 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -5.791 7.300 -13.684 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -4.609 6.911 -12.412 1.00 0.00 H new ATOM 1400 N LEU A 88 -3.537 8.879 -10.686 1.00 0.00 N ATOM 1401 CA LEU A 88 -3.009 9.169 -9.360 1.00 0.00 C ATOM 1402 C LEU A 88 -3.009 10.677 -9.114 1.00 0.00 C ATOM 1403 O LEU A 88 -3.670 11.154 -8.193 1.00 0.00 O ATOM 1404 CB LEU A 88 -1.618 8.539 -9.193 1.00 0.00 C ATOM 1405 CG LEU A 88 -0.874 9.005 -7.932 1.00 0.00 C ATOM 1406 CD1 LEU A 88 -1.656 8.674 -6.658 1.00 0.00 C ATOM 1407 CD2 LEU A 88 0.501 8.336 -7.877 1.00 0.00 C ATOM 0 H LEU A 88 -2.941 8.263 -11.239 1.00 0.00 H new ATOM 0 HA LEU A 88 -3.652 8.722 -8.602 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -1.722 7.454 -9.162 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -1.014 8.777 -10.069 1.00 0.00 H new ATOM 0 HG LEU A 88 -0.765 10.088 -7.986 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -1.097 9.019 -5.788 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -2.626 9.171 -6.687 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -1.802 7.596 -6.591 1.00 0.00 H new ATOM 0 HD21 LEU A 88 1.030 8.665 -6.983 1.00 0.00 H new ATOM 0 HD22 LEU A 88 0.378 7.253 -7.848 1.00 0.00 H new ATOM 0 HD23 LEU A 88 1.076 8.612 -8.761 1.00 0.00 H new ATOM 1479 N SER B 3 -13.783 -8.827 -8.216 1.00 0.00 N ATOM 1480 CA SER B 3 -12.763 -8.079 -7.509 1.00 0.00 C ATOM 1481 C SER B 3 -12.131 -7.060 -8.465 1.00 0.00 C ATOM 1482 O SER B 3 -11.009 -7.278 -8.929 1.00 0.00 O ATOM 1483 CB SER B 3 -11.727 -9.089 -6.993 1.00 0.00 C ATOM 1484 OG SER B 3 -11.396 -10.035 -7.995 1.00 0.00 O ATOM 0 HA SER B 3 -13.179 -7.526 -6.667 1.00 0.00 H new ATOM 0 HB2 SER B 3 -10.828 -8.562 -6.674 1.00 0.00 H new ATOM 0 HB3 SER B 3 -12.121 -9.605 -6.117 1.00 0.00 H new ATOM 0 HG SER B 3 -12.124 -10.088 -8.649 1.00 0.00 H new ATOM 1490 N PRO B 4 -12.824 -5.951 -8.775 1.00 0.00 N ATOM 1491 CA PRO B 4 -12.302 -4.903 -9.638 1.00 0.00 C ATOM 1492 C PRO B 4 -11.261 -4.084 -8.867 1.00 0.00 C ATOM 1493 O PRO B 4 -11.488 -2.930 -8.493 1.00 0.00 O ATOM 1494 CB PRO B 4 -13.532 -4.092 -10.052 1.00 0.00 C ATOM 1495 CG PRO B 4 -14.443 -4.207 -8.830 1.00 0.00 C ATOM 1496 CD PRO B 4 -14.177 -5.634 -8.345 1.00 0.00 C ATOM 0 HA PRO B 4 -11.784 -5.272 -10.523 1.00 0.00 H new ATOM 0 HB2 PRO B 4 -13.278 -3.055 -10.270 1.00 0.00 H new ATOM 0 HB3 PRO B 4 -14.003 -4.500 -10.947 1.00 0.00 H new ATOM 0 HG2 PRO B 4 -14.194 -3.468 -8.069 1.00 0.00 H new ATOM 0 HG3 PRO B 4 -15.491 -4.057 -9.090 1.00 0.00 H new ATOM 0 HD2 PRO B 4 -14.269 -5.703 -7.261 1.00 0.00 H new ATOM 0 HD3 PRO B 4 -14.897 -6.333 -8.771 1.00 0.00 H new ATOM 1504 N LEU B 5 -10.096 -4.686 -8.617 1.00 0.00 N ATOM 1505 CA LEU B 5 -9.050 -4.032 -7.847 1.00 0.00 C ATOM 1506 C LEU B 5 -8.657 -2.709 -8.508 1.00 0.00 C ATOM 1507 O LEU B 5 -8.361 -1.741 -7.816 1.00 0.00 O ATOM 1508 CB LEU B 5 -7.852 -4.968 -7.650 1.00 0.00 C ATOM 1509 CG LEU B 5 -6.916 -4.493 -6.525 1.00 0.00 C ATOM 1510 CD1 LEU B 5 -7.520 -4.712 -5.131 1.00 0.00 C ATOM 1511 CD2 LEU B 5 -5.602 -5.272 -6.608 1.00 0.00 C ATOM 0 H LEU B 5 -9.859 -5.624 -8.939 1.00 0.00 H new ATOM 0 HA LEU B 5 -9.431 -3.798 -6.853 1.00 0.00 H new ATOM 0 HB2 LEU B 5 -8.212 -5.971 -7.420 1.00 0.00 H new ATOM 0 HB3 LEU B 5 -7.290 -5.036 -8.582 1.00 0.00 H new ATOM 0 HG LEU B 5 -6.757 -3.423 -6.662 1.00 0.00 H new ATOM 0 HD11 LEU B 5 -6.821 -4.361 -4.372 1.00 0.00 H new ATOM 0 HD12 LEU B 5 -8.455 -4.157 -5.048 1.00 0.00 H new ATOM 0 HD13 LEU B 5 -7.714 -5.774 -4.981 1.00 0.00 H new ATOM 0 HD21 LEU B 5 -4.932 -4.942 -5.814 1.00 0.00 H new ATOM 0 HD22 LEU B 5 -5.803 -6.337 -6.494 1.00 0.00 H new ATOM 0 HD23 LEU B 5 -5.133 -5.093 -7.576 1.00 0.00 H new ATOM 1523 N ASP B 6 -8.715 -2.631 -9.838 1.00 0.00 N ATOM 1524 CA ASP B 6 -8.566 -1.380 -10.567 1.00 0.00 C ATOM 1525 C ASP B 6 -9.522 -0.294 -10.065 1.00 0.00 C ATOM 1526 O ASP B 6 -9.104 0.839 -9.841 1.00 0.00 O ATOM 1527 CB ASP B 6 -8.717 -1.611 -12.079 1.00 0.00 C ATOM 1528 CG ASP B 6 -10.145 -1.962 -12.505 1.00 0.00 C ATOM 1529 OD1 ASP B 6 -10.775 -2.785 -11.803 1.00 0.00 O ATOM 1530 OD2 ASP B 6 -10.587 -1.388 -13.522 1.00 0.00 O ATOM 0 H ASP B 6 -8.868 -3.441 -10.439 1.00 0.00 H new ATOM 0 HA ASP B 6 -7.558 -1.012 -10.377 1.00 0.00 H new ATOM 0 HB2 ASP B 6 -8.399 -0.713 -12.609 1.00 0.00 H new ATOM 0 HB3 ASP B 6 -8.048 -2.415 -12.384 1.00 0.00 H new ATOM 1535 N GLN B 7 -10.798 -0.628 -9.863 1.00 0.00 N ATOM 1536 CA GLN B 7 -11.768 0.311 -9.325 1.00 0.00 C ATOM 1537 C GLN B 7 -11.393 0.650 -7.886 1.00 0.00 C ATOM 1538 O GLN B 7 -11.550 1.798 -7.466 1.00 0.00 O ATOM 1539 CB GLN B 7 -13.187 -0.265 -9.450 1.00 0.00 C ATOM 1540 CG GLN B 7 -14.299 0.734 -9.090 1.00 0.00 C ATOM 1541 CD GLN B 7 -14.796 0.587 -7.652 1.00 0.00 C ATOM 1542 OE1 GLN B 7 -15.769 -0.114 -7.400 1.00 0.00 O ATOM 1543 NE2 GLN B 7 -14.151 1.246 -6.697 1.00 0.00 N ATOM 0 H GLN B 7 -11.180 -1.551 -10.068 1.00 0.00 H new ATOM 0 HA GLN B 7 -11.756 1.239 -9.897 1.00 0.00 H new ATOM 0 HB2 GLN B 7 -13.340 -0.610 -10.473 1.00 0.00 H new ATOM 0 HB3 GLN B 7 -13.273 -1.138 -8.803 1.00 0.00 H new ATOM 0 HG2 GLN B 7 -13.929 1.749 -9.238 1.00 0.00 H new ATOM 0 HG3 GLN B 7 -15.137 0.597 -9.773 1.00 0.00 H new ATOM 0 HE21 GLN B 7 -13.344 1.823 -6.932 1.00 0.00 H new ATOM 0 HE22 GLN B 7 -14.463 1.175 -5.728 1.00 0.00 H new ATOM 1552 N ALA B 8 -10.905 -0.332 -7.123 1.00 0.00 N ATOM 1553 CA ALA B 8 -10.511 -0.087 -5.736 1.00 0.00 C ATOM 1554 C ALA B 8 -9.376 0.943 -5.682 1.00 0.00 C ATOM 1555 O ALA B 8 -9.454 1.945 -4.970 1.00 0.00 O ATOM 1556 CB ALA B 8 -10.111 -1.395 -5.049 1.00 0.00 C ATOM 0 H ALA B 8 -10.775 -1.293 -7.439 1.00 0.00 H new ATOM 0 HA ALA B 8 -11.364 0.322 -5.195 1.00 0.00 H new ATOM 0 HB1 ALA B 8 -9.821 -1.191 -4.018 1.00 0.00 H new ATOM 0 HB2 ALA B 8 -10.955 -2.084 -5.059 1.00 0.00 H new ATOM 0 HB3 ALA B 8 -9.271 -1.843 -5.580 1.00 0.00 H new ATOM 1562 N ILE B 9 -8.333 0.700 -6.475 1.00 0.00 N ATOM 1563 CA ILE B 9 -7.210 1.604 -6.661 1.00 0.00 C ATOM 1564 C ILE B 9 -7.745 2.964 -7.108 1.00 0.00 C ATOM 1565 O ILE B 9 -7.369 3.981 -6.537 1.00 0.00 O ATOM 1566 CB ILE B 9 -6.200 0.998 -7.656 1.00 0.00 C ATOM 1567 CG1 ILE B 9 -5.567 -0.276 -7.065 1.00 0.00 C ATOM 1568 CG2 ILE B 9 -5.099 2.018 -7.980 1.00 0.00 C ATOM 1569 CD1 ILE B 9 -4.922 -1.169 -8.129 1.00 0.00 C ATOM 0 H ILE B 9 -8.248 -0.158 -7.020 1.00 0.00 H new ATOM 0 HA ILE B 9 -6.670 1.748 -5.725 1.00 0.00 H new ATOM 0 HB ILE B 9 -6.730 0.740 -8.573 1.00 0.00 H new ATOM 0 HG12 ILE B 9 -4.814 0.006 -6.329 1.00 0.00 H new ATOM 0 HG13 ILE B 9 -6.332 -0.844 -6.536 1.00 0.00 H new ATOM 0 HG21 ILE B 9 -4.392 1.579 -8.683 1.00 0.00 H new ATOM 0 HG22 ILE B 9 -5.546 2.908 -8.423 1.00 0.00 H new ATOM 0 HG23 ILE B 9 -4.576 2.293 -7.064 1.00 0.00 H new ATOM 0 HD11 ILE B 9 -4.493 -2.051 -7.653 1.00 0.00 H new ATOM 0 HD12 ILE B 9 -5.678 -1.478 -8.851 1.00 0.00 H new ATOM 0 HD13 ILE B 9 -4.136 -0.615 -8.641 1.00 0.00 H new ATOM 1581 N GLY B 10 -8.646 2.983 -8.093 1.00 0.00 N ATOM 1582 CA GLY B 10 -9.340 4.184 -8.535 1.00 0.00 C ATOM 1583 C GLY B 10 -9.947 4.958 -7.363 1.00 0.00 C ATOM 1584 O GLY B 10 -9.758 6.166 -7.252 1.00 0.00 O ATOM 0 H GLY B 10 -8.915 2.147 -8.612 1.00 0.00 H new ATOM 0 HA2 GLY B 10 -8.644 4.828 -9.073 1.00 0.00 H new ATOM 0 HA3 GLY B 10 -10.128 3.910 -9.236 1.00 0.00 H new ATOM 1588 N LEU B 11 -10.672 4.270 -6.479 1.00 0.00 N ATOM 1589 CA LEU B 11 -11.292 4.871 -5.304 1.00 0.00 C ATOM 1590 C LEU B 11 -10.214 5.505 -4.414 1.00 0.00 C ATOM 1591 O LEU B 11 -10.301 6.681 -4.055 1.00 0.00 O ATOM 1592 CB LEU B 11 -12.106 3.797 -4.556 1.00 0.00 C ATOM 1593 CG LEU B 11 -13.316 4.306 -3.755 1.00 0.00 C ATOM 1594 CD1 LEU B 11 -12.956 5.409 -2.757 1.00 0.00 C ATOM 1595 CD2 LEU B 11 -14.456 4.772 -4.667 1.00 0.00 C ATOM 0 H LEU B 11 -10.845 3.268 -6.563 1.00 0.00 H new ATOM 0 HA LEU B 11 -11.977 5.666 -5.600 1.00 0.00 H new ATOM 0 HB2 LEU B 11 -12.458 3.065 -5.282 1.00 0.00 H new ATOM 0 HB3 LEU B 11 -11.438 3.273 -3.873 1.00 0.00 H new ATOM 0 HG LEU B 11 -13.661 3.446 -3.180 1.00 0.00 H new ATOM 0 HD11 LEU B 11 -13.853 5.725 -2.224 1.00 0.00 H new ATOM 0 HD12 LEU B 11 -12.225 5.029 -2.043 1.00 0.00 H new ATOM 0 HD13 LEU B 11 -12.534 6.260 -3.292 1.00 0.00 H new ATOM 0 HD21 LEU B 11 -15.289 5.123 -4.058 1.00 0.00 H new ATOM 0 HD22 LEU B 11 -14.104 5.584 -5.303 1.00 0.00 H new ATOM 0 HD23 LEU B 11 -14.787 3.941 -5.290 1.00 0.00 H new ATOM 1607 N LEU B 12 -9.187 4.718 -4.074 1.00 0.00 N ATOM 1608 CA LEU B 12 -8.079 5.146 -3.224 1.00 0.00 C ATOM 1609 C LEU B 12 -7.416 6.404 -3.803 1.00 0.00 C ATOM 1610 O LEU B 12 -7.263 7.416 -3.119 1.00 0.00 O ATOM 1611 CB LEU B 12 -7.103 3.968 -3.056 1.00 0.00 C ATOM 1612 CG LEU B 12 -5.941 4.169 -2.065 1.00 0.00 C ATOM 1613 CD1 LEU B 12 -4.772 4.968 -2.656 1.00 0.00 C ATOM 1614 CD2 LEU B 12 -6.409 4.770 -0.733 1.00 0.00 C ATOM 0 H LEU B 12 -9.105 3.751 -4.389 1.00 0.00 H new ATOM 0 HA LEU B 12 -8.437 5.425 -2.233 1.00 0.00 H new ATOM 0 HB2 LEU B 12 -7.674 3.096 -2.739 1.00 0.00 H new ATOM 0 HB3 LEU B 12 -6.680 3.734 -4.033 1.00 0.00 H new ATOM 0 HG LEU B 12 -5.560 3.168 -1.860 1.00 0.00 H new ATOM 0 HD11 LEU B 12 -3.988 5.073 -1.907 1.00 0.00 H new ATOM 0 HD12 LEU B 12 -4.375 4.443 -3.525 1.00 0.00 H new ATOM 0 HD13 LEU B 12 -5.122 5.956 -2.957 1.00 0.00 H new ATOM 0 HD21 LEU B 12 -5.554 4.892 -0.069 1.00 0.00 H new ATOM 0 HD22 LEU B 12 -6.870 5.741 -0.914 1.00 0.00 H new ATOM 0 HD23 LEU B 12 -7.137 4.104 -0.269 1.00 0.00 H new ATOM 1626 N ILE B 13 -7.048 6.338 -5.084 1.00 0.00 N ATOM 1627 CA ILE B 13 -6.552 7.459 -5.870 1.00 0.00 C ATOM 1628 C ILE B 13 -7.492 8.656 -5.717 1.00 0.00 C ATOM 1629 O ILE B 13 -7.043 9.754 -5.395 1.00 0.00 O ATOM 1630 CB ILE B 13 -6.397 7.009 -7.336 1.00 0.00 C ATOM 1631 CG1 ILE B 13 -5.094 6.204 -7.481 1.00 0.00 C ATOM 1632 CG2 ILE B 13 -6.451 8.193 -8.307 1.00 0.00 C ATOM 1633 CD1 ILE B 13 -4.918 5.608 -8.881 1.00 0.00 C ATOM 0 H ILE B 13 -7.090 5.470 -5.617 1.00 0.00 H new ATOM 0 HA ILE B 13 -5.573 7.779 -5.513 1.00 0.00 H new ATOM 0 HB ILE B 13 -7.238 6.368 -7.600 1.00 0.00 H new ATOM 0 HG12 ILE B 13 -4.246 6.851 -7.257 1.00 0.00 H new ATOM 0 HG13 ILE B 13 -5.085 5.400 -6.745 1.00 0.00 H new ATOM 0 HG21 ILE B 13 -6.338 7.831 -9.329 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -7.409 8.702 -8.207 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -5.644 8.889 -8.077 1.00 0.00 H new ATOM 0 HD11 ILE B 13 -3.982 5.051 -8.924 1.00 0.00 H new ATOM 0 HD12 ILE B 13 -5.749 4.937 -9.098 1.00 0.00 H new ATOM 0 HD13 ILE B 13 -4.897 6.411 -9.618 1.00 0.00 H new ATOM 1645 N GLY B 14 -8.787 8.429 -5.945 1.00 0.00 N ATOM 1646 CA GLY B 14 -9.831 9.429 -5.827 1.00 0.00 C ATOM 1647 C GLY B 14 -9.697 10.201 -4.521 1.00 0.00 C ATOM 1648 O GLY B 14 -9.432 11.401 -4.537 1.00 0.00 O ATOM 0 H GLY B 14 -9.141 7.514 -6.225 1.00 0.00 H new ATOM 0 HA2 GLY B 14 -9.777 10.119 -6.669 1.00 0.00 H new ATOM 0 HA3 GLY B 14 -10.808 8.948 -5.871 1.00 0.00 H new ATOM 1652 N ILE B 15 -9.867 9.517 -3.383 1.00 0.00 N ATOM 1653 CA ILE B 15 -9.784 10.188 -2.088 1.00 0.00 C ATOM 1654 C ILE B 15 -8.420 10.860 -1.916 1.00 0.00 C ATOM 1655 O ILE B 15 -8.358 12.041 -1.570 1.00 0.00 O ATOM 1656 CB ILE B 15 -10.182 9.264 -0.921 1.00 0.00 C ATOM 1657 CG1 ILE B 15 -10.107 9.961 0.452 1.00 0.00 C ATOM 1658 CG2 ILE B 15 -9.363 7.972 -0.837 1.00 0.00 C ATOM 1659 CD1 ILE B 15 -10.979 11.212 0.567 1.00 0.00 C ATOM 0 H ILE B 15 -10.059 8.516 -3.335 1.00 0.00 H new ATOM 0 HA ILE B 15 -10.526 10.986 -2.067 1.00 0.00 H new ATOM 0 HB ILE B 15 -11.216 9.008 -1.152 1.00 0.00 H new ATOM 0 HG12 ILE B 15 -10.405 9.252 1.224 1.00 0.00 H new ATOM 0 HG13 ILE B 15 -9.071 10.234 0.653 1.00 0.00 H new ATOM 0 HG21 ILE B 15 -9.706 7.378 0.011 1.00 0.00 H new ATOM 0 HG22 ILE B 15 -9.491 7.400 -1.756 1.00 0.00 H new ATOM 0 HG23 ILE B 15 -8.309 8.217 -0.706 1.00 0.00 H new ATOM 0 HD11 ILE B 15 -10.869 11.642 1.563 1.00 0.00 H new ATOM 0 HD12 ILE B 15 -10.668 11.942 -0.180 1.00 0.00 H new ATOM 0 HD13 ILE B 15 -12.023 10.945 0.400 1.00 0.00 H new ATOM 1671 N PHE B 16 -7.336 10.128 -2.198 1.00 0.00 N ATOM 1672 CA PHE B 16 -5.982 10.653 -2.091 1.00 0.00 C ATOM 1673 C PHE B 16 -5.867 12.018 -2.764 1.00 0.00 C ATOM 1674 O PHE B 16 -5.444 12.976 -2.117 1.00 0.00 O ATOM 1675 CB PHE B 16 -4.967 9.662 -2.676 1.00 0.00 C ATOM 1676 CG PHE B 16 -3.568 10.235 -2.814 1.00 0.00 C ATOM 1677 CD1 PHE B 16 -2.811 10.519 -1.663 1.00 0.00 C ATOM 1678 CD2 PHE B 16 -3.103 10.659 -4.073 1.00 0.00 C ATOM 1679 CE1 PHE B 16 -1.565 11.160 -1.777 1.00 0.00 C ATOM 1680 CE2 PHE B 16 -1.859 11.304 -4.187 1.00 0.00 C ATOM 1681 CZ PHE B 16 -1.082 11.540 -3.041 1.00 0.00 C ATOM 0 H PHE B 16 -7.379 9.157 -2.506 1.00 0.00 H new ATOM 0 HA PHE B 16 -5.754 10.785 -1.033 1.00 0.00 H new ATOM 0 HB2 PHE B 16 -4.927 8.778 -2.040 1.00 0.00 H new ATOM 0 HB3 PHE B 16 -5.315 9.335 -3.656 1.00 0.00 H new ATOM 0 HD1 PHE B 16 -3.188 10.244 -0.689 1.00 0.00 H new ATOM 0 HD2 PHE B 16 -3.704 10.488 -4.954 1.00 0.00 H new ATOM 0 HE1 PHE B 16 -0.978 11.361 -0.893 1.00 0.00 H new ATOM 0 HE2 PHE B 16 -1.501 11.618 -5.156 1.00 0.00 H new ATOM 0 HZ PHE B 16 -0.115 12.013 -3.131 1.00 0.00 H new ATOM 1691 N HIS B 17 -6.239 12.117 -4.046 1.00 0.00 N ATOM 1692 CA HIS B 17 -6.058 13.347 -4.800 1.00 0.00 C ATOM 1693 C HIS B 17 -7.131 14.406 -4.540 1.00 0.00 C ATOM 1694 O HIS B 17 -7.031 15.495 -5.099 1.00 0.00 O ATOM 1695 CB HIS B 17 -5.743 13.092 -6.279 1.00 0.00 C ATOM 1696 CG HIS B 17 -6.800 12.425 -7.120 1.00 0.00 C ATOM 1697 ND1 HIS B 17 -6.536 11.601 -8.191 1.00 0.00 N ATOM 1698 CD2 HIS B 17 -8.143 12.702 -7.136 1.00 0.00 C ATOM 1699 CE1 HIS B 17 -7.700 11.371 -8.821 1.00 0.00 C ATOM 1700 NE2 HIS B 17 -8.707 12.024 -8.220 1.00 0.00 N ATOM 0 H HIS B 17 -6.666 11.357 -4.576 1.00 0.00 H new ATOM 0 HA HIS B 17 -5.157 13.812 -4.399 1.00 0.00 H new ATOM 0 HB2 HIS B 17 -5.504 14.050 -6.740 1.00 0.00 H new ATOM 0 HB3 HIS B 17 -4.842 12.481 -6.328 1.00 0.00 H new ATOM 0 HD1 HIS B 17 -5.623 11.232 -8.458 1.00 0.00 H new ATOM 0 HD2 HIS B 17 -8.671 13.332 -6.435 1.00 0.00 H new ATOM 0 HE1 HIS B 17 -7.811 10.745 -9.694 1.00 0.00 H new ATOM 1708 N LYS B 18 -8.140 14.147 -3.697 1.00 0.00 N ATOM 1709 CA LYS B 18 -8.986 15.252 -3.254 1.00 0.00 C ATOM 1710 C LYS B 18 -8.115 16.163 -2.395 1.00 0.00 C ATOM 1711 O LYS B 18 -7.988 17.353 -2.664 1.00 0.00 O ATOM 1712 CB LYS B 18 -10.225 14.785 -2.481 1.00 0.00 C ATOM 1713 CG LYS B 18 -11.189 14.020 -3.393 1.00 0.00 C ATOM 1714 CD LYS B 18 -12.642 14.089 -2.902 1.00 0.00 C ATOM 1715 CE LYS B 18 -12.822 13.400 -1.547 1.00 0.00 C ATOM 1716 NZ LYS B 18 -14.220 13.473 -1.089 1.00 0.00 N ATOM 0 H LYS B 18 -8.380 13.228 -3.326 1.00 0.00 H new ATOM 0 HA LYS B 18 -9.376 15.780 -4.124 1.00 0.00 H new ATOM 0 HB2 LYS B 18 -9.921 14.147 -1.652 1.00 0.00 H new ATOM 0 HB3 LYS B 18 -10.734 15.647 -2.050 1.00 0.00 H new ATOM 0 HG2 LYS B 18 -11.130 14.428 -4.402 1.00 0.00 H new ATOM 0 HG3 LYS B 18 -10.878 12.977 -3.452 1.00 0.00 H new ATOM 0 HD2 LYS B 18 -12.949 15.132 -2.822 1.00 0.00 H new ATOM 0 HD3 LYS B 18 -13.296 13.620 -3.637 1.00 0.00 H new ATOM 0 HE2 LYS B 18 -12.517 12.356 -1.624 1.00 0.00 H new ATOM 0 HE3 LYS B 18 -12.171 13.869 -0.809 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 -14.309 12.997 -0.168 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 -14.502 14.469 -0.993 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 -14.837 13.004 -1.782 1.00 0.00 H new ATOM 1730 N TYR B 19 -7.471 15.573 -1.387 1.00 0.00 N ATOM 1731 CA TYR B 19 -6.491 16.284 -0.581 1.00 0.00 C ATOM 1732 C TYR B 19 -5.270 16.651 -1.425 1.00 0.00 C ATOM 1733 O TYR B 19 -4.767 17.769 -1.366 1.00 0.00 O ATOM 1734 CB TYR B 19 -6.049 15.397 0.586 1.00 0.00 C ATOM 1735 CG TYR B 19 -7.133 15.031 1.579 1.00 0.00 C ATOM 1736 CD1 TYR B 19 -7.700 16.028 2.392 1.00 0.00 C ATOM 1737 CD2 TYR B 19 -7.446 13.680 1.813 1.00 0.00 C ATOM 1738 CE1 TYR B 19 -8.486 15.674 3.500 1.00 0.00 C ATOM 1739 CE2 TYR B 19 -8.263 13.327 2.904 1.00 0.00 C ATOM 1740 CZ TYR B 19 -8.765 14.324 3.759 1.00 0.00 C ATOM 1741 OH TYR B 19 -9.512 13.975 4.845 1.00 0.00 O ATOM 0 H TYR B 19 -7.615 14.601 -1.113 1.00 0.00 H new ATOM 0 HA TYR B 19 -6.947 17.198 -0.201 1.00 0.00 H new ATOM 0 HB2 TYR B 19 -5.628 14.477 0.180 1.00 0.00 H new ATOM 0 HB3 TYR B 19 -5.247 15.905 1.122 1.00 0.00 H new ATOM 0 HD1 TYR B 19 -7.530 17.070 2.163 1.00 0.00 H new ATOM 0 HD2 TYR B 19 -7.060 12.914 1.157 1.00 0.00 H new ATOM 0 HE1 TYR B 19 -8.876 16.441 4.153 1.00 0.00 H new ATOM 0 HE2 TYR B 19 -8.504 12.290 3.084 1.00 0.00 H new ATOM 0 HH TYR B 19 -9.745 14.779 5.354 1.00 0.00 H new ATOM 1751 N SER B 20 -4.766 15.671 -2.170 1.00 0.00 N ATOM 1752 CA SER B 20 -3.490 15.747 -2.860 1.00 0.00 C ATOM 1753 C SER B 20 -3.663 16.082 -4.345 1.00 0.00 C ATOM 1754 O SER B 20 -3.006 15.471 -5.186 1.00 0.00 O ATOM 1755 CB SER B 20 -2.764 14.408 -2.676 1.00 0.00 C ATOM 1756 OG SER B 20 -2.943 13.922 -1.358 1.00 0.00 O ATOM 0 H SER B 20 -5.248 14.783 -2.311 1.00 0.00 H new ATOM 0 HA SER B 20 -2.897 16.555 -2.432 1.00 0.00 H new ATOM 0 HB2 SER B 20 -3.144 13.680 -3.393 1.00 0.00 H new ATOM 0 HB3 SER B 20 -1.701 14.533 -2.882 1.00 0.00 H new ATOM 0 HG SER B 20 -2.615 13.000 -1.302 1.00 0.00 H new ATOM 1762 N GLY B 21 -4.532 17.027 -4.704 1.00 0.00 N ATOM 1763 CA GLY B 21 -4.705 17.374 -6.108 1.00 0.00 C ATOM 1764 C GLY B 21 -5.738 18.474 -6.284 1.00 0.00 C ATOM 1765 O GLY B 21 -5.419 19.550 -6.791 1.00 0.00 O ATOM 0 H GLY B 21 -5.115 17.555 -4.054 1.00 0.00 H new ATOM 0 HA2 GLY B 21 -3.751 17.698 -6.524 1.00 0.00 H new ATOM 0 HA3 GLY B 21 -5.013 16.491 -6.667 1.00 0.00 H new ATOM 1769 N LYS B 22 -6.983 18.210 -5.880 1.00 0.00 N ATOM 1770 CA LYS B 22 -8.063 19.181 -5.928 1.00 0.00 C ATOM 1771 C LYS B 22 -7.846 20.220 -4.823 1.00 0.00 C ATOM 1772 O LYS B 22 -8.568 20.259 -3.830 1.00 0.00 O ATOM 1773 CB LYS B 22 -9.420 18.464 -5.828 1.00 0.00 C ATOM 1774 CG LYS B 22 -9.571 17.260 -6.776 1.00 0.00 C ATOM 1775 CD LYS B 22 -9.170 17.523 -8.234 1.00 0.00 C ATOM 1776 CE LYS B 22 -9.963 18.684 -8.834 1.00 0.00 C ATOM 1777 NZ LYS B 22 -9.628 18.881 -10.254 1.00 0.00 N ATOM 0 H LYS B 22 -7.266 17.304 -5.507 1.00 0.00 H new ATOM 0 HA LYS B 22 -8.066 19.711 -6.880 1.00 0.00 H new ATOM 0 HB2 LYS B 22 -9.564 18.124 -4.802 1.00 0.00 H new ATOM 0 HB3 LYS B 22 -10.213 19.181 -6.041 1.00 0.00 H new ATOM 0 HG2 LYS B 22 -8.967 16.438 -6.392 1.00 0.00 H new ATOM 0 HG3 LYS B 22 -10.609 16.929 -6.755 1.00 0.00 H new ATOM 0 HD2 LYS B 22 -8.104 17.745 -8.285 1.00 0.00 H new ATOM 0 HD3 LYS B 22 -9.337 16.623 -8.826 1.00 0.00 H new ATOM 0 HE2 LYS B 22 -11.031 18.489 -8.733 1.00 0.00 H new ATOM 0 HE3 LYS B 22 -9.752 19.597 -8.278 1.00 0.00 H new ATOM 0 HZ1 LYS B 22 -10.181 19.675 -10.634 1.00 0.00 H new ATOM 0 HZ2 LYS B 22 -8.613 19.091 -10.345 1.00 0.00 H new ATOM 0 HZ3 LYS B 22 -9.852 18.016 -10.787 1.00 0.00 H new ATOM 1791 N GLU B 23 -6.839 21.074 -5.025 1.00 0.00 N ATOM 1792 CA GLU B 23 -6.301 21.977 -4.024 1.00 0.00 C ATOM 1793 C GLU B 23 -5.695 21.133 -2.891 1.00 0.00 C ATOM 1794 O GLU B 23 -5.285 19.997 -3.127 1.00 0.00 O ATOM 1795 CB GLU B 23 -7.335 23.033 -3.578 1.00 0.00 C ATOM 1796 CG GLU B 23 -7.933 23.829 -4.752 1.00 0.00 C ATOM 1797 CD GLU B 23 -9.069 23.100 -5.470 1.00 0.00 C ATOM 1798 OE1 GLU B 23 -10.154 23.001 -4.858 1.00 0.00 O ATOM 1799 OE2 GLU B 23 -8.839 22.669 -6.622 1.00 0.00 O ATOM 0 H GLU B 23 -6.364 21.152 -5.924 1.00 0.00 H new ATOM 0 HA GLU B 23 -5.497 22.583 -4.442 1.00 0.00 H new ATOM 0 HB2 GLU B 23 -8.140 22.537 -3.036 1.00 0.00 H new ATOM 0 HB3 GLU B 23 -6.861 23.725 -2.882 1.00 0.00 H new ATOM 0 HG2 GLU B 23 -8.303 24.785 -4.381 1.00 0.00 H new ATOM 0 HG3 GLU B 23 -7.143 24.050 -5.470 1.00 0.00 H new ATOM 1806 N GLY B 24 -5.598 21.688 -1.679 1.00 0.00 N ATOM 1807 CA GLY B 24 -4.974 21.022 -0.545 1.00 0.00 C ATOM 1808 C GLY B 24 -3.458 20.937 -0.728 1.00 0.00 C ATOM 1809 O GLY B 24 -2.723 21.738 -0.151 1.00 0.00 O ATOM 0 H GLY B 24 -5.955 22.619 -1.462 1.00 0.00 H new ATOM 0 HA2 GLY B 24 -5.204 21.565 0.372 1.00 0.00 H new ATOM 0 HA3 GLY B 24 -5.388 20.020 -0.434 1.00 0.00 H new ATOM 1813 N ASP B 25 -2.984 19.987 -1.538 1.00 0.00 N ATOM 1814 CA ASP B 25 -1.573 19.807 -1.863 1.00 0.00 C ATOM 1815 C ASP B 25 -1.470 19.162 -3.252 1.00 0.00 C ATOM 1816 O ASP B 25 -2.464 18.672 -3.773 1.00 0.00 O ATOM 1817 CB ASP B 25 -0.902 18.993 -0.746 1.00 0.00 C ATOM 1818 CG ASP B 25 0.626 18.960 -0.807 1.00 0.00 C ATOM 1819 OD1 ASP B 25 1.196 19.640 -1.689 1.00 0.00 O ATOM 1820 OD2 ASP B 25 1.209 18.288 0.070 1.00 0.00 O ATOM 0 H ASP B 25 -3.589 19.306 -1.996 1.00 0.00 H new ATOM 0 HA ASP B 25 -1.041 20.757 -1.915 1.00 0.00 H new ATOM 0 HB2 ASP B 25 -1.205 19.405 0.217 1.00 0.00 H new ATOM 0 HB3 ASP B 25 -1.276 17.970 -0.786 1.00 0.00 H new ATOM 1825 N LYS B 26 -0.297 19.203 -3.886 1.00 0.00 N ATOM 1826 CA LYS B 26 -0.113 18.842 -5.287 1.00 0.00 C ATOM 1827 C LYS B 26 0.442 17.422 -5.420 1.00 0.00 C ATOM 1828 O LYS B 26 1.651 17.224 -5.305 1.00 0.00 O ATOM 1829 CB LYS B 26 0.828 19.865 -5.942 1.00 0.00 C ATOM 1830 CG LYS B 26 0.258 21.288 -5.868 1.00 0.00 C ATOM 1831 CD LYS B 26 1.221 22.276 -6.537 1.00 0.00 C ATOM 1832 CE LYS B 26 0.680 23.705 -6.428 1.00 0.00 C ATOM 1833 NZ LYS B 26 1.602 24.675 -7.043 1.00 0.00 N ATOM 0 H LYS B 26 0.567 19.494 -3.428 1.00 0.00 H new ATOM 0 HA LYS B 26 -1.077 18.859 -5.795 1.00 0.00 H new ATOM 0 HB2 LYS B 26 1.799 19.836 -5.447 1.00 0.00 H new ATOM 0 HB3 LYS B 26 0.993 19.593 -6.984 1.00 0.00 H new ATOM 0 HG2 LYS B 26 -0.714 21.325 -6.360 1.00 0.00 H new ATOM 0 HG3 LYS B 26 0.099 21.571 -4.827 1.00 0.00 H new ATOM 0 HD2 LYS B 26 2.201 22.214 -6.065 1.00 0.00 H new ATOM 0 HD3 LYS B 26 1.355 22.010 -7.586 1.00 0.00 H new ATOM 0 HE2 LYS B 26 -0.293 23.766 -6.915 1.00 0.00 H new ATOM 0 HE3 LYS B 26 0.528 23.959 -5.379 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 1.208 25.633 -6.953 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 2.523 24.633 -6.561 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 1.727 24.445 -8.049 1.00 0.00 H new ATOM 1847 N HIS B 27 -0.429 16.431 -5.656 1.00 0.00 N ATOM 1848 CA HIS B 27 -0.060 15.052 -6.004 1.00 0.00 C ATOM 1849 C HIS B 27 0.765 14.354 -4.914 1.00 0.00 C ATOM 1850 O HIS B 27 1.280 13.255 -5.109 1.00 0.00 O ATOM 1851 CB HIS B 27 0.631 15.023 -7.373 1.00 0.00 C ATOM 1852 CG HIS B 27 -0.071 15.863 -8.416 1.00 0.00 C ATOM 1853 ND1 HIS B 27 -1.430 15.939 -8.635 1.00 0.00 N ATOM 1854 CD2 HIS B 27 0.530 16.772 -9.245 1.00 0.00 C ATOM 1855 CE1 HIS B 27 -1.634 16.864 -9.589 1.00 0.00 C ATOM 1856 NE2 HIS B 27 -0.470 17.396 -9.995 1.00 0.00 N ATOM 0 H HIS B 27 -1.438 16.571 -5.609 1.00 0.00 H new ATOM 0 HA HIS B 27 -0.980 14.472 -6.072 1.00 0.00 H new ATOM 0 HB2 HIS B 27 1.656 15.376 -7.262 1.00 0.00 H new ATOM 0 HB3 HIS B 27 0.685 13.992 -7.723 1.00 0.00 H new ATOM 0 HD2 HIS B 27 1.590 16.971 -9.308 1.00 0.00 H new ATOM 0 HE1 HIS B 27 -2.603 17.142 -9.976 1.00 0.00 H new ATOM 0 HE2 HIS B 27 -0.341 18.113 -10.709 1.00 0.00 H new ATOM 1864 N THR B 28 0.866 14.999 -3.756 1.00 0.00 N ATOM 1865 CA THR B 28 1.567 14.623 -2.553 1.00 0.00 C ATOM 1866 C THR B 28 0.671 15.185 -1.448 1.00 0.00 C ATOM 1867 O THR B 28 -0.111 16.098 -1.726 1.00 0.00 O ATOM 1868 CB THR B 28 2.969 15.251 -2.573 1.00 0.00 C ATOM 1869 OG1 THR B 28 2.888 16.642 -2.824 1.00 0.00 O ATOM 1870 CG2 THR B 28 3.852 14.629 -3.660 1.00 0.00 C ATOM 0 H THR B 28 0.402 15.899 -3.635 1.00 0.00 H new ATOM 0 HA THR B 28 1.731 13.553 -2.424 1.00 0.00 H new ATOM 0 HB THR B 28 3.410 15.063 -1.594 1.00 0.00 H new ATOM 0 HG1 THR B 28 2.559 16.791 -3.735 1.00 0.00 H new ATOM 0 HG21 THR B 28 4.835 15.099 -3.643 1.00 0.00 H new ATOM 0 HG22 THR B 28 3.957 13.560 -3.476 1.00 0.00 H new ATOM 0 HG23 THR B 28 3.392 14.785 -4.636 1.00 0.00 H new ATOM 1878 N LEU B 29 0.704 14.611 -0.247 1.00 0.00 N ATOM 1879 CA LEU B 29 -0.222 14.960 0.821 1.00 0.00 C ATOM 1880 C LEU B 29 0.496 15.885 1.798 1.00 0.00 C ATOM 1881 O LEU B 29 1.690 15.726 2.027 1.00 0.00 O ATOM 1882 CB LEU B 29 -0.709 13.666 1.488 1.00 0.00 C ATOM 1883 CG LEU B 29 -1.733 13.863 2.617 1.00 0.00 C ATOM 1884 CD1 LEU B 29 -3.031 14.503 2.118 1.00 0.00 C ATOM 1885 CD2 LEU B 29 -2.075 12.492 3.206 1.00 0.00 C ATOM 0 H LEU B 29 1.377 13.889 0.011 1.00 0.00 H new ATOM 0 HA LEU B 29 -1.097 15.488 0.442 1.00 0.00 H new ATOM 0 HB2 LEU B 29 -1.151 13.026 0.725 1.00 0.00 H new ATOM 0 HB3 LEU B 29 0.154 13.135 1.889 1.00 0.00 H new ATOM 0 HG LEU B 29 -1.289 14.527 3.358 1.00 0.00 H new ATOM 0 HD11 LEU B 29 -3.722 14.621 2.952 1.00 0.00 H new ATOM 0 HD12 LEU B 29 -2.813 15.480 1.686 1.00 0.00 H new ATOM 0 HD13 LEU B 29 -3.484 13.864 1.360 1.00 0.00 H new ATOM 0 HD21 LEU B 29 -2.801 12.612 4.010 1.00 0.00 H new ATOM 0 HD22 LEU B 29 -2.497 11.857 2.427 1.00 0.00 H new ATOM 0 HD23 LEU B 29 -1.170 12.030 3.601 1.00 0.00 H new ATOM 1897 N SER B 30 -0.204 16.848 2.391 1.00 0.00 N ATOM 1898 CA SER B 30 0.399 17.776 3.329 1.00 0.00 C ATOM 1899 C SER B 30 0.224 17.225 4.739 1.00 0.00 C ATOM 1900 O SER B 30 -0.750 16.520 5.011 1.00 0.00 O ATOM 1901 CB SER B 30 -0.319 19.119 3.186 1.00 0.00 C ATOM 1902 OG SER B 30 -1.713 18.897 3.263 1.00 0.00 O ATOM 0 H SER B 30 -1.200 17.003 2.233 1.00 0.00 H new ATOM 0 HA SER B 30 1.463 17.907 3.132 1.00 0.00 H new ATOM 0 HB2 SER B 30 -0.001 19.803 3.973 1.00 0.00 H new ATOM 0 HB3 SER B 30 -0.062 19.585 2.235 1.00 0.00 H new ATOM 0 HG SER B 30 -2.188 19.674 2.901 1.00 0.00 H new ATOM 1908 N LYS B 31 1.129 17.570 5.660 1.00 0.00 N ATOM 1909 CA LYS B 31 0.904 17.291 7.070 1.00 0.00 C ATOM 1910 C LYS B 31 -0.448 17.875 7.481 1.00 0.00 C ATOM 1911 O LYS B 31 -1.185 17.237 8.223 1.00 0.00 O ATOM 1912 CB LYS B 31 2.022 17.855 7.954 1.00 0.00 C ATOM 1913 CG LYS B 31 3.315 17.032 7.875 1.00 0.00 C ATOM 1914 CD LYS B 31 4.244 17.466 9.018 1.00 0.00 C ATOM 1915 CE LYS B 31 5.533 16.640 9.071 1.00 0.00 C ATOM 1916 NZ LYS B 31 6.453 16.982 7.974 1.00 0.00 N ATOM 0 H LYS B 31 2.012 18.037 5.452 1.00 0.00 H new ATOM 0 HA LYS B 31 0.904 16.210 7.212 1.00 0.00 H new ATOM 0 HB2 LYS B 31 2.232 18.882 7.656 1.00 0.00 H new ATOM 0 HB3 LYS B 31 1.680 17.887 8.988 1.00 0.00 H new ATOM 0 HG2 LYS B 31 3.091 15.968 7.953 1.00 0.00 H new ATOM 0 HG3 LYS B 31 3.803 17.186 6.912 1.00 0.00 H new ATOM 0 HD2 LYS B 31 4.496 18.520 8.897 1.00 0.00 H new ATOM 0 HD3 LYS B 31 3.716 17.371 9.967 1.00 0.00 H new ATOM 0 HE2 LYS B 31 6.031 16.806 10.026 1.00 0.00 H new ATOM 0 HE3 LYS B 31 5.286 15.580 9.020 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 7.352 16.476 8.104 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 6.028 16.705 7.066 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 6.630 18.007 7.976 1.00 0.00 H new ATOM 1930 N LYS B 32 -0.784 19.067 6.971 1.00 0.00 N ATOM 1931 CA LYS B 32 -2.093 19.677 7.167 1.00 0.00 C ATOM 1932 C LYS B 32 -3.229 18.693 6.844 1.00 0.00 C ATOM 1933 O LYS B 32 -4.019 18.341 7.721 1.00 0.00 O ATOM 1934 CB LYS B 32 -2.222 20.942 6.307 1.00 0.00 C ATOM 1935 CG LYS B 32 -1.190 22.016 6.675 1.00 0.00 C ATOM 1936 CD LYS B 32 -1.469 23.339 5.946 1.00 0.00 C ATOM 1937 CE LYS B 32 -1.392 23.196 4.419 1.00 0.00 C ATOM 1938 NZ LYS B 32 -1.522 24.502 3.751 1.00 0.00 N ATOM 0 H LYS B 32 -0.148 19.633 6.409 1.00 0.00 H new ATOM 0 HA LYS B 32 -2.180 19.950 8.219 1.00 0.00 H new ATOM 0 HB2 LYS B 32 -2.104 20.676 5.257 1.00 0.00 H new ATOM 0 HB3 LYS B 32 -3.225 21.353 6.421 1.00 0.00 H new ATOM 0 HG2 LYS B 32 -1.205 22.183 7.752 1.00 0.00 H new ATOM 0 HG3 LYS B 32 -0.190 21.663 6.421 1.00 0.00 H new ATOM 0 HD2 LYS B 32 -2.458 23.702 6.224 1.00 0.00 H new ATOM 0 HD3 LYS B 32 -0.750 24.090 6.274 1.00 0.00 H new ATOM 0 HE2 LYS B 32 -0.443 22.737 4.142 1.00 0.00 H new ATOM 0 HE3 LYS B 32 -2.182 22.529 4.074 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 -1.466 24.372 2.721 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 -2.438 24.928 3.997 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 -0.754 25.130 4.063 1.00 0.00 H new ATOM 1952 N GLU B 33 -3.332 18.249 5.588 1.00 0.00 N ATOM 1953 CA GLU B 33 -4.462 17.428 5.174 1.00 0.00 C ATOM 1954 C GLU B 33 -4.388 16.030 5.799 1.00 0.00 C ATOM 1955 O GLU B 33 -5.421 15.451 6.128 1.00 0.00 O ATOM 1956 CB GLU B 33 -4.578 17.384 3.645 1.00 0.00 C ATOM 1957 CG GLU B 33 -5.304 18.612 3.065 1.00 0.00 C ATOM 1958 CD GLU B 33 -4.635 19.949 3.374 1.00 0.00 C ATOM 1959 OE1 GLU B 33 -4.978 20.530 4.427 1.00 0.00 O ATOM 1960 OE2 GLU B 33 -3.794 20.372 2.552 1.00 0.00 O ATOM 0 H GLU B 33 -2.653 18.444 4.852 1.00 0.00 H new ATOM 0 HA GLU B 33 -5.377 17.889 5.547 1.00 0.00 H new ATOM 0 HB2 GLU B 33 -3.580 17.320 3.211 1.00 0.00 H new ATOM 0 HB3 GLU B 33 -5.112 16.480 3.352 1.00 0.00 H new ATOM 0 HG2 GLU B 33 -5.376 18.498 1.983 1.00 0.00 H new ATOM 0 HG3 GLU B 33 -6.323 18.632 3.452 1.00 0.00 H new ATOM 1967 N LEU B 34 -3.182 15.492 6.000 1.00 0.00 N ATOM 1968 CA LEU B 34 -3.002 14.243 6.727 1.00 0.00 C ATOM 1969 C LEU B 34 -3.580 14.375 8.139 1.00 0.00 C ATOM 1970 O LEU B 34 -4.381 13.545 8.565 1.00 0.00 O ATOM 1971 CB LEU B 34 -1.516 13.856 6.730 1.00 0.00 C ATOM 1972 CG LEU B 34 -1.195 12.555 7.484 1.00 0.00 C ATOM 1973 CD1 LEU B 34 -2.005 11.352 6.983 1.00 0.00 C ATOM 1974 CD2 LEU B 34 0.298 12.243 7.330 1.00 0.00 C ATOM 0 H LEU B 34 -2.314 15.909 5.665 1.00 0.00 H new ATOM 0 HA LEU B 34 -3.545 13.438 6.233 1.00 0.00 H new ATOM 0 HB2 LEU B 34 -1.178 13.756 5.699 1.00 0.00 H new ATOM 0 HB3 LEU B 34 -0.943 14.669 7.175 1.00 0.00 H new ATOM 0 HG LEU B 34 -1.465 12.716 8.528 1.00 0.00 H new ATOM 0 HD11 LEU B 34 -1.732 10.466 7.556 1.00 0.00 H new ATOM 0 HD12 LEU B 34 -3.069 11.552 7.109 1.00 0.00 H new ATOM 0 HD13 LEU B 34 -1.790 11.183 5.928 1.00 0.00 H new ATOM 0 HD21 LEU B 34 0.534 11.321 7.862 1.00 0.00 H new ATOM 0 HD22 LEU B 34 0.538 12.123 6.273 1.00 0.00 H new ATOM 0 HD23 LEU B 34 0.886 13.062 7.745 1.00 0.00 H new ATOM 1986 N LYS B 35 -3.212 15.434 8.864 1.00 0.00 N ATOM 1987 CA LYS B 35 -3.771 15.716 10.178 1.00 0.00 C ATOM 1988 C LYS B 35 -5.284 15.907 10.093 1.00 0.00 C ATOM 1989 O LYS B 35 -5.999 15.463 10.988 1.00 0.00 O ATOM 1990 CB LYS B 35 -3.099 16.937 10.814 1.00 0.00 C ATOM 1991 CG LYS B 35 -1.677 16.602 11.285 1.00 0.00 C ATOM 1992 CD LYS B 35 -0.897 17.860 11.692 1.00 0.00 C ATOM 1993 CE LYS B 35 -1.586 18.690 12.784 1.00 0.00 C ATOM 1994 NZ LYS B 35 -1.871 17.892 13.990 1.00 0.00 N ATOM 0 H LYS B 35 -2.520 16.115 8.553 1.00 0.00 H new ATOM 0 HA LYS B 35 -3.573 14.857 10.819 1.00 0.00 H new ATOM 0 HB2 LYS B 35 -3.064 17.753 10.093 1.00 0.00 H new ATOM 0 HB3 LYS B 35 -3.693 17.284 11.659 1.00 0.00 H new ATOM 0 HG2 LYS B 35 -1.727 15.916 12.131 1.00 0.00 H new ATOM 0 HG3 LYS B 35 -1.143 16.086 10.487 1.00 0.00 H new ATOM 0 HD2 LYS B 35 0.092 17.565 12.042 1.00 0.00 H new ATOM 0 HD3 LYS B 35 -0.750 18.486 10.812 1.00 0.00 H new ATOM 0 HE2 LYS B 35 -0.952 19.535 13.051 1.00 0.00 H new ATOM 0 HE3 LYS B 35 -2.517 19.101 12.393 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 -2.274 18.507 14.726 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 -2.551 17.140 13.756 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 -0.990 17.465 14.340 1.00 0.00 H new ATOM 2008 N GLU B 36 -5.794 16.585 9.061 1.00 0.00 N ATOM 2009 CA GLU B 36 -7.234 16.723 8.860 1.00 0.00 C ATOM 2010 C GLU B 36 -7.878 15.331 8.830 1.00 0.00 C ATOM 2011 O GLU B 36 -8.756 15.031 9.642 1.00 0.00 O ATOM 2012 CB GLU B 36 -7.513 17.545 7.588 1.00 0.00 C ATOM 2013 CG GLU B 36 -8.940 18.113 7.515 1.00 0.00 C ATOM 2014 CD GLU B 36 -10.029 17.060 7.312 1.00 0.00 C ATOM 2015 OE1 GLU B 36 -9.777 16.098 6.553 1.00 0.00 O ATOM 2016 OE2 GLU B 36 -11.110 17.248 7.911 1.00 0.00 O ATOM 0 H GLU B 36 -5.226 17.047 8.351 1.00 0.00 H new ATOM 0 HA GLU B 36 -7.684 17.271 9.688 1.00 0.00 H new ATOM 0 HB2 GLU B 36 -6.801 18.369 7.536 1.00 0.00 H new ATOM 0 HB3 GLU B 36 -7.337 16.916 6.715 1.00 0.00 H new ATOM 0 HG2 GLU B 36 -9.148 18.660 8.435 1.00 0.00 H new ATOM 0 HG3 GLU B 36 -8.990 18.832 6.698 1.00 0.00 H new ATOM 2023 N LEU B 37 -7.418 14.477 7.911 1.00 0.00 N ATOM 2024 CA LEU B 37 -7.910 13.114 7.770 1.00 0.00 C ATOM 2025 C LEU B 37 -7.854 12.389 9.117 1.00 0.00 C ATOM 2026 O LEU B 37 -8.864 11.867 9.586 1.00 0.00 O ATOM 2027 CB LEU B 37 -7.090 12.370 6.708 1.00 0.00 C ATOM 2028 CG LEU B 37 -7.476 10.886 6.573 1.00 0.00 C ATOM 2029 CD1 LEU B 37 -8.936 10.699 6.143 1.00 0.00 C ATOM 2030 CD2 LEU B 37 -6.549 10.232 5.544 1.00 0.00 C ATOM 0 H LEU B 37 -6.688 14.719 7.241 1.00 0.00 H new ATOM 0 HA LEU B 37 -8.950 13.140 7.444 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -7.223 12.862 5.745 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -6.032 12.442 6.959 1.00 0.00 H new ATOM 0 HG LEU B 37 -7.367 10.417 7.551 1.00 0.00 H new ATOM 0 HD11 LEU B 37 -9.158 9.635 6.062 1.00 0.00 H new ATOM 0 HD12 LEU B 37 -9.594 11.152 6.884 1.00 0.00 H new ATOM 0 HD13 LEU B 37 -9.095 11.177 5.176 1.00 0.00 H new ATOM 0 HD21 LEU B 37 -6.810 9.179 5.437 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -6.661 10.733 4.583 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -5.515 10.317 5.879 1.00 0.00 H new ATOM 2042 N ILE B 38 -6.670 12.348 9.735 1.00 0.00 N ATOM 2043 CA ILE B 38 -6.460 11.663 11.004 1.00 0.00 C ATOM 2044 C ILE B 38 -7.459 12.168 12.044 1.00 0.00 C ATOM 2045 O ILE B 38 -8.129 11.362 12.681 1.00 0.00 O ATOM 2046 CB ILE B 38 -4.997 11.809 11.463 1.00 0.00 C ATOM 2047 CG1 ILE B 38 -4.090 10.951 10.560 1.00 0.00 C ATOM 2048 CG2 ILE B 38 -4.827 11.382 12.931 1.00 0.00 C ATOM 2049 CD1 ILE B 38 -2.599 11.225 10.778 1.00 0.00 C ATOM 0 H ILE B 38 -5.830 12.792 9.364 1.00 0.00 H new ATOM 0 HA ILE B 38 -6.641 10.596 10.875 1.00 0.00 H new ATOM 0 HB ILE B 38 -4.714 12.859 11.384 1.00 0.00 H new ATOM 0 HG12 ILE B 38 -4.292 9.897 10.749 1.00 0.00 H new ATOM 0 HG13 ILE B 38 -4.340 11.142 9.516 1.00 0.00 H new ATOM 0 HG21 ILE B 38 -3.784 11.497 13.225 1.00 0.00 H new ATOM 0 HG22 ILE B 38 -5.454 12.007 13.567 1.00 0.00 H new ATOM 0 HG23 ILE B 38 -5.123 10.339 13.043 1.00 0.00 H new ATOM 0 HD11 ILE B 38 -2.012 10.591 10.114 1.00 0.00 H new ATOM 0 HD12 ILE B 38 -2.386 12.272 10.562 1.00 0.00 H new ATOM 0 HD13 ILE B 38 -2.337 11.007 11.813 1.00 0.00 H new ATOM 2061 N GLN B 39 -7.573 13.487 12.220 1.00 0.00 N ATOM 2062 CA GLN B 39 -8.513 14.063 13.171 1.00 0.00 C ATOM 2063 C GLN B 39 -9.930 13.568 12.893 1.00 0.00 C ATOM 2064 O GLN B 39 -10.615 13.162 13.826 1.00 0.00 O ATOM 2065 CB GLN B 39 -8.435 15.592 13.157 1.00 0.00 C ATOM 2066 CG GLN B 39 -7.175 16.073 13.889 1.00 0.00 C ATOM 2067 CD GLN B 39 -6.912 17.550 13.625 1.00 0.00 C ATOM 2068 OE1 GLN B 39 -7.007 18.385 14.517 1.00 0.00 O ATOM 2069 NE2 GLN B 39 -6.578 17.875 12.383 1.00 0.00 N ATOM 0 H GLN B 39 -7.020 14.176 11.710 1.00 0.00 H new ATOM 0 HA GLN B 39 -8.238 13.732 14.173 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -8.425 15.952 12.128 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -9.321 16.012 13.633 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -7.289 15.907 14.960 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -6.316 15.485 13.565 1.00 0.00 H new ATOM 0 HE21 GLN B 39 -6.509 17.151 11.667 1.00 0.00 H new ATOM 0 HE22 GLN B 39 -6.390 18.849 12.144 1.00 0.00 H new ATOM 2078 N LYS B 40 -10.375 13.569 11.631 1.00 0.00 N ATOM 2079 CA LYS B 40 -11.689 13.024 11.308 1.00 0.00 C ATOM 2080 C LYS B 40 -11.793 11.555 11.722 1.00 0.00 C ATOM 2081 O LYS B 40 -12.679 11.197 12.496 1.00 0.00 O ATOM 2082 CB LYS B 40 -12.027 13.222 9.823 1.00 0.00 C ATOM 2083 CG LYS B 40 -12.146 14.700 9.427 1.00 0.00 C ATOM 2084 CD LYS B 40 -13.370 15.396 10.048 1.00 0.00 C ATOM 2085 CE LYS B 40 -12.976 16.619 10.888 1.00 0.00 C ATOM 2086 NZ LYS B 40 -12.191 16.251 12.078 1.00 0.00 N ATOM 0 H LYS B 40 -9.853 13.934 10.834 1.00 0.00 H new ATOM 0 HA LYS B 40 -12.431 13.578 11.883 1.00 0.00 H new ATOM 0 HB2 LYS B 40 -11.256 12.749 9.214 1.00 0.00 H new ATOM 0 HB3 LYS B 40 -12.965 12.715 9.599 1.00 0.00 H new ATOM 0 HG2 LYS B 40 -11.242 15.226 9.734 1.00 0.00 H new ATOM 0 HG3 LYS B 40 -12.205 14.775 8.341 1.00 0.00 H new ATOM 0 HD2 LYS B 40 -14.051 15.706 9.255 1.00 0.00 H new ATOM 0 HD3 LYS B 40 -13.911 14.686 10.674 1.00 0.00 H new ATOM 0 HE2 LYS B 40 -12.397 17.308 10.273 1.00 0.00 H new ATOM 0 HE3 LYS B 40 -13.877 17.149 11.199 1.00 0.00 H new ATOM 0 HZ1 LYS B 40 -12.050 17.091 12.674 1.00 0.00 H new ATOM 0 HZ2 LYS B 40 -12.701 15.524 12.619 1.00 0.00 H new ATOM 0 HZ3 LYS B 40 -11.267 15.877 11.782 1.00 0.00 H new ATOM 2337 N LEU B 56 3.199 8.690 15.095 1.00 0.00 N ATOM 2338 CA LEU B 56 2.740 8.230 13.793 1.00 0.00 C ATOM 2339 C LEU B 56 3.193 9.204 12.704 1.00 0.00 C ATOM 2340 O LEU B 56 3.836 8.793 11.745 1.00 0.00 O ATOM 2341 CB LEU B 56 1.213 8.061 13.826 1.00 0.00 C ATOM 2342 CG LEU B 56 0.581 7.653 12.486 1.00 0.00 C ATOM 2343 CD1 LEU B 56 1.039 6.263 12.032 1.00 0.00 C ATOM 2344 CD2 LEU B 56 -0.944 7.665 12.635 1.00 0.00 C ATOM 0 HA LEU B 56 3.179 7.261 13.558 1.00 0.00 H new ATOM 0 HB2 LEU B 56 0.961 7.310 14.574 1.00 0.00 H new ATOM 0 HB3 LEU B 56 0.765 8.999 14.152 1.00 0.00 H new ATOM 0 HG LEU B 56 0.902 8.367 11.728 1.00 0.00 H new ATOM 0 HD11 LEU B 56 0.567 6.017 11.081 1.00 0.00 H new ATOM 0 HD12 LEU B 56 2.122 6.258 11.911 1.00 0.00 H new ATOM 0 HD13 LEU B 56 0.754 5.524 12.780 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -1.404 7.377 11.690 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -1.239 6.960 13.412 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -1.275 8.667 12.909 1.00 0.00 H new ATOM 2356 N MET B 57 2.873 10.492 12.854 1.00 0.00 N ATOM 2357 CA MET B 57 3.271 11.535 11.920 1.00 0.00 C ATOM 2358 C MET B 57 4.783 11.482 11.683 1.00 0.00 C ATOM 2359 O MET B 57 5.229 11.413 10.538 1.00 0.00 O ATOM 2360 CB MET B 57 2.851 12.909 12.464 1.00 0.00 C ATOM 2361 CG MET B 57 1.332 13.127 12.418 1.00 0.00 C ATOM 2362 SD MET B 57 0.566 13.296 10.785 1.00 0.00 S ATOM 2363 CE MET B 57 1.413 14.760 10.157 1.00 0.00 C ATOM 0 H MET B 57 2.323 10.839 13.640 1.00 0.00 H new ATOM 0 HA MET B 57 2.771 11.372 10.965 1.00 0.00 H new ATOM 0 HB2 MET B 57 3.197 13.009 13.493 1.00 0.00 H new ATOM 0 HB3 MET B 57 3.343 13.690 11.885 1.00 0.00 H new ATOM 0 HG2 MET B 57 0.856 12.290 12.929 1.00 0.00 H new ATOM 0 HG3 MET B 57 1.102 14.024 12.993 1.00 0.00 H new ATOM 0 HE1 MET B 57 0.866 15.158 9.302 1.00 0.00 H new ATOM 0 HE2 MET B 57 1.462 15.516 10.940 1.00 0.00 H new ATOM 0 HE3 MET B 57 2.423 14.492 9.849 1.00 0.00 H new ATOM 2373 N ASP B 58 5.566 11.501 12.766 1.00 0.00 N ATOM 2374 CA ASP B 58 7.019 11.433 12.679 1.00 0.00 C ATOM 2375 C ASP B 58 7.450 10.206 11.875 1.00 0.00 C ATOM 2376 O ASP B 58 8.184 10.337 10.898 1.00 0.00 O ATOM 2377 CB ASP B 58 7.643 11.427 14.078 1.00 0.00 C ATOM 2378 CG ASP B 58 9.166 11.377 13.986 1.00 0.00 C ATOM 2379 OD1 ASP B 58 9.700 10.249 13.918 1.00 0.00 O ATOM 2380 OD2 ASP B 58 9.769 12.471 13.972 1.00 0.00 O ATOM 0 H ASP B 58 5.209 11.564 13.719 1.00 0.00 H new ATOM 0 HA ASP B 58 7.378 12.320 12.157 1.00 0.00 H new ATOM 0 HB2 ASP B 58 7.335 12.319 14.623 1.00 0.00 H new ATOM 0 HB3 ASP B 58 7.279 10.568 14.641 1.00 0.00 H new ATOM 2385 N ASP B 59 6.995 9.020 12.285 1.00 0.00 N ATOM 2386 CA ASP B 59 7.315 7.764 11.620 1.00 0.00 C ATOM 2387 C ASP B 59 6.994 7.835 10.126 1.00 0.00 C ATOM 2388 O ASP B 59 7.848 7.547 9.293 1.00 0.00 O ATOM 2389 CB ASP B 59 6.556 6.615 12.292 1.00 0.00 C ATOM 2390 CG ASP B 59 6.806 5.295 11.573 1.00 0.00 C ATOM 2391 OD1 ASP B 59 7.858 4.685 11.858 1.00 0.00 O ATOM 2392 OD2 ASP B 59 5.940 4.923 10.752 1.00 0.00 O ATOM 0 H ASP B 59 6.388 8.908 13.097 1.00 0.00 H new ATOM 0 HA ASP B 59 8.385 7.580 11.714 1.00 0.00 H new ATOM 0 HB2 ASP B 59 6.867 6.530 13.333 1.00 0.00 H new ATOM 0 HB3 ASP B 59 5.488 6.834 12.295 1.00 0.00 H new ATOM 2397 N LEU B 60 5.765 8.222 9.781 1.00 0.00 N ATOM 2398 CA LEU B 60 5.337 8.334 8.395 1.00 0.00 C ATOM 2399 C LEU B 60 6.217 9.316 7.626 1.00 0.00 C ATOM 2400 O LEU B 60 6.529 9.073 6.462 1.00 0.00 O ATOM 2401 CB LEU B 60 3.870 8.771 8.315 1.00 0.00 C ATOM 2402 CG LEU B 60 2.875 7.717 8.824 1.00 0.00 C ATOM 2403 CD1 LEU B 60 1.479 8.350 8.845 1.00 0.00 C ATOM 2404 CD2 LEU B 60 2.873 6.454 7.955 1.00 0.00 C ATOM 0 H LEU B 60 5.042 8.466 10.458 1.00 0.00 H new ATOM 0 HA LEU B 60 5.437 7.350 7.937 1.00 0.00 H new ATOM 0 HB2 LEU B 60 3.742 9.686 8.894 1.00 0.00 H new ATOM 0 HB3 LEU B 60 3.630 9.013 7.280 1.00 0.00 H new ATOM 0 HG LEU B 60 3.174 7.406 9.825 1.00 0.00 H new ATOM 0 HD11 LEU B 60 0.754 7.620 9.204 1.00 0.00 H new ATOM 0 HD12 LEU B 60 1.482 9.215 9.509 1.00 0.00 H new ATOM 0 HD13 LEU B 60 1.208 8.666 7.838 1.00 0.00 H new ATOM 0 HD21 LEU B 60 2.154 5.739 8.355 1.00 0.00 H new ATOM 0 HD22 LEU B 60 2.596 6.715 6.934 1.00 0.00 H new ATOM 0 HD23 LEU B 60 3.868 6.009 7.958 1.00 0.00 H new ATOM 2416 N ASP B 61 6.611 10.430 8.250 1.00 0.00 N ATOM 2417 CA ASP B 61 7.374 11.485 7.596 1.00 0.00 C ATOM 2418 C ASP B 61 8.852 11.110 7.394 1.00 0.00 C ATOM 2419 O ASP B 61 9.739 11.914 7.673 1.00 0.00 O ATOM 2420 CB ASP B 61 7.203 12.789 8.394 1.00 0.00 C ATOM 2421 CG ASP B 61 7.859 14.001 7.737 1.00 0.00 C ATOM 2422 OD1 ASP B 61 7.885 14.053 6.488 1.00 0.00 O ATOM 2423 OD2 ASP B 61 8.317 14.880 8.499 1.00 0.00 O ATOM 0 H ASP B 61 6.405 10.622 9.230 1.00 0.00 H new ATOM 0 HA ASP B 61 6.982 11.630 6.589 1.00 0.00 H new ATOM 0 HB2 ASP B 61 6.139 12.988 8.524 1.00 0.00 H new ATOM 0 HB3 ASP B 61 7.626 12.653 9.390 1.00 0.00 H new ATOM 2428 N ARG B 62 9.138 9.936 6.820 1.00 0.00 N ATOM 2429 CA ARG B 62 10.492 9.606 6.371 1.00 0.00 C ATOM 2430 C ARG B 62 10.925 10.618 5.305 1.00 0.00 C ATOM 2431 O ARG B 62 12.100 10.956 5.192 1.00 0.00 O ATOM 2432 CB ARG B 62 10.563 8.176 5.815 1.00 0.00 C ATOM 2433 CG ARG B 62 10.183 7.068 6.809 1.00 0.00 C ATOM 2434 CD ARG B 62 11.072 7.046 8.060 1.00 0.00 C ATOM 2435 NE ARG B 62 10.591 7.996 9.072 1.00 0.00 N ATOM 2436 CZ ARG B 62 11.318 8.532 10.062 1.00 0.00 C ATOM 2437 NH1 ARG B 62 12.600 8.185 10.231 1.00 0.00 N ATOM 2438 NH2 ARG B 62 10.751 9.412 10.890 1.00 0.00 N ATOM 0 H ARG B 62 8.450 9.201 6.656 1.00 0.00 H new ATOM 0 HA ARG B 62 11.169 9.657 7.224 1.00 0.00 H new ATOM 0 HB2 ARG B 62 9.904 8.107 4.949 1.00 0.00 H new ATOM 0 HB3 ARG B 62 11.577 7.991 5.460 1.00 0.00 H new ATOM 0 HG2 ARG B 62 9.144 7.201 7.112 1.00 0.00 H new ATOM 0 HG3 ARG B 62 10.248 6.102 6.308 1.00 0.00 H new ATOM 0 HD2 ARG B 62 11.088 6.040 8.480 1.00 0.00 H new ATOM 0 HD3 ARG B 62 12.097 7.292 7.785 1.00 0.00 H new ATOM 0 HE ARG B 62 9.611 8.274 9.016 1.00 0.00 H new ATOM 0 HH11 ARG B 62 13.032 7.507 9.603 1.00 0.00 H new ATOM 0 HH12 ARG B 62 13.145 8.599 10.988 1.00 0.00 H new ATOM 0 HH21 ARG B 62 9.772 9.671 10.766 1.00 0.00 H new ATOM 0 HH22 ARG B 62 11.296 9.825 11.646 1.00 0.00 H new ATOM 2452 N ASN B 63 9.947 11.128 4.550 1.00 0.00 N ATOM 2453 CA ASN B 63 10.078 12.245 3.623 1.00 0.00 C ATOM 2454 C ASN B 63 10.751 13.467 4.257 1.00 0.00 C ATOM 2455 O ASN B 63 11.351 14.258 3.532 1.00 0.00 O ATOM 2456 CB ASN B 63 8.679 12.635 3.128 1.00 0.00 C ATOM 2457 CG ASN B 63 8.651 13.256 1.735 1.00 0.00 C ATOM 2458 OD1 ASN B 63 7.822 12.860 0.919 1.00 0.00 O ATOM 2459 ND2 ASN B 63 9.524 14.212 1.435 1.00 0.00 N ATOM 0 H ASN B 63 8.999 10.752 4.573 1.00 0.00 H new ATOM 0 HA ASN B 63 10.715 11.922 2.800 1.00 0.00 H new ATOM 0 HB2 ASN B 63 8.047 11.747 3.129 1.00 0.00 H new ATOM 0 HB3 ASN B 63 8.241 13.339 3.835 1.00 0.00 H new ATOM 0 HD21 ASN B 63 9.517 14.636 0.508 1.00 0.00 H new ATOM 0 HD22 ASN B 63 10.201 14.521 2.132 1.00 0.00 H new ATOM 2466 N LYS B 64 10.599 13.661 5.575 1.00 0.00 N ATOM 2467 CA LYS B 64 11.115 14.808 6.314 1.00 0.00 C ATOM 2468 C LYS B 64 10.722 16.124 5.633 1.00 0.00 C ATOM 2469 O LYS B 64 11.571 16.979 5.385 1.00 0.00 O ATOM 2470 CB LYS B 64 12.633 14.664 6.515 1.00 0.00 C ATOM 2471 CG LYS B 64 12.967 13.465 7.415 1.00 0.00 C ATOM 2472 CD LYS B 64 14.447 13.073 7.327 1.00 0.00 C ATOM 2473 CE LYS B 64 15.380 14.210 7.761 1.00 0.00 C ATOM 2474 NZ LYS B 64 16.788 13.776 7.757 1.00 0.00 N ATOM 0 H LYS B 64 10.097 13.000 6.168 1.00 0.00 H new ATOM 0 HA LYS B 64 10.660 14.834 7.304 1.00 0.00 H new ATOM 0 HB2 LYS B 64 13.120 14.542 5.547 1.00 0.00 H new ATOM 0 HB3 LYS B 64 13.031 15.576 6.959 1.00 0.00 H new ATOM 0 HG2 LYS B 64 12.717 13.707 8.448 1.00 0.00 H new ATOM 0 HG3 LYS B 64 12.349 12.614 7.129 1.00 0.00 H new ATOM 0 HD2 LYS B 64 14.627 12.200 7.954 1.00 0.00 H new ATOM 0 HD3 LYS B 64 14.683 12.784 6.303 1.00 0.00 H new ATOM 0 HE2 LYS B 64 15.257 15.061 7.090 1.00 0.00 H new ATOM 0 HE3 LYS B 64 15.104 14.549 8.760 1.00 0.00 H new ATOM 0 HZ1 LYS B 64 17.396 14.566 8.055 1.00 0.00 H new ATOM 0 HZ2 LYS B 64 16.908 12.980 8.415 1.00 0.00 H new ATOM 0 HZ3 LYS B 64 17.056 13.476 6.798 1.00 0.00 H new ATOM 2488 N ASP B 65 9.431 16.295 5.327 1.00 0.00 N ATOM 2489 CA ASP B 65 8.930 17.467 4.626 1.00 0.00 C ATOM 2490 C ASP B 65 7.448 17.633 4.953 1.00 0.00 C ATOM 2491 O ASP B 65 6.748 16.648 5.174 1.00 0.00 O ATOM 2492 CB ASP B 65 9.161 17.304 3.116 1.00 0.00 C ATOM 2493 CG ASP B 65 8.964 18.614 2.356 1.00 0.00 C ATOM 2494 OD1 ASP B 65 7.806 19.081 2.299 1.00 0.00 O ATOM 2495 OD2 ASP B 65 9.982 19.143 1.861 1.00 0.00 O ATOM 0 H ASP B 65 8.706 15.617 5.563 1.00 0.00 H new ATOM 0 HA ASP B 65 9.461 18.363 4.946 1.00 0.00 H new ATOM 0 HB2 ASP B 65 10.172 16.934 2.943 1.00 0.00 H new ATOM 0 HB3 ASP B 65 8.475 16.553 2.725 1.00 0.00 H new ATOM 2500 N GLN B 66 6.975 18.881 5.009 1.00 0.00 N ATOM 2501 CA GLN B 66 5.570 19.212 5.231 1.00 0.00 C ATOM 2502 C GLN B 66 4.680 18.539 4.185 1.00 0.00 C ATOM 2503 O GLN B 66 3.588 18.075 4.501 1.00 0.00 O ATOM 2504 CB GLN B 66 5.394 20.738 5.261 1.00 0.00 C ATOM 2505 CG GLN B 66 4.058 21.204 5.869 1.00 0.00 C ATOM 2506 CD GLN B 66 2.827 20.906 5.013 1.00 0.00 C ATOM 2507 OE1 GLN B 66 1.847 20.338 5.490 1.00 0.00 O ATOM 2508 NE2 GLN B 66 2.861 21.290 3.739 1.00 0.00 N ATOM 0 H GLN B 66 7.570 19.702 4.899 1.00 0.00 H new ATOM 0 HA GLN B 66 5.255 18.824 6.200 1.00 0.00 H new ATOM 0 HB2 GLN B 66 6.213 21.176 5.831 1.00 0.00 H new ATOM 0 HB3 GLN B 66 5.472 21.122 4.244 1.00 0.00 H new ATOM 0 HG2 GLN B 66 3.931 20.728 6.841 1.00 0.00 H new ATOM 0 HG3 GLN B 66 4.110 22.278 6.045 1.00 0.00 H new ATOM 0 HE21 GLN B 66 3.688 21.760 3.370 1.00 0.00 H new ATOM 0 HE22 GLN B 66 2.060 21.115 3.132 1.00 0.00 H new ATOM 2517 N GLU B 67 5.168 18.490 2.950 1.00 0.00 N ATOM 2518 CA GLU B 67 4.540 17.799 1.841 1.00 0.00 C ATOM 2519 C GLU B 67 5.147 16.399 1.801 1.00 0.00 C ATOM 2520 O GLU B 67 6.289 16.229 1.378 1.00 0.00 O ATOM 2521 CB GLU B 67 4.794 18.566 0.536 1.00 0.00 C ATOM 2522 CG GLU B 67 4.263 20.005 0.619 1.00 0.00 C ATOM 2523 CD GLU B 67 4.407 20.758 -0.700 1.00 0.00 C ATOM 2524 OE1 GLU B 67 5.416 20.512 -1.396 1.00 0.00 O ATOM 2525 OE2 GLU B 67 3.518 21.592 -0.974 1.00 0.00 O ATOM 0 H GLU B 67 6.042 18.947 2.690 1.00 0.00 H new ATOM 0 HA GLU B 67 3.459 17.735 1.962 1.00 0.00 H new ATOM 0 HB2 GLU B 67 5.863 18.583 0.324 1.00 0.00 H new ATOM 0 HB3 GLU B 67 4.313 18.046 -0.293 1.00 0.00 H new ATOM 0 HG2 GLU B 67 3.213 19.985 0.909 1.00 0.00 H new ATOM 0 HG3 GLU B 67 4.800 20.542 1.401 1.00 0.00 H new ATOM 2532 N VAL B 68 4.389 15.406 2.263 1.00 0.00 N ATOM 2533 CA VAL B 68 4.804 14.018 2.288 1.00 0.00 C ATOM 2534 C VAL B 68 4.315 13.349 1.002 1.00 0.00 C ATOM 2535 O VAL B 68 3.244 13.667 0.481 1.00 0.00 O ATOM 2536 CB VAL B 68 4.307 13.314 3.568 1.00 0.00 C ATOM 2537 CG1 VAL B 68 4.940 13.952 4.809 1.00 0.00 C ATOM 2538 CG2 VAL B 68 2.784 13.300 3.744 1.00 0.00 C ATOM 0 H VAL B 68 3.451 15.554 2.636 1.00 0.00 H new ATOM 0 HA VAL B 68 5.891 13.943 2.321 1.00 0.00 H new ATOM 0 HB VAL B 68 4.617 12.275 3.454 1.00 0.00 H new ATOM 0 HG11 VAL B 68 4.579 13.444 5.703 1.00 0.00 H new ATOM 0 HG12 VAL B 68 6.025 13.860 4.752 1.00 0.00 H new ATOM 0 HG13 VAL B 68 4.667 15.006 4.855 1.00 0.00 H new ATOM 0 HG21 VAL B 68 2.529 12.785 4.670 1.00 0.00 H new ATOM 0 HG22 VAL B 68 2.413 14.324 3.785 1.00 0.00 H new ATOM 0 HG23 VAL B 68 2.325 12.781 2.902 1.00 0.00 H new ATOM 2548 N ASN B 69 5.086 12.396 0.483 1.00 0.00 N ATOM 2549 CA ASN B 69 4.841 11.881 -0.854 1.00 0.00 C ATOM 2550 C ASN B 69 3.840 10.728 -0.796 1.00 0.00 C ATOM 2551 O ASN B 69 3.635 10.114 0.250 1.00 0.00 O ATOM 2552 CB ASN B 69 6.177 11.406 -1.449 1.00 0.00 C ATOM 2553 CG ASN B 69 5.997 10.729 -2.805 1.00 0.00 C ATOM 2554 OD1 ASN B 69 5.220 11.190 -3.636 1.00 0.00 O ATOM 2555 ND2 ASN B 69 6.656 9.595 -3.025 1.00 0.00 N ATOM 0 H ASN B 69 5.877 11.971 0.966 1.00 0.00 H new ATOM 0 HA ASN B 69 4.419 12.664 -1.484 1.00 0.00 H new ATOM 0 HB2 ASN B 69 6.848 12.258 -1.557 1.00 0.00 H new ATOM 0 HB3 ASN B 69 6.653 10.710 -0.758 1.00 0.00 H new ATOM 0 HD21 ASN B 69 6.521 9.088 -3.900 1.00 0.00 H new ATOM 0 HD22 ASN B 69 7.296 9.232 -2.319 1.00 0.00 H new ATOM 2562 N PHE B 70 3.208 10.446 -1.935 1.00 0.00 N ATOM 2563 CA PHE B 70 2.239 9.374 -2.107 1.00 0.00 C ATOM 2564 C PHE B 70 2.699 8.061 -1.461 1.00 0.00 C ATOM 2565 O PHE B 70 1.903 7.396 -0.803 1.00 0.00 O ATOM 2566 CB PHE B 70 1.947 9.193 -3.600 1.00 0.00 C ATOM 2567 CG PHE B 70 1.017 8.039 -3.911 1.00 0.00 C ATOM 2568 CD1 PHE B 70 -0.280 8.004 -3.364 1.00 0.00 C ATOM 2569 CD2 PHE B 70 1.448 6.996 -4.750 1.00 0.00 C ATOM 2570 CE1 PHE B 70 -1.161 6.964 -3.700 1.00 0.00 C ATOM 2571 CE2 PHE B 70 0.566 5.958 -5.089 1.00 0.00 C ATOM 2572 CZ PHE B 70 -0.742 5.949 -4.577 1.00 0.00 C ATOM 0 H PHE B 70 3.365 10.979 -2.791 1.00 0.00 H new ATOM 0 HA PHE B 70 1.321 9.655 -1.591 1.00 0.00 H new ATOM 0 HB2 PHE B 70 1.510 10.113 -3.988 1.00 0.00 H new ATOM 0 HB3 PHE B 70 2.888 9.040 -4.128 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -0.598 8.780 -2.684 1.00 0.00 H new ATOM 0 HD2 PHE B 70 2.458 6.994 -5.134 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -2.158 6.944 -3.286 1.00 0.00 H new ATOM 0 HE2 PHE B 70 0.894 5.165 -5.745 1.00 0.00 H new ATOM 0 HZ PHE B 70 -1.426 5.162 -4.857 1.00 0.00 H new ATOM 2582 N GLN B 71 3.979 7.693 -1.594 1.00 0.00 N ATOM 2583 CA GLN B 71 4.495 6.499 -0.927 1.00 0.00 C ATOM 2584 C GLN B 71 4.210 6.533 0.577 1.00 0.00 C ATOM 2585 O GLN B 71 3.844 5.515 1.158 1.00 0.00 O ATOM 2586 CB GLN B 71 5.997 6.323 -1.195 1.00 0.00 C ATOM 2587 CG GLN B 71 6.596 5.110 -0.455 1.00 0.00 C ATOM 2588 CD GLN B 71 5.882 3.795 -0.779 1.00 0.00 C ATOM 2589 OE1 GLN B 71 5.698 3.462 -1.944 1.00 0.00 O ATOM 2590 NE2 GLN B 71 5.466 3.032 0.230 1.00 0.00 N ATOM 0 H GLN B 71 4.667 8.200 -2.151 1.00 0.00 H new ATOM 0 HA GLN B 71 3.973 5.638 -1.345 1.00 0.00 H new ATOM 0 HB2 GLN B 71 6.159 6.206 -2.266 1.00 0.00 H new ATOM 0 HB3 GLN B 71 6.525 7.227 -0.889 1.00 0.00 H new ATOM 0 HG2 GLN B 71 7.650 5.018 -0.716 1.00 0.00 H new ATOM 0 HG3 GLN B 71 6.548 5.287 0.619 1.00 0.00 H new ATOM 0 HE21 GLN B 71 5.629 3.327 1.193 1.00 0.00 H new ATOM 0 HE22 GLN B 71 4.985 2.153 0.040 1.00 0.00 H new ATOM 2599 N GLU B 72 4.373 7.686 1.227 1.00 0.00 N ATOM 2600 CA GLU B 72 4.123 7.816 2.654 1.00 0.00 C ATOM 2601 C GLU B 72 2.643 7.549 2.932 1.00 0.00 C ATOM 2602 O GLU B 72 2.309 6.819 3.863 1.00 0.00 O ATOM 2603 CB GLU B 72 4.553 9.205 3.154 1.00 0.00 C ATOM 2604 CG GLU B 72 5.941 9.655 2.668 1.00 0.00 C ATOM 2605 CD GLU B 72 7.092 8.790 3.177 1.00 0.00 C ATOM 2606 OE1 GLU B 72 7.178 7.626 2.732 1.00 0.00 O ATOM 2607 OE2 GLU B 72 7.893 9.331 3.971 1.00 0.00 O ATOM 0 H GLU B 72 4.680 8.549 0.778 1.00 0.00 H new ATOM 0 HA GLU B 72 4.716 7.081 3.199 1.00 0.00 H new ATOM 0 HB2 GLU B 72 3.814 9.938 2.832 1.00 0.00 H new ATOM 0 HB3 GLU B 72 4.546 9.203 4.244 1.00 0.00 H new ATOM 0 HG2 GLU B 72 5.952 9.650 1.578 1.00 0.00 H new ATOM 0 HG3 GLU B 72 6.108 10.685 2.983 1.00 0.00 H new ATOM 2614 N TYR B 73 1.755 8.104 2.102 1.00 0.00 N ATOM 2615 CA TYR B 73 0.324 7.838 2.195 1.00 0.00 C ATOM 2616 C TYR B 73 0.036 6.342 2.034 1.00 0.00 C ATOM 2617 O TYR B 73 -0.705 5.763 2.823 1.00 0.00 O ATOM 2618 CB TYR B 73 -0.449 8.675 1.171 1.00 0.00 C ATOM 2619 CG TYR B 73 -1.945 8.434 1.201 1.00 0.00 C ATOM 2620 CD1 TYR B 73 -2.727 9.005 2.222 1.00 0.00 C ATOM 2621 CD2 TYR B 73 -2.554 7.617 0.229 1.00 0.00 C ATOM 2622 CE1 TYR B 73 -4.123 8.846 2.215 1.00 0.00 C ATOM 2623 CE2 TYR B 73 -3.949 7.455 0.228 1.00 0.00 C ATOM 2624 CZ TYR B 73 -4.736 8.084 1.206 1.00 0.00 C ATOM 2625 OH TYR B 73 -6.092 7.971 1.156 1.00 0.00 O ATOM 0 H TYR B 73 2.010 8.746 1.352 1.00 0.00 H new ATOM 0 HA TYR B 73 -0.018 8.132 3.187 1.00 0.00 H new ATOM 0 HB2 TYR B 73 -0.255 9.732 1.356 1.00 0.00 H new ATOM 0 HB3 TYR B 73 -0.073 8.452 0.173 1.00 0.00 H new ATOM 0 HD1 TYR B 73 -2.253 9.567 3.013 1.00 0.00 H new ATOM 0 HD2 TYR B 73 -1.950 7.117 -0.513 1.00 0.00 H new ATOM 0 HE1 TYR B 73 -4.724 9.309 2.984 1.00 0.00 H new ATOM 0 HE2 TYR B 73 -4.419 6.844 -0.529 1.00 0.00 H new ATOM 0 HH TYR B 73 -6.346 7.409 0.394 1.00 0.00 H new ATOM 2635 N ILE B 74 0.629 5.695 1.031 1.00 0.00 N ATOM 2636 CA ILE B 74 0.491 4.258 0.831 1.00 0.00 C ATOM 2637 C ILE B 74 0.971 3.496 2.072 1.00 0.00 C ATOM 2638 O ILE B 74 0.285 2.602 2.564 1.00 0.00 O ATOM 2639 CB ILE B 74 1.233 3.850 -0.456 1.00 0.00 C ATOM 2640 CG1 ILE B 74 0.474 4.297 -1.717 1.00 0.00 C ATOM 2641 CG2 ILE B 74 1.503 2.346 -0.510 1.00 0.00 C ATOM 2642 CD1 ILE B 74 -0.812 3.504 -1.996 1.00 0.00 C ATOM 0 H ILE B 74 1.218 6.155 0.336 1.00 0.00 H new ATOM 0 HA ILE B 74 -0.558 3.993 0.700 1.00 0.00 H new ATOM 0 HB ILE B 74 2.193 4.365 -0.432 1.00 0.00 H new ATOM 0 HG12 ILE B 74 0.222 5.353 -1.620 1.00 0.00 H new ATOM 0 HG13 ILE B 74 1.137 4.206 -2.577 1.00 0.00 H new ATOM 0 HG21 ILE B 74 2.028 2.103 -1.434 1.00 0.00 H new ATOM 0 HG22 ILE B 74 2.117 2.056 0.343 1.00 0.00 H new ATOM 0 HG23 ILE B 74 0.557 1.805 -0.477 1.00 0.00 H new ATOM 0 HD11 ILE B 74 -1.284 3.884 -2.902 1.00 0.00 H new ATOM 0 HD12 ILE B 74 -0.568 2.450 -2.128 1.00 0.00 H new ATOM 0 HD13 ILE B 74 -1.497 3.615 -1.156 1.00 0.00 H new ATOM 2654 N THR B 75 2.135 3.852 2.608 1.00 0.00 N ATOM 2655 CA THR B 75 2.652 3.226 3.819 1.00 0.00 C ATOM 2656 C THR B 75 1.663 3.439 4.974 1.00 0.00 C ATOM 2657 O THR B 75 1.395 2.513 5.739 1.00 0.00 O ATOM 2658 CB THR B 75 4.060 3.763 4.129 1.00 0.00 C ATOM 2659 OG1 THR B 75 4.860 3.733 2.959 1.00 0.00 O ATOM 2660 CG2 THR B 75 4.755 2.922 5.203 1.00 0.00 C ATOM 0 H THR B 75 2.740 4.575 2.219 1.00 0.00 H new ATOM 0 HA THR B 75 2.750 2.150 3.675 1.00 0.00 H new ATOM 0 HB THR B 75 3.945 4.785 4.490 1.00 0.00 H new ATOM 0 HG1 THR B 75 4.606 4.474 2.370 1.00 0.00 H new ATOM 0 HG21 THR B 75 5.747 3.329 5.398 1.00 0.00 H new ATOM 0 HG22 THR B 75 4.167 2.945 6.120 1.00 0.00 H new ATOM 0 HG23 THR B 75 4.846 1.893 4.856 1.00 0.00 H new ATOM 2668 N PHE B 76 1.080 4.638 5.082 1.00 0.00 N ATOM 2669 CA PHE B 76 0.026 4.918 6.049 1.00 0.00 C ATOM 2670 C PHE B 76 -1.191 4.024 5.809 1.00 0.00 C ATOM 2671 O PHE B 76 -1.749 3.505 6.770 1.00 0.00 O ATOM 2672 CB PHE B 76 -0.356 6.407 6.046 1.00 0.00 C ATOM 2673 CG PHE B 76 -1.489 6.792 6.986 1.00 0.00 C ATOM 2674 CD1 PHE B 76 -1.551 6.266 8.291 1.00 0.00 C ATOM 2675 CD2 PHE B 76 -2.515 7.646 6.534 1.00 0.00 C ATOM 2676 CE1 PHE B 76 -2.646 6.561 9.122 1.00 0.00 C ATOM 2677 CE2 PHE B 76 -3.593 7.965 7.378 1.00 0.00 C ATOM 2678 CZ PHE B 76 -3.662 7.418 8.671 1.00 0.00 C ATOM 0 H PHE B 76 1.329 5.437 4.500 1.00 0.00 H new ATOM 0 HA PHE B 76 0.414 4.687 7.041 1.00 0.00 H new ATOM 0 HB2 PHE B 76 0.526 6.991 6.309 1.00 0.00 H new ATOM 0 HB3 PHE B 76 -0.636 6.691 5.032 1.00 0.00 H new ATOM 0 HD1 PHE B 76 -0.755 5.634 8.655 1.00 0.00 H new ATOM 0 HD2 PHE B 76 -2.473 8.057 5.536 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -2.706 6.127 10.109 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -4.369 8.631 7.032 1.00 0.00 H new ATOM 0 HZ PHE B 76 -4.495 7.657 9.316 1.00 0.00 H new ATOM 2688 N LEU B 77 -1.589 3.802 4.551 1.00 0.00 N ATOM 2689 CA LEU B 77 -2.649 2.855 4.220 1.00 0.00 C ATOM 2690 C LEU B 77 -2.277 1.501 4.829 1.00 0.00 C ATOM 2691 O LEU B 77 -3.064 0.899 5.556 1.00 0.00 O ATOM 2692 CB LEU B 77 -2.824 2.779 2.693 1.00 0.00 C ATOM 2693 CG LEU B 77 -4.193 2.276 2.208 1.00 0.00 C ATOM 2694 CD1 LEU B 77 -4.144 2.193 0.680 1.00 0.00 C ATOM 2695 CD2 LEU B 77 -4.560 0.887 2.739 1.00 0.00 C ATOM 0 H LEU B 77 -1.185 4.273 3.741 1.00 0.00 H new ATOM 0 HA LEU B 77 -3.607 3.174 4.631 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -2.652 3.771 2.275 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -2.052 2.125 2.288 1.00 0.00 H new ATOM 0 HG LEU B 77 -4.945 2.973 2.578 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -5.104 1.838 0.304 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -3.936 3.181 0.268 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -3.358 1.501 0.378 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -5.538 0.598 2.355 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -3.813 0.163 2.412 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -4.590 0.910 3.828 1.00 0.00 H new ATOM 2707 N GLY B 78 -1.045 1.052 4.573 1.00 0.00 N ATOM 2708 CA GLY B 78 -0.495 -0.153 5.169 1.00 0.00 C ATOM 2709 C GLY B 78 -0.672 -0.177 6.685 1.00 0.00 C ATOM 2710 O GLY B 78 -1.264 -1.112 7.217 1.00 0.00 O ATOM 0 H GLY B 78 -0.401 1.525 3.939 1.00 0.00 H new ATOM 0 HA2 GLY B 78 -0.981 -1.026 4.734 1.00 0.00 H new ATOM 0 HA3 GLY B 78 0.565 -0.225 4.927 1.00 0.00 H new ATOM 2714 N ALA B 79 -0.169 0.842 7.385 1.00 0.00 N ATOM 2715 CA ALA B 79 -0.272 0.930 8.836 1.00 0.00 C ATOM 2716 C ALA B 79 -1.734 0.842 9.287 1.00 0.00 C ATOM 2717 O ALA B 79 -2.090 -0.008 10.099 1.00 0.00 O ATOM 2718 CB ALA B 79 0.387 2.224 9.324 1.00 0.00 C ATOM 0 H ALA B 79 0.321 1.628 6.958 1.00 0.00 H new ATOM 0 HA ALA B 79 0.254 0.086 9.281 1.00 0.00 H new ATOM 0 HB1 ALA B 79 0.308 2.286 10.409 1.00 0.00 H new ATOM 0 HB2 ALA B 79 1.438 2.228 9.036 1.00 0.00 H new ATOM 0 HB3 ALA B 79 -0.116 3.080 8.874 1.00 0.00 H new ATOM 2724 N LEU B 80 -2.581 1.717 8.744 1.00 0.00 N ATOM 2725 CA LEU B 80 -4.002 1.791 9.047 1.00 0.00 C ATOM 2726 C LEU B 80 -4.653 0.417 8.875 1.00 0.00 C ATOM 2727 O LEU B 80 -5.367 -0.048 9.757 1.00 0.00 O ATOM 2728 CB LEU B 80 -4.646 2.864 8.155 1.00 0.00 C ATOM 2729 CG LEU B 80 -6.157 3.051 8.364 1.00 0.00 C ATOM 2730 CD1 LEU B 80 -6.502 3.389 9.818 1.00 0.00 C ATOM 2731 CD2 LEU B 80 -6.645 4.186 7.455 1.00 0.00 C ATOM 0 H LEU B 80 -2.283 2.413 8.061 1.00 0.00 H new ATOM 0 HA LEU B 80 -4.155 2.080 10.087 1.00 0.00 H new ATOM 0 HB2 LEU B 80 -4.147 3.816 8.337 1.00 0.00 H new ATOM 0 HB3 LEU B 80 -4.467 2.605 7.112 1.00 0.00 H new ATOM 0 HG LEU B 80 -6.650 2.111 8.117 1.00 0.00 H new ATOM 0 HD11 LEU B 80 -7.581 3.512 9.917 1.00 0.00 H new ATOM 0 HD12 LEU B 80 -6.168 2.581 10.469 1.00 0.00 H new ATOM 0 HD13 LEU B 80 -6.004 4.315 10.104 1.00 0.00 H new ATOM 0 HD21 LEU B 80 -7.717 4.328 7.594 1.00 0.00 H new ATOM 0 HD22 LEU B 80 -6.120 5.107 7.709 1.00 0.00 H new ATOM 0 HD23 LEU B 80 -6.445 3.930 6.414 1.00 0.00 H new ATOM 2743 N ALA B 81 -4.382 -0.252 7.755 1.00 0.00 N ATOM 2744 CA ALA B 81 -4.853 -1.605 7.524 1.00 0.00 C ATOM 2745 C ALA B 81 -4.334 -2.557 8.608 1.00 0.00 C ATOM 2746 O ALA B 81 -5.115 -3.298 9.204 1.00 0.00 O ATOM 2747 CB ALA B 81 -4.444 -2.056 6.123 1.00 0.00 C ATOM 0 H ALA B 81 -3.831 0.133 6.988 1.00 0.00 H new ATOM 0 HA ALA B 81 -5.941 -1.624 7.584 1.00 0.00 H new ATOM 0 HB1 ALA B 81 -4.798 -3.072 5.950 1.00 0.00 H new ATOM 0 HB2 ALA B 81 -4.884 -1.388 5.383 1.00 0.00 H new ATOM 0 HB3 ALA B 81 -3.358 -2.030 6.035 1.00 0.00 H new ATOM 2753 N MET B 82 -3.027 -2.534 8.884 1.00 0.00 N ATOM 2754 CA MET B 82 -2.402 -3.401 9.876 1.00 0.00 C ATOM 2755 C MET B 82 -2.947 -3.170 11.290 1.00 0.00 C ATOM 2756 O MET B 82 -2.937 -4.104 12.092 1.00 0.00 O ATOM 2757 CB MET B 82 -0.872 -3.281 9.827 1.00 0.00 C ATOM 2758 CG MET B 82 -0.282 -3.953 8.578 1.00 0.00 C ATOM 2759 SD MET B 82 -0.517 -5.746 8.406 1.00 0.00 S ATOM 2760 CE MET B 82 0.392 -6.364 9.839 1.00 0.00 C ATOM 0 H MET B 82 -2.371 -1.906 8.419 1.00 0.00 H new ATOM 0 HA MET B 82 -2.666 -4.426 9.614 1.00 0.00 H new ATOM 0 HB2 MET B 82 -0.590 -2.228 9.839 1.00 0.00 H new ATOM 0 HB3 MET B 82 -0.444 -3.736 10.720 1.00 0.00 H new ATOM 0 HG2 MET B 82 -0.713 -3.471 7.700 1.00 0.00 H new ATOM 0 HG3 MET B 82 0.789 -3.750 8.560 1.00 0.00 H new ATOM 0 HE1 MET B 82 0.441 -7.452 9.797 1.00 0.00 H new ATOM 0 HE2 MET B 82 1.402 -5.954 9.833 1.00 0.00 H new ATOM 0 HE3 MET B 82 -0.118 -6.059 10.753 1.00 0.00 H new ATOM 2770 N ILE B 83 -3.465 -1.981 11.623 1.00 0.00 N ATOM 2771 CA ILE B 83 -4.199 -1.818 12.884 1.00 0.00 C ATOM 2772 C ILE B 83 -5.291 -2.895 12.980 1.00 0.00 C ATOM 2773 O ILE B 83 -5.509 -3.461 14.048 1.00 0.00 O ATOM 2774 CB ILE B 83 -4.764 -0.390 13.054 1.00 0.00 C ATOM 2775 CG1 ILE B 83 -3.606 0.616 13.190 1.00 0.00 C ATOM 2776 CG2 ILE B 83 -5.678 -0.299 14.287 1.00 0.00 C ATOM 2777 CD1 ILE B 83 -4.067 2.077 13.231 1.00 0.00 C ATOM 0 H ILE B 83 -3.393 -1.138 11.054 1.00 0.00 H new ATOM 0 HA ILE B 83 -3.504 -1.954 13.712 1.00 0.00 H new ATOM 0 HB ILE B 83 -5.356 -0.150 12.171 1.00 0.00 H new ATOM 0 HG12 ILE B 83 -3.047 0.394 14.099 1.00 0.00 H new ATOM 0 HG13 ILE B 83 -2.920 0.483 12.354 1.00 0.00 H new ATOM 0 HG21 ILE B 83 -6.061 0.717 14.382 1.00 0.00 H new ATOM 0 HG22 ILE B 83 -6.512 -0.992 14.174 1.00 0.00 H new ATOM 0 HG23 ILE B 83 -5.110 -0.557 15.181 1.00 0.00 H new ATOM 0 HD11 ILE B 83 -3.199 2.730 13.328 1.00 0.00 H new ATOM 0 HD12 ILE B 83 -4.600 2.316 12.311 1.00 0.00 H new ATOM 0 HD13 ILE B 83 -4.730 2.226 14.084 1.00 0.00 H new ATOM 2789 N TYR B 84 -5.932 -3.234 11.856 1.00 0.00 N ATOM 2790 CA TYR B 84 -6.962 -4.261 11.788 1.00 0.00 C ATOM 2791 C TYR B 84 -6.374 -5.639 11.453 1.00 0.00 C ATOM 2792 O TYR B 84 -7.092 -6.493 10.930 1.00 0.00 O ATOM 2793 CB TYR B 84 -8.027 -3.836 10.766 1.00 0.00 C ATOM 2794 CG TYR B 84 -8.448 -2.381 10.868 1.00 0.00 C ATOM 2795 CD1 TYR B 84 -8.898 -1.862 12.096 1.00 0.00 C ATOM 2796 CD2 TYR B 84 -8.282 -1.520 9.767 1.00 0.00 C ATOM 2797 CE1 TYR B 84 -9.157 -0.487 12.228 1.00 0.00 C ATOM 2798 CE2 TYR B 84 -8.548 -0.147 9.899 1.00 0.00 C ATOM 2799 CZ TYR B 84 -8.973 0.371 11.134 1.00 0.00 C ATOM 2800 OH TYR B 84 -9.233 1.702 11.268 1.00 0.00 O ATOM 0 H TYR B 84 -5.742 -2.792 10.957 1.00 0.00 H new ATOM 0 HA TYR B 84 -7.427 -4.360 12.769 1.00 0.00 H new ATOM 0 HB2 TYR B 84 -7.645 -4.021 9.762 1.00 0.00 H new ATOM 0 HB3 TYR B 84 -8.907 -4.466 10.893 1.00 0.00 H new ATOM 0 HD1 TYR B 84 -9.045 -2.521 12.939 1.00 0.00 H new ATOM 0 HD2 TYR B 84 -7.949 -1.916 8.819 1.00 0.00 H new ATOM 0 HE1 TYR B 84 -9.498 -0.091 13.173 1.00 0.00 H new ATOM 0 HE2 TYR B 84 -8.426 0.511 9.051 1.00 0.00 H new ATOM 0 HH TYR B 84 -9.067 1.976 12.194 1.00 0.00 H new ATOM 2810 N ASN B 85 -5.097 -5.886 11.782 1.00 0.00 N ATOM 2811 CA ASN B 85 -4.421 -7.170 11.576 1.00 0.00 C ATOM 2812 C ASN B 85 -5.286 -8.353 12.018 1.00 0.00 C ATOM 2813 O ASN B 85 -5.327 -9.373 11.334 1.00 0.00 O ATOM 2814 CB ASN B 85 -3.054 -7.231 12.276 1.00 0.00 C ATOM 2815 CG ASN B 85 -3.156 -7.070 13.790 1.00 0.00 C ATOM 2816 OD1 ASN B 85 -3.288 -8.047 14.518 1.00 0.00 O ATOM 2817 ND2 ASN B 85 -3.114 -5.835 14.275 1.00 0.00 N ATOM 0 H ASN B 85 -4.495 -5.181 12.208 1.00 0.00 H new ATOM 0 HA ASN B 85 -4.255 -7.247 10.502 1.00 0.00 H new ATOM 0 HB2 ASN B 85 -2.577 -8.184 12.048 1.00 0.00 H new ATOM 0 HB3 ASN B 85 -2.410 -6.448 11.875 1.00 0.00 H new ATOM 0 HD21 ASN B 85 -3.193 -5.679 15.280 1.00 0.00 H new ATOM 0 HD22 ASN B 85 -3.003 -5.042 13.643 1.00 0.00 H new ATOM 2824 N GLU B 86 -5.992 -8.208 13.141 1.00 0.00 N ATOM 2825 CA GLU B 86 -6.888 -9.232 13.655 1.00 0.00 C ATOM 2826 C GLU B 86 -7.929 -9.625 12.602 1.00 0.00 C ATOM 2827 O GLU B 86 -8.151 -10.809 12.362 1.00 0.00 O ATOM 2828 CB GLU B 86 -7.567 -8.725 14.934 1.00 0.00 C ATOM 2829 CG GLU B 86 -6.551 -8.409 16.039 1.00 0.00 C ATOM 2830 CD GLU B 86 -7.254 -7.946 17.312 1.00 0.00 C ATOM 2831 OE1 GLU B 86 -7.642 -6.759 17.341 1.00 0.00 O ATOM 2832 OE2 GLU B 86 -7.404 -8.790 18.221 1.00 0.00 O ATOM 0 H GLU B 86 -5.954 -7.369 13.720 1.00 0.00 H new ATOM 0 HA GLU B 86 -6.308 -10.124 13.892 1.00 0.00 H new ATOM 0 HB2 GLU B 86 -8.145 -7.829 14.707 1.00 0.00 H new ATOM 0 HB3 GLU B 86 -8.271 -9.476 15.293 1.00 0.00 H new ATOM 0 HG2 GLU B 86 -5.952 -9.295 16.252 1.00 0.00 H new ATOM 0 HG3 GLU B 86 -5.865 -7.635 15.696 1.00 0.00 H new ATOM 2839 N ALA B 87 -8.566 -8.632 11.976 1.00 0.00 N ATOM 2840 CA ALA B 87 -9.605 -8.854 10.981 1.00 0.00 C ATOM 2841 C ALA B 87 -8.982 -9.330 9.670 1.00 0.00 C ATOM 2842 O ALA B 87 -9.470 -10.275 9.060 1.00 0.00 O ATOM 2843 CB ALA B 87 -10.407 -7.566 10.772 1.00 0.00 C ATOM 0 H ALA B 87 -8.370 -7.646 12.150 1.00 0.00 H new ATOM 0 HA ALA B 87 -10.285 -9.629 11.335 1.00 0.00 H new ATOM 0 HB1 ALA B 87 -11.183 -7.738 10.026 1.00 0.00 H new ATOM 0 HB2 ALA B 87 -10.868 -7.268 11.714 1.00 0.00 H new ATOM 0 HB3 ALA B 87 -9.741 -6.775 10.427 1.00 0.00 H new ATOM 2849 N LEU B 88 -7.902 -8.665 9.250 1.00 0.00 N ATOM 2850 CA LEU B 88 -7.115 -9.018 8.073 1.00 0.00 C ATOM 2851 C LEU B 88 -6.802 -10.515 8.098 1.00 0.00 C ATOM 2852 O LEU B 88 -7.155 -11.248 7.177 1.00 0.00 O ATOM 2853 CB LEU B 88 -5.854 -8.140 8.080 1.00 0.00 C ATOM 2854 CG LEU B 88 -4.912 -8.237 6.869 1.00 0.00 C ATOM 2855 CD1 LEU B 88 -3.951 -7.045 6.939 1.00 0.00 C ATOM 2856 CD2 LEU B 88 -4.073 -9.524 6.870 1.00 0.00 C ATOM 0 H LEU B 88 -7.544 -7.843 9.736 1.00 0.00 H new ATOM 0 HA LEU B 88 -7.659 -8.833 7.147 1.00 0.00 H new ATOM 0 HB2 LEU B 88 -6.169 -7.101 8.178 1.00 0.00 H new ATOM 0 HB3 LEU B 88 -5.279 -8.385 8.973 1.00 0.00 H new ATOM 0 HG LEU B 88 -5.520 -8.240 5.964 1.00 0.00 H new ATOM 0 HD11 LEU B 88 -3.265 -7.081 6.093 1.00 0.00 H new ATOM 0 HD12 LEU B 88 -4.520 -6.116 6.906 1.00 0.00 H new ATOM 0 HD13 LEU B 88 -3.383 -7.089 7.868 1.00 0.00 H new ATOM 0 HD21 LEU B 88 -3.427 -9.538 5.992 1.00 0.00 H new ATOM 0 HD22 LEU B 88 -3.461 -9.559 7.771 1.00 0.00 H new ATOM 0 HD23 LEU B 88 -4.735 -10.390 6.847 1.00 0.00 H new