USER MOD reduce.3.24.130724 H: found=0, std=0, add=1198, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1198 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 117 ASN :FLIP amide:sc= -0.314 F(o=-1.8,f=-1.2) USER MOD Set 1.2: A 134 GLN : amide:sc= -0.913 X(o=-1.2,f=-1.4) USER MOD Set 2.1: A 115 ASN : amide:sc= -5.2! C(o=-8.6!,f=-11!) USER MOD Set 2.2: A 131 GLN :FLIP amide:sc= -3.41! F(o=-12,f=-8.6!) USER MOD Set 3.1: A 72 HIS : no HD1:sc= -4.76! C(o=-5.8!,f=-5.9!) USER MOD Set 3.2: A 73 ASN :FLIP amide:sc= -0.998 F(o=-9.1,f=-5.8) USER MOD Set 4.1: A 47 HIS :FLIP no HD1:sc= -3.03! F(o=-5.6,f=-4!) USER MOD Set 4.2: A 78 ASN : amide:sc= -1 K(o=-4,f=-6.8!) USER MOD Set 5.1: A 4 HIS :FLIP no HD1:sc= -0.818 X(o=-1.5,f=-1.2) USER MOD Set 5.2: A 5 HIS :FLIP no HD1:sc= -0.383 F(o=-2.6,f=-1.2) USER MOD Single : A 1 MET CE :methyl 154:sc= -0.125 (180deg=-0.7) USER MOD Single : A 1 MET N :NH3+ -118:sc= 0.0886 (180deg=0) USER MOD Single : A 2 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 3 HIS : no HD1:sc= -0.313 K(o=-0.31,f=-1) USER MOD Single : A 6 HIS : no HE2:sc= -3.45 K(o=-3.5,f=-5!) USER MOD Single : A 7 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 12 HIS : no HD1:sc= 0 X(o=0,f=-0.018) USER MOD Single : A 13 ASN :FLIP amide:sc= -0.172 F(o=-0.84,f=-0.17) USER MOD Single : A 17 LYS NZ :NH3+ 162:sc= -0.0155 (180deg=-0.138) USER MOD Single : A 22 HIS : no HD1:sc= -1.14 X(o=-1.1,f=-0.75) USER MOD Single : A 24 HIS : no HE2:sc= -11.5! C(o=-11!,f=-11!) USER MOD Single : A 27 THR OG1 : rot 137:sc= -0.725 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot -100:sc= -1.05 USER MOD Single : A 43 MET CE :methyl -162:sc= -5.68! (180deg=-6.39!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 55 LYS NZ :NH3+ -178:sc=-0.00827 (180deg=-0.019) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 SER OG : rot 172:sc= 0.365! USER MOD Single : A 65 THR OG1 : rot 180:sc= 0.1 USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 71 SER OG : rot -38:sc= -1.22 USER MOD Single : A 76 MET CE :methyl -166:sc= -14.7! (180deg=-15.8!) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 SER OG : rot 180:sc= -0.847 USER MOD Single : A 96 TYR OH : rot -37:sc= -2.78! USER MOD Single : A 106 SER OG : rot 180:sc= -0.445 USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 HIS : no HD1:sc= -0.308 K(o=-0.31,f=-1) USER MOD Single : A 119 ASN : amide:sc= -2.46 X(o=-2.5,f=-2.4!) USER MOD Single : A 121 SER OG : rot 57:sc= 0.281 USER MOD Single : A 122 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ -119:sc= 0.259 (180deg=-0.193) USER MOD Single : A 124 TYR OH : rot -52:sc= -1.67 USER MOD Single : A 126 TYR OH : rot 180:sc= -1.12 USER MOD Single : A 128 SER OG : rot -92:sc= 0.812 USER MOD Single : A 136 MET CE :methyl -135:sc= -6.92! (180deg=-7.63!) USER MOD Single : A 137 LYS NZ :NH3+ -177:sc= -2.72! (180deg=-2.88!) USER MOD Single : A 140 GLN : amide:sc= -3.05 K(o=-3.1,f=-3.6!) USER MOD Single : A 144 THR OG1 : rot -123:sc= 0.72 USER MOD Single : A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 152 HIS : no HE2:sc= 0.299 K(o=0.3,f=-5.4!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -27.712 5.326 -16.604 1.00 0.00 N ATOM 2 CA MET A 1 -27.687 6.658 -15.945 1.00 0.00 C ATOM 3 C MET A 1 -27.408 6.527 -14.450 1.00 0.00 C ATOM 4 O MET A 1 -27.375 5.423 -13.909 1.00 0.00 O ATOM 5 CB MET A 1 -29.037 7.341 -16.172 1.00 0.00 C ATOM 6 CG MET A 1 -29.194 7.931 -17.564 1.00 0.00 C ATOM 7 SD MET A 1 -28.910 9.711 -17.599 1.00 0.00 S ATOM 8 CE MET A 1 -27.124 9.775 -17.466 1.00 0.00 C ATOM 0 H1 MET A 1 -26.955 5.276 -17.316 1.00 0.00 H new ATOM 0 H2 MET A 1 -27.566 4.583 -15.891 1.00 0.00 H new ATOM 0 H3 MET A 1 -28.632 5.185 -17.067 1.00 0.00 H new ATOM 0 HA MET A 1 -26.886 7.257 -16.378 1.00 0.00 H new ATOM 0 HB2 MET A 1 -29.834 6.617 -16.001 1.00 0.00 H new ATOM 0 HB3 MET A 1 -29.162 8.134 -15.434 1.00 0.00 H new ATOM 0 HG2 MET A 1 -28.495 7.442 -18.243 1.00 0.00 H new ATOM 0 HG3 MET A 1 -30.198 7.720 -17.933 1.00 0.00 H new ATOM 0 HE1 MET A 1 -26.758 10.696 -17.919 1.00 0.00 H new ATOM 0 HE2 MET A 1 -26.836 9.749 -16.415 1.00 0.00 H new ATOM 0 HE3 MET A 1 -26.690 8.919 -17.983 1.00 0.00 H new ATOM 20 N HIS A 2 -27.206 7.663 -13.790 1.00 0.00 N ATOM 21 CA HIS A 2 -26.929 7.675 -12.358 1.00 0.00 C ATOM 22 C HIS A 2 -27.614 8.858 -11.681 1.00 0.00 C ATOM 23 O HIS A 2 -27.273 10.013 -11.932 1.00 0.00 O ATOM 24 CB HIS A 2 -25.419 7.732 -12.111 1.00 0.00 C ATOM 25 CG HIS A 2 -24.926 6.670 -11.177 1.00 0.00 C ATOM 26 ND1 HIS A 2 -24.792 5.348 -11.544 1.00 0.00 N ATOM 27 CD2 HIS A 2 -24.532 6.740 -9.883 1.00 0.00 C ATOM 28 CE1 HIS A 2 -24.338 4.650 -10.517 1.00 0.00 C ATOM 29 NE2 HIS A 2 -24.172 5.473 -9.498 1.00 0.00 N ATOM 0 H HIS A 2 -27.229 8.586 -14.223 1.00 0.00 H new ATOM 0 HA HIS A 2 -27.326 6.756 -11.928 1.00 0.00 H new ATOM 0 HB2 HIS A 2 -24.899 7.636 -13.064 1.00 0.00 H new ATOM 0 HB3 HIS A 2 -25.162 8.710 -11.704 1.00 0.00 H new ATOM 0 HD2 HIS A 2 -24.506 7.628 -9.269 1.00 0.00 H new ATOM 0 HE1 HIS A 2 -24.137 3.589 -10.512 1.00 0.00 H new ATOM 0 HE2 HIS A 2 -23.831 5.209 -8.573 1.00 0.00 H new ATOM 38 N HIS A 3 -28.582 8.559 -10.820 1.00 0.00 N ATOM 39 CA HIS A 3 -29.315 9.599 -10.107 1.00 0.00 C ATOM 40 C HIS A 3 -28.614 9.959 -8.801 1.00 0.00 C ATOM 41 O HIS A 3 -27.620 9.337 -8.426 1.00 0.00 O ATOM 42 CB HIS A 3 -30.747 9.139 -9.820 1.00 0.00 C ATOM 43 CG HIS A 3 -30.821 7.841 -9.078 1.00 0.00 C ATOM 44 ND1 HIS A 3 -30.471 7.711 -7.751 1.00 0.00 N ATOM 45 CD2 HIS A 3 -31.209 6.608 -9.485 1.00 0.00 C ATOM 46 CE1 HIS A 3 -30.640 6.457 -7.373 1.00 0.00 C ATOM 47 NE2 HIS A 3 -31.088 5.767 -8.406 1.00 0.00 N ATOM 0 H HIS A 3 -28.876 7.608 -10.600 1.00 0.00 H new ATOM 0 HA HIS A 3 -29.346 10.486 -10.740 1.00 0.00 H new ATOM 0 HB2 HIS A 3 -31.258 9.909 -9.241 1.00 0.00 H new ATOM 0 HB3 HIS A 3 -31.284 9.040 -10.763 1.00 0.00 H new ATOM 0 HD2 HIS A 3 -31.550 6.337 -10.473 1.00 0.00 H new ATOM 0 HE1 HIS A 3 -30.445 6.063 -6.387 1.00 0.00 H new ATOM 0 HE2 HIS A 3 -31.308 4.771 -8.403 1.00 0.00 H new ATOM 56 N HIS A 4 -29.140 10.968 -8.111 1.00 0.00 N ATOM 57 CA HIS A 4 -28.564 11.411 -6.847 1.00 0.00 C ATOM 58 C HIS A 4 -29.392 12.537 -6.238 1.00 0.00 C ATOM 59 O HIS A 4 -30.466 12.871 -6.739 1.00 0.00 O ATOM 60 CB HIS A 4 -27.121 11.878 -7.057 1.00 0.00 C ATOM 61 CG HIS A 4 -26.997 13.039 -7.994 1.00 0.00 C ATOM 62 ND1 HIS A 4 -26.649 14.327 -7.767 1.00 0.00 N flip ATOM 63 CD2 HIS A 4 -27.248 12.945 -9.347 1.00 0.00 C flip ATOM 64 CE1 HIS A 4 -26.693 14.980 -8.974 1.00 0.00 C flip ATOM 65 NE2 HIS A 4 -27.058 14.124 -9.912 1.00 0.00 N flip ATOM 0 H HIS A 4 -29.963 11.493 -8.407 1.00 0.00 H new ATOM 0 HA HIS A 4 -28.569 10.567 -6.157 1.00 0.00 H new ATOM 0 HB2 HIS A 4 -26.693 12.153 -6.093 1.00 0.00 H new ATOM 0 HB3 HIS A 4 -26.531 11.046 -7.442 1.00 0.00 H new ATOM 0 HD2 HIS A 4 -27.553 12.047 -9.864 1.00 0.00 H new ATOM 0 HE1 HIS A 4 -26.466 16.024 -9.131 1.00 0.00 H new ATOM 0 HE2 HIS A 4 -27.173 14.337 -10.903 1.00 0.00 H new ATOM 74 N HIS A 5 -28.887 13.118 -5.153 1.00 0.00 N ATOM 75 CA HIS A 5 -29.577 14.208 -4.471 1.00 0.00 C ATOM 76 C HIS A 5 -30.917 13.740 -3.905 1.00 0.00 C ATOM 77 O HIS A 5 -31.034 13.464 -2.713 1.00 0.00 O ATOM 78 CB HIS A 5 -29.793 15.387 -5.425 1.00 0.00 C ATOM 79 CG HIS A 5 -28.590 16.267 -5.568 1.00 0.00 C ATOM 80 ND1 HIS A 5 -28.012 16.804 -6.670 1.00 0.00 N flip ATOM 81 CD2 HIS A 5 -27.834 16.690 -4.495 1.00 0.00 C flip ATOM 82 CE1 HIS A 5 -26.930 17.535 -6.244 1.00 0.00 C flip ATOM 83 NE2 HIS A 5 -26.844 17.451 -4.930 1.00 0.00 N flip ATOM 0 H HIS A 5 -28.000 12.851 -4.727 1.00 0.00 H new ATOM 0 HA HIS A 5 -28.949 14.535 -3.642 1.00 0.00 H new ATOM 0 HB2 HIS A 5 -30.072 15.004 -6.407 1.00 0.00 H new ATOM 0 HB3 HIS A 5 -30.631 15.985 -5.067 1.00 0.00 H new ATOM 0 HD2 HIS A 5 -28.021 16.439 -3.461 1.00 0.00 H new ATOM 0 HE1 HIS A 5 -26.258 18.089 -6.882 1.00 0.00 H new ATOM 0 HE2 HIS A 5 -26.135 17.897 -4.349 1.00 0.00 H new ATOM 92 N HIS A 6 -31.923 13.652 -4.771 1.00 0.00 N ATOM 93 CA HIS A 6 -33.252 13.218 -4.356 1.00 0.00 C ATOM 94 C HIS A 6 -33.204 11.821 -3.747 1.00 0.00 C ATOM 95 O HIS A 6 -32.955 10.837 -4.443 1.00 0.00 O ATOM 96 CB HIS A 6 -34.211 13.235 -5.548 1.00 0.00 C ATOM 97 CG HIS A 6 -33.772 12.363 -6.682 1.00 0.00 C ATOM 98 ND1 HIS A 6 -34.090 11.023 -6.769 1.00 0.00 N ATOM 99 CD2 HIS A 6 -33.034 12.644 -7.783 1.00 0.00 C ATOM 100 CE1 HIS A 6 -33.567 10.519 -7.872 1.00 0.00 C ATOM 101 NE2 HIS A 6 -32.922 11.481 -8.506 1.00 0.00 N ATOM 0 H HIS A 6 -31.843 13.875 -5.763 1.00 0.00 H new ATOM 0 HA HIS A 6 -33.613 13.912 -3.597 1.00 0.00 H new ATOM 0 HB2 HIS A 6 -35.198 12.914 -5.214 1.00 0.00 H new ATOM 0 HB3 HIS A 6 -34.314 14.259 -5.907 1.00 0.00 H new ATOM 0 HD1 HIS A 6 -34.643 10.503 -6.088 1.00 0.00 H new ATOM 0 HD2 HIS A 6 -32.612 13.603 -8.044 1.00 0.00 H new ATOM 0 HE1 HIS A 6 -33.652 9.494 -8.200 1.00 0.00 H new ATOM 110 N HIS A 7 -33.448 11.741 -2.443 1.00 0.00 N ATOM 111 CA HIS A 7 -33.435 10.465 -1.736 1.00 0.00 C ATOM 112 C HIS A 7 -32.046 9.835 -1.772 1.00 0.00 C ATOM 113 O HIS A 7 -31.384 9.823 -2.810 1.00 0.00 O ATOM 114 CB HIS A 7 -34.460 9.507 -2.350 1.00 0.00 C ATOM 115 CG HIS A 7 -35.307 8.805 -1.333 1.00 0.00 C ATOM 116 ND1 HIS A 7 -36.606 9.170 -1.055 1.00 0.00 N ATOM 117 CD2 HIS A 7 -35.031 7.753 -0.526 1.00 0.00 C ATOM 118 CE1 HIS A 7 -37.094 8.375 -0.120 1.00 0.00 C ATOM 119 NE2 HIS A 7 -36.159 7.506 0.218 1.00 0.00 N ATOM 0 H HIS A 7 -33.658 12.546 -1.853 1.00 0.00 H new ATOM 0 HA HIS A 7 -33.701 10.652 -0.696 1.00 0.00 H new ATOM 0 HB2 HIS A 7 -35.107 10.065 -3.027 1.00 0.00 H new ATOM 0 HB3 HIS A 7 -33.936 8.763 -2.950 1.00 0.00 H new ATOM 0 HD2 HIS A 7 -34.099 7.210 -0.477 1.00 0.00 H new ATOM 0 HE1 HIS A 7 -38.089 8.427 0.297 1.00 0.00 H new ATOM 0 HE2 HIS A 7 -36.258 6.771 0.918 1.00 0.00 H new ATOM 128 N MET A 8 -31.610 9.311 -0.630 1.00 0.00 N ATOM 129 CA MET A 8 -30.302 8.677 -0.529 1.00 0.00 C ATOM 130 C MET A 8 -29.188 9.669 -0.850 1.00 0.00 C ATOM 131 O MET A 8 -29.408 10.659 -1.547 1.00 0.00 O ATOM 132 CB MET A 8 -30.218 7.477 -1.474 1.00 0.00 C ATOM 133 CG MET A 8 -29.239 6.410 -1.014 1.00 0.00 C ATOM 134 SD MET A 8 -29.033 5.088 -2.223 1.00 0.00 S ATOM 135 CE MET A 8 -30.373 3.994 -1.758 1.00 0.00 C ATOM 0 H MET A 8 -32.145 9.314 0.238 1.00 0.00 H new ATOM 0 HA MET A 8 -30.173 8.333 0.497 1.00 0.00 H new ATOM 0 HB2 MET A 8 -31.208 7.032 -1.572 1.00 0.00 H new ATOM 0 HB3 MET A 8 -29.925 7.825 -2.465 1.00 0.00 H new ATOM 0 HG2 MET A 8 -28.271 6.871 -0.817 1.00 0.00 H new ATOM 0 HG3 MET A 8 -29.587 5.985 -0.072 1.00 0.00 H new ATOM 0 HE1 MET A 8 -30.378 3.125 -2.416 1.00 0.00 H new ATOM 0 HE2 MET A 8 -30.235 3.668 -0.727 1.00 0.00 H new ATOM 0 HE3 MET A 8 -31.322 4.523 -1.847 1.00 0.00 H new ATOM 145 N SER A 9 -27.994 9.395 -0.336 1.00 0.00 N ATOM 146 CA SER A 9 -26.844 10.262 -0.569 1.00 0.00 C ATOM 147 C SER A 9 -25.828 9.586 -1.484 1.00 0.00 C ATOM 148 O SER A 9 -25.109 10.254 -2.229 1.00 0.00 O ATOM 149 CB SER A 9 -26.183 10.632 0.760 1.00 0.00 C ATOM 150 OG SER A 9 -25.949 9.482 1.553 1.00 0.00 O ATOM 0 H SER A 9 -27.797 8.580 0.245 1.00 0.00 H new ATOM 0 HA SER A 9 -27.198 11.170 -1.058 1.00 0.00 H new ATOM 0 HB2 SER A 9 -25.240 11.144 0.570 1.00 0.00 H new ATOM 0 HB3 SER A 9 -26.820 11.329 1.304 1.00 0.00 H new ATOM 0 HG SER A 9 -25.524 9.747 2.396 1.00 0.00 H new ATOM 156 N ASP A 10 -25.776 8.259 -1.426 1.00 0.00 N ATOM 157 CA ASP A 10 -24.849 7.492 -2.251 1.00 0.00 C ATOM 158 C ASP A 10 -23.403 7.845 -1.919 1.00 0.00 C ATOM 159 O ASP A 10 -23.137 8.816 -1.210 1.00 0.00 O ATOM 160 CB ASP A 10 -25.121 7.747 -3.735 1.00 0.00 C ATOM 161 CG ASP A 10 -26.162 6.801 -4.302 1.00 0.00 C ATOM 162 OD1 ASP A 10 -25.817 5.632 -4.572 1.00 0.00 O ATOM 163 OD2 ASP A 10 -27.323 7.230 -4.473 1.00 0.00 O ATOM 0 H ASP A 10 -26.365 7.692 -0.816 1.00 0.00 H new ATOM 0 HA ASP A 10 -25.004 6.434 -2.037 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -25.457 8.775 -3.869 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -24.192 7.640 -4.296 1.00 0.00 H new ATOM 168 N GLY A 11 -22.471 7.050 -2.436 1.00 0.00 N ATOM 169 CA GLY A 11 -21.062 7.293 -2.184 1.00 0.00 C ATOM 170 C GLY A 11 -20.346 6.061 -1.662 1.00 0.00 C ATOM 171 O GLY A 11 -20.494 5.698 -0.496 1.00 0.00 O ATOM 0 H GLY A 11 -22.667 6.241 -3.026 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -20.583 7.625 -3.105 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -20.959 8.103 -1.462 1.00 0.00 H new ATOM 175 N HIS A 12 -19.569 5.419 -2.529 1.00 0.00 N ATOM 176 CA HIS A 12 -18.830 4.221 -2.148 1.00 0.00 C ATOM 177 C HIS A 12 -17.897 3.775 -3.271 1.00 0.00 C ATOM 178 O HIS A 12 -16.756 3.382 -3.024 1.00 0.00 O ATOM 179 CB HIS A 12 -19.800 3.091 -1.792 1.00 0.00 C ATOM 180 CG HIS A 12 -19.544 2.485 -0.446 1.00 0.00 C ATOM 181 ND1 HIS A 12 -20.193 2.893 0.700 1.00 0.00 N ATOM 182 CD2 HIS A 12 -18.703 1.493 -0.066 1.00 0.00 C ATOM 183 CE1 HIS A 12 -19.763 2.179 1.724 1.00 0.00 C ATOM 184 NE2 HIS A 12 -18.859 1.322 1.286 1.00 0.00 N ATOM 0 H HIS A 12 -19.435 5.708 -3.498 1.00 0.00 H new ATOM 0 HA HIS A 12 -18.225 4.460 -1.274 1.00 0.00 H new ATOM 0 HB2 HIS A 12 -20.819 3.476 -1.820 1.00 0.00 H new ATOM 0 HB3 HIS A 12 -19.732 2.312 -2.551 1.00 0.00 H new ATOM 0 HD2 HIS A 12 -18.034 0.940 -0.708 1.00 0.00 H new ATOM 0 HE1 HIS A 12 -20.095 2.279 2.747 1.00 0.00 H new ATOM 0 HE2 HIS A 12 -18.358 0.643 1.860 1.00 0.00 H new ATOM 193 N ASN A 13 -18.389 3.840 -4.504 1.00 0.00 N ATOM 194 CA ASN A 13 -17.602 3.442 -5.664 1.00 0.00 C ATOM 195 C ASN A 13 -16.369 4.329 -5.819 1.00 0.00 C ATOM 196 O ASN A 13 -16.153 5.252 -5.033 1.00 0.00 O ATOM 197 CB ASN A 13 -18.454 3.510 -6.932 1.00 0.00 C ATOM 198 CG ASN A 13 -19.079 4.877 -7.135 1.00 0.00 C ATOM 199 OD1 ASN A 13 -18.272 5.836 -7.574 1.00 0.00 O flip ATOM 200 ND2 ASN A 13 -20.270 5.069 -6.900 1.00 0.00 N flip ATOM 0 H ASN A 13 -19.330 4.165 -4.725 1.00 0.00 H new ATOM 0 HA ASN A 13 -17.271 2.415 -5.510 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -17.836 3.264 -7.796 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -19.241 2.758 -6.879 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -20.853 4.303 -6.564 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -20.675 5.994 -7.041 1.00 0.00 H new ATOM 207 N GLY A 14 -15.564 4.041 -6.837 1.00 0.00 N ATOM 208 CA GLY A 14 -14.363 4.821 -7.078 1.00 0.00 C ATOM 209 C GLY A 14 -13.098 3.997 -6.937 1.00 0.00 C ATOM 210 O GLY A 14 -12.296 3.915 -7.867 1.00 0.00 O ATOM 0 H GLY A 14 -15.722 3.282 -7.499 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -14.405 5.247 -8.080 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -14.329 5.656 -6.378 1.00 0.00 H new ATOM 214 N LEU A 15 -12.918 3.388 -5.771 1.00 0.00 N ATOM 215 CA LEU A 15 -11.742 2.567 -5.507 1.00 0.00 C ATOM 216 C LEU A 15 -10.461 3.405 -5.603 1.00 0.00 C ATOM 217 O LEU A 15 -10.150 4.168 -4.688 1.00 0.00 O ATOM 218 CB LEU A 15 -11.697 1.381 -6.474 1.00 0.00 C ATOM 219 CG LEU A 15 -12.607 0.207 -6.102 1.00 0.00 C ATOM 220 CD1 LEU A 15 -14.048 0.670 -5.958 1.00 0.00 C ATOM 221 CD2 LEU A 15 -12.501 -0.899 -7.141 1.00 0.00 C ATOM 0 H LEU A 15 -13.573 3.447 -4.991 1.00 0.00 H new ATOM 0 HA LEU A 15 -11.810 2.178 -4.491 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -11.971 1.732 -7.469 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -10.670 1.020 -6.535 1.00 0.00 H new ATOM 0 HG LEU A 15 -12.279 -0.191 -5.142 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -14.678 -0.179 -5.693 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -14.111 1.426 -5.175 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -14.390 1.095 -6.902 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -13.154 -1.725 -6.861 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -12.802 -0.513 -8.115 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -11.471 -1.252 -7.193 1.00 0.00 H new ATOM 233 N GLY A 16 -9.722 3.275 -6.709 1.00 0.00 N ATOM 234 CA GLY A 16 -8.500 4.045 -6.869 1.00 0.00 C ATOM 235 C GLY A 16 -8.792 5.507 -7.148 1.00 0.00 C ATOM 236 O GLY A 16 -8.269 6.394 -6.475 1.00 0.00 O ATOM 0 H GLY A 16 -9.948 2.656 -7.488 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -7.895 3.960 -5.966 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -7.912 3.629 -7.687 1.00 0.00 H new ATOM 240 N LYS A 17 -9.642 5.749 -8.143 1.00 0.00 N ATOM 241 CA LYS A 17 -10.030 7.106 -8.524 1.00 0.00 C ATOM 242 C LYS A 17 -8.824 8.042 -8.592 1.00 0.00 C ATOM 243 O LYS A 17 -8.666 8.929 -7.754 1.00 0.00 O ATOM 244 CB LYS A 17 -11.069 7.653 -7.540 1.00 0.00 C ATOM 245 CG LYS A 17 -12.475 7.712 -8.115 1.00 0.00 C ATOM 246 CD LYS A 17 -12.740 9.043 -8.800 1.00 0.00 C ATOM 247 CE LYS A 17 -12.451 8.967 -10.291 1.00 0.00 C ATOM 248 NZ LYS A 17 -13.479 8.169 -11.016 1.00 0.00 N ATOM 0 H LYS A 17 -10.078 5.017 -8.704 1.00 0.00 H new ATOM 0 HA LYS A 17 -10.467 7.058 -9.521 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -11.076 7.029 -6.647 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -10.770 8.654 -7.227 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -12.612 6.900 -8.829 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -13.202 7.561 -7.317 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -13.779 9.334 -8.644 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -12.121 9.817 -8.347 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -12.415 9.974 -10.706 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -11.469 8.522 -10.448 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -13.433 8.385 -12.032 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -13.299 7.155 -10.869 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -14.424 8.409 -10.654 1.00 0.00 H new ATOM 262 N GLY A 18 -7.979 7.843 -9.599 1.00 0.00 N ATOM 263 CA GLY A 18 -6.809 8.682 -9.755 1.00 0.00 C ATOM 264 C GLY A 18 -5.670 7.966 -10.450 1.00 0.00 C ATOM 265 O GLY A 18 -5.113 8.471 -11.425 1.00 0.00 O ATOM 0 H GLY A 18 -8.085 7.117 -10.307 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -7.077 9.571 -10.326 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -6.476 9.021 -8.774 1.00 0.00 H new ATOM 269 N PHE A 19 -5.322 6.788 -9.947 1.00 0.00 N ATOM 270 CA PHE A 19 -4.236 6.008 -10.523 1.00 0.00 C ATOM 271 C PHE A 19 -4.688 5.267 -11.778 1.00 0.00 C ATOM 272 O PHE A 19 -4.416 5.704 -12.896 1.00 0.00 O ATOM 273 CB PHE A 19 -3.683 5.022 -9.490 1.00 0.00 C ATOM 274 CG PHE A 19 -2.218 5.199 -9.183 1.00 0.00 C ATOM 275 CD1 PHE A 19 -1.354 5.736 -10.122 1.00 0.00 C ATOM 276 CD2 PHE A 19 -1.705 4.813 -7.956 1.00 0.00 C ATOM 277 CE1 PHE A 19 -0.008 5.883 -9.845 1.00 0.00 C ATOM 278 CE2 PHE A 19 -0.361 4.960 -7.671 1.00 0.00 C ATOM 279 CZ PHE A 19 0.489 5.495 -8.616 1.00 0.00 C ATOM 0 H PHE A 19 -5.775 6.353 -9.143 1.00 0.00 H new ATOM 0 HA PHE A 19 -3.444 6.699 -10.811 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -4.251 5.127 -8.565 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -3.846 4.007 -9.851 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -1.737 6.044 -11.084 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -2.364 4.391 -7.212 1.00 0.00 H new ATOM 0 HE1 PHE A 19 0.654 6.301 -10.589 1.00 0.00 H new ATOM 0 HE2 PHE A 19 0.024 4.656 -6.709 1.00 0.00 H new ATOM 0 HZ PHE A 19 1.540 5.610 -8.396 1.00 0.00 H new ATOM 289 N GLY A 20 -5.372 4.144 -11.591 1.00 0.00 N ATOM 290 CA GLY A 20 -5.839 3.370 -12.724 1.00 0.00 C ATOM 291 C GLY A 20 -7.336 3.114 -12.679 1.00 0.00 C ATOM 292 O GLY A 20 -8.116 3.837 -13.298 1.00 0.00 O ATOM 0 H GLY A 20 -5.611 3.757 -10.678 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -5.592 3.896 -13.646 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -5.312 2.416 -12.750 1.00 0.00 H new ATOM 296 N ASP A 21 -7.733 2.081 -11.939 1.00 0.00 N ATOM 297 CA ASP A 21 -9.146 1.725 -11.809 1.00 0.00 C ATOM 298 C ASP A 21 -9.364 0.800 -10.611 1.00 0.00 C ATOM 299 O ASP A 21 -9.850 1.230 -9.567 1.00 0.00 O ATOM 300 CB ASP A 21 -9.657 1.056 -13.090 1.00 0.00 C ATOM 301 CG ASP A 21 -8.571 0.302 -13.836 1.00 0.00 C ATOM 302 OD1 ASP A 21 -7.642 0.958 -14.353 1.00 0.00 O ATOM 303 OD2 ASP A 21 -8.649 -0.942 -13.903 1.00 0.00 O ATOM 0 H ASP A 21 -7.097 1.475 -11.420 1.00 0.00 H new ATOM 0 HA ASP A 21 -9.710 2.644 -11.647 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -10.463 0.367 -12.837 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -10.081 1.816 -13.746 1.00 0.00 H new ATOM 308 N HIS A 22 -8.998 -0.470 -10.770 1.00 0.00 N ATOM 309 CA HIS A 22 -9.151 -1.454 -9.700 1.00 0.00 C ATOM 310 C HIS A 22 -7.852 -2.231 -9.499 1.00 0.00 C ATOM 311 O HIS A 22 -7.545 -3.147 -10.260 1.00 0.00 O ATOM 312 CB HIS A 22 -10.296 -2.422 -10.016 1.00 0.00 C ATOM 313 CG HIS A 22 -10.464 -2.708 -11.477 1.00 0.00 C ATOM 314 ND1 HIS A 22 -11.648 -2.501 -12.153 1.00 0.00 N ATOM 315 CD2 HIS A 22 -9.589 -3.188 -12.394 1.00 0.00 C ATOM 316 CE1 HIS A 22 -11.495 -2.839 -13.421 1.00 0.00 C ATOM 317 NE2 HIS A 22 -10.256 -3.259 -13.593 1.00 0.00 N ATOM 0 H HIS A 22 -8.593 -0.842 -11.629 1.00 0.00 H new ATOM 0 HA HIS A 22 -9.389 -0.921 -8.780 1.00 0.00 H new ATOM 0 HB2 HIS A 22 -10.121 -3.360 -9.490 1.00 0.00 H new ATOM 0 HB3 HIS A 22 -11.226 -2.008 -9.628 1.00 0.00 H new ATOM 0 HD2 HIS A 22 -8.560 -3.463 -12.216 1.00 0.00 H new ATOM 0 HE1 HIS A 22 -12.255 -2.781 -14.186 1.00 0.00 H new ATOM 0 HE2 HIS A 22 -9.858 -3.584 -14.474 1.00 0.00 H new ATOM 326 N ILE A 23 -7.094 -1.853 -8.470 1.00 0.00 N ATOM 327 CA ILE A 23 -5.823 -2.497 -8.161 1.00 0.00 C ATOM 328 C ILE A 23 -5.412 -2.246 -6.702 1.00 0.00 C ATOM 329 O ILE A 23 -5.678 -3.064 -5.813 1.00 0.00 O ATOM 330 CB ILE A 23 -4.693 -1.986 -9.082 1.00 0.00 C ATOM 331 CG1 ILE A 23 -4.944 -2.361 -10.544 1.00 0.00 C ATOM 332 CG2 ILE A 23 -3.356 -2.534 -8.617 1.00 0.00 C ATOM 333 CD1 ILE A 23 -5.597 -1.253 -11.346 1.00 0.00 C ATOM 0 H ILE A 23 -7.344 -1.097 -7.833 1.00 0.00 H new ATOM 0 HA ILE A 23 -5.968 -3.565 -8.322 1.00 0.00 H new ATOM 0 HB ILE A 23 -4.676 -0.898 -9.020 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -3.996 -2.627 -11.011 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -5.577 -3.247 -10.580 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -2.565 -2.169 -9.272 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -3.163 -2.204 -7.596 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -3.379 -3.623 -8.648 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -5.746 -1.586 -12.373 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -6.561 -1.002 -10.903 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -4.955 -0.372 -11.340 1.00 0.00 H new ATOM 345 N HIS A 24 -4.749 -1.108 -6.460 1.00 0.00 N ATOM 346 CA HIS A 24 -4.293 -0.764 -5.118 1.00 0.00 C ATOM 347 C HIS A 24 -5.375 -0.024 -4.347 1.00 0.00 C ATOM 348 O HIS A 24 -5.098 0.912 -3.596 1.00 0.00 O ATOM 349 CB HIS A 24 -3.008 0.083 -5.165 1.00 0.00 C ATOM 350 CG HIS A 24 -2.035 -0.300 -6.244 1.00 0.00 C ATOM 351 ND1 HIS A 24 -2.259 -0.074 -7.588 1.00 0.00 N ATOM 352 CD2 HIS A 24 -0.808 -0.874 -6.168 1.00 0.00 C ATOM 353 CE1 HIS A 24 -1.214 -0.494 -8.282 1.00 0.00 C ATOM 354 NE2 HIS A 24 -0.325 -0.982 -7.444 1.00 0.00 N ATOM 0 H HIS A 24 -4.520 -0.417 -7.175 1.00 0.00 H new ATOM 0 HA HIS A 24 -4.072 -1.698 -4.601 1.00 0.00 H new ATOM 0 HB2 HIS A 24 -3.285 1.129 -5.300 1.00 0.00 H new ATOM 0 HB3 HIS A 24 -2.506 0.008 -4.200 1.00 0.00 H new ATOM 0 HD1 HIS A 24 -3.098 0.350 -7.983 1.00 0.00 H new ATOM 0 HD2 HIS A 24 -0.305 -1.188 -5.266 1.00 0.00 H new ATOM 0 HE1 HIS A 24 -1.108 -0.445 -9.356 1.00 0.00 H new ATOM 363 N TRP A 25 -6.607 -0.450 -4.553 1.00 0.00 N ATOM 364 CA TRP A 25 -7.762 0.158 -3.909 1.00 0.00 C ATOM 365 C TRP A 25 -8.916 -0.829 -3.858 1.00 0.00 C ATOM 366 O TRP A 25 -10.042 -0.466 -3.519 1.00 0.00 O ATOM 367 CB TRP A 25 -8.179 1.389 -4.701 1.00 0.00 C ATOM 368 CG TRP A 25 -7.590 1.378 -6.071 1.00 0.00 C ATOM 369 CD1 TRP A 25 -8.145 0.846 -7.189 1.00 0.00 C ATOM 370 CD2 TRP A 25 -6.308 1.884 -6.460 1.00 0.00 C ATOM 371 NE1 TRP A 25 -7.284 0.971 -8.245 1.00 0.00 N ATOM 372 CE2 TRP A 25 -6.157 1.615 -7.829 1.00 0.00 C ATOM 373 CE3 TRP A 25 -5.277 2.536 -5.787 1.00 0.00 C ATOM 374 CZ2 TRP A 25 -5.015 1.973 -8.537 1.00 0.00 C ATOM 375 CZ3 TRP A 25 -4.148 2.892 -6.486 1.00 0.00 C ATOM 376 CH2 TRP A 25 -4.023 2.611 -7.850 1.00 0.00 C ATOM 0 H TRP A 25 -6.838 -1.228 -5.171 1.00 0.00 H new ATOM 0 HA TRP A 25 -7.499 0.442 -2.890 1.00 0.00 H new ATOM 0 HB2 TRP A 25 -9.266 1.428 -4.771 1.00 0.00 H new ATOM 0 HB3 TRP A 25 -7.861 2.288 -4.173 1.00 0.00 H new ATOM 0 HD1 TRP A 25 -9.123 0.391 -7.238 1.00 0.00 H new ATOM 0 HE1 TRP A 25 -7.458 0.636 -9.193 1.00 0.00 H new ATOM 0 HE3 TRP A 25 -5.363 2.758 -4.734 1.00 0.00 H new ATOM 0 HZ2 TRP A 25 -4.917 1.755 -9.590 1.00 0.00 H new ATOM 0 HZ3 TRP A 25 -3.344 3.398 -5.973 1.00 0.00 H new ATOM 0 HH2 TRP A 25 -3.123 2.905 -8.370 1.00 0.00 H new ATOM 387 N ARG A 26 -8.628 -2.077 -4.216 1.00 0.00 N ATOM 388 CA ARG A 26 -9.640 -3.117 -4.230 1.00 0.00 C ATOM 389 C ARG A 26 -10.487 -3.069 -2.963 1.00 0.00 C ATOM 390 O ARG A 26 -11.715 -3.108 -3.029 1.00 0.00 O ATOM 391 CB ARG A 26 -8.989 -4.494 -4.381 1.00 0.00 C ATOM 392 CG ARG A 26 -9.354 -5.199 -5.677 1.00 0.00 C ATOM 393 CD ARG A 26 -8.187 -6.009 -6.218 1.00 0.00 C ATOM 394 NE ARG A 26 -8.561 -6.787 -7.396 1.00 0.00 N ATOM 395 CZ ARG A 26 -7.779 -7.708 -7.955 1.00 0.00 C ATOM 396 NH1 ARG A 26 -6.581 -7.969 -7.447 1.00 0.00 N ATOM 397 NH2 ARG A 26 -8.197 -8.370 -9.024 1.00 0.00 N ATOM 0 H ARG A 26 -7.699 -2.388 -4.500 1.00 0.00 H new ATOM 0 HA ARG A 26 -10.293 -2.942 -5.085 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -7.906 -4.382 -4.330 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -9.285 -5.121 -3.540 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -10.207 -5.856 -5.507 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -9.662 -4.462 -6.419 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -7.367 -5.338 -6.472 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -7.821 -6.680 -5.441 1.00 0.00 H new ATOM 0 HE ARG A 26 -9.475 -6.615 -7.815 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -6.255 -7.463 -6.624 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -5.986 -8.676 -7.880 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -9.117 -8.174 -9.418 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -7.599 -9.076 -9.453 1.00 0.00 H new ATOM 411 N THR A 27 -9.816 -2.967 -1.812 1.00 0.00 N ATOM 412 CA THR A 27 -10.506 -2.896 -0.516 1.00 0.00 C ATOM 413 C THR A 27 -9.567 -3.246 0.634 1.00 0.00 C ATOM 414 O THR A 27 -8.668 -4.075 0.489 1.00 0.00 O ATOM 415 CB THR A 27 -11.716 -3.836 -0.478 1.00 0.00 C ATOM 416 OG1 THR A 27 -12.178 -4.001 0.851 1.00 0.00 O ATOM 417 CG2 THR A 27 -11.426 -5.214 -1.034 1.00 0.00 C ATOM 0 H THR A 27 -8.799 -2.932 -1.749 1.00 0.00 H new ATOM 0 HA THR A 27 -10.847 -1.868 -0.397 1.00 0.00 H new ATOM 0 HB THR A 27 -12.469 -3.361 -1.106 1.00 0.00 H new ATOM 0 HG1 THR A 27 -13.157 -3.957 0.865 1.00 0.00 H new ATOM 0 HG21 THR A 27 -12.326 -5.826 -0.976 1.00 0.00 H new ATOM 0 HG22 THR A 27 -11.112 -5.128 -2.074 1.00 0.00 H new ATOM 0 HG23 THR A 27 -10.631 -5.681 -0.452 1.00 0.00 H new ATOM 425 N LEU A 28 -9.795 -2.618 1.784 1.00 0.00 N ATOM 426 CA LEU A 28 -8.984 -2.867 2.968 1.00 0.00 C ATOM 427 C LEU A 28 -9.626 -3.937 3.846 1.00 0.00 C ATOM 428 O LEU A 28 -8.983 -4.917 4.218 1.00 0.00 O ATOM 429 CB LEU A 28 -8.799 -1.577 3.771 1.00 0.00 C ATOM 430 CG LEU A 28 -7.697 -1.628 4.830 1.00 0.00 C ATOM 431 CD1 LEU A 28 -7.012 -0.276 4.953 1.00 0.00 C ATOM 432 CD2 LEU A 28 -8.269 -2.062 6.172 1.00 0.00 C ATOM 0 H LEU A 28 -10.537 -1.931 1.919 1.00 0.00 H new ATOM 0 HA LEU A 28 -8.007 -3.223 2.641 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -8.580 -0.764 3.079 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -9.742 -1.333 4.261 1.00 0.00 H new ATOM 0 HG LEU A 28 -6.953 -2.362 4.519 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -6.231 -0.332 5.711 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -6.569 -0.004 3.995 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -7.744 0.478 5.241 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -7.472 -2.093 6.914 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -9.032 -1.352 6.489 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -8.713 -3.053 6.075 1.00 0.00 H new ATOM 444 N GLU A 29 -10.900 -3.739 4.169 1.00 0.00 N ATOM 445 CA GLU A 29 -11.633 -4.688 4.999 1.00 0.00 C ATOM 446 C GLU A 29 -11.729 -6.045 4.309 1.00 0.00 C ATOM 447 O GLU A 29 -11.547 -7.087 4.939 1.00 0.00 O ATOM 448 CB GLU A 29 -13.035 -4.156 5.306 1.00 0.00 C ATOM 449 CG GLU A 29 -13.492 -4.431 6.729 1.00 0.00 C ATOM 450 CD GLU A 29 -14.866 -5.069 6.789 1.00 0.00 C ATOM 451 OE1 GLU A 29 -15.850 -4.396 6.417 1.00 0.00 O ATOM 452 OE2 GLU A 29 -14.958 -6.242 7.210 1.00 0.00 O ATOM 0 H GLU A 29 -11.446 -2.931 3.869 1.00 0.00 H new ATOM 0 HA GLU A 29 -11.090 -4.812 5.936 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -13.053 -3.081 5.129 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -13.745 -4.606 4.612 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -12.770 -5.085 7.218 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -13.505 -3.496 7.289 1.00 0.00 H new ATOM 459 N ASP A 30 -12.010 -6.025 3.010 1.00 0.00 N ATOM 460 CA ASP A 30 -12.124 -7.255 2.237 1.00 0.00 C ATOM 461 C ASP A 30 -10.756 -7.714 1.744 1.00 0.00 C ATOM 462 O ASP A 30 -10.500 -8.911 1.625 1.00 0.00 O ATOM 463 CB ASP A 30 -13.070 -7.054 1.050 1.00 0.00 C ATOM 464 CG ASP A 30 -14.509 -7.382 1.396 1.00 0.00 C ATOM 465 OD1 ASP A 30 -15.224 -6.476 1.874 1.00 0.00 O ATOM 466 OD2 ASP A 30 -14.919 -8.542 1.191 1.00 0.00 O ATOM 0 H ASP A 30 -12.163 -5.172 2.472 1.00 0.00 H new ATOM 0 HA ASP A 30 -12.534 -8.028 2.888 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -13.007 -6.020 0.710 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -12.746 -7.683 0.220 1.00 0.00 H new ATOM 471 N GLY A 31 -9.876 -6.755 1.464 1.00 0.00 N ATOM 472 CA GLY A 31 -8.547 -7.089 0.994 1.00 0.00 C ATOM 473 C GLY A 31 -7.760 -7.882 2.019 1.00 0.00 C ATOM 474 O GLY A 31 -6.934 -8.722 1.663 1.00 0.00 O ATOM 0 H GLY A 31 -10.061 -5.756 1.555 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -8.624 -7.665 0.072 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -8.008 -6.173 0.753 1.00 0.00 H new ATOM 478 N LYS A 32 -8.021 -7.617 3.296 1.00 0.00 N ATOM 479 CA LYS A 32 -7.333 -8.314 4.375 1.00 0.00 C ATOM 480 C LYS A 32 -8.024 -9.638 4.689 1.00 0.00 C ATOM 481 O LYS A 32 -7.368 -10.639 4.981 1.00 0.00 O ATOM 482 CB LYS A 32 -7.279 -7.437 5.630 1.00 0.00 C ATOM 483 CG LYS A 32 -8.635 -7.192 6.271 1.00 0.00 C ATOM 484 CD LYS A 32 -8.899 -8.174 7.402 1.00 0.00 C ATOM 485 CE LYS A 32 -10.389 -8.358 7.643 1.00 0.00 C ATOM 486 NZ LYS A 32 -10.936 -7.320 8.561 1.00 0.00 N ATOM 0 H LYS A 32 -8.703 -6.925 3.607 1.00 0.00 H new ATOM 0 HA LYS A 32 -6.314 -8.524 4.049 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -6.622 -7.908 6.362 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -6.832 -6.477 5.371 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -8.679 -6.173 6.654 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -9.417 -7.283 5.518 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -8.446 -9.136 7.163 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -8.423 -7.816 8.315 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -10.919 -8.316 6.691 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -10.569 -9.347 8.065 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -11.954 -7.481 8.699 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -10.449 -7.376 9.478 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -10.787 -6.378 8.147 1.00 0.00 H new ATOM 500 N LYS A 33 -9.353 -9.640 4.617 1.00 0.00 N ATOM 501 CA LYS A 33 -10.127 -10.845 4.884 1.00 0.00 C ATOM 502 C LYS A 33 -9.843 -11.907 3.830 1.00 0.00 C ATOM 503 O LYS A 33 -9.717 -13.091 4.141 1.00 0.00 O ATOM 504 CB LYS A 33 -11.623 -10.523 4.914 1.00 0.00 C ATOM 505 CG LYS A 33 -12.490 -11.694 5.341 1.00 0.00 C ATOM 506 CD LYS A 33 -13.928 -11.521 4.878 1.00 0.00 C ATOM 507 CE LYS A 33 -14.508 -12.826 4.358 1.00 0.00 C ATOM 508 NZ LYS A 33 -15.750 -12.606 3.565 1.00 0.00 N ATOM 0 H LYS A 33 -9.913 -8.822 4.377 1.00 0.00 H new ATOM 0 HA LYS A 33 -9.831 -11.233 5.859 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -11.793 -9.689 5.595 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -11.935 -10.194 3.923 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -12.083 -12.618 4.930 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -12.465 -11.790 6.427 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -14.536 -11.156 5.706 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -13.970 -10.765 4.094 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -13.767 -13.331 3.739 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -14.726 -13.486 5.197 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -16.114 -13.520 3.229 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -16.467 -12.147 4.163 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -15.538 -11.997 2.749 1.00 0.00 H new ATOM 522 N GLU A 34 -9.735 -11.469 2.579 1.00 0.00 N ATOM 523 CA GLU A 34 -9.456 -12.374 1.473 1.00 0.00 C ATOM 524 C GLU A 34 -7.962 -12.668 1.383 1.00 0.00 C ATOM 525 O GLU A 34 -7.555 -13.741 0.941 1.00 0.00 O ATOM 526 CB GLU A 34 -9.952 -11.773 0.157 1.00 0.00 C ATOM 527 CG GLU A 34 -9.908 -12.746 -1.009 1.00 0.00 C ATOM 528 CD GLU A 34 -11.158 -12.685 -1.866 1.00 0.00 C ATOM 529 OE1 GLU A 34 -12.180 -13.284 -1.469 1.00 0.00 O ATOM 530 OE2 GLU A 34 -11.115 -12.039 -2.934 1.00 0.00 O ATOM 0 H GLU A 34 -9.837 -10.491 2.308 1.00 0.00 H new ATOM 0 HA GLU A 34 -9.984 -13.310 1.655 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -10.976 -11.423 0.290 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -9.346 -10.900 -0.086 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -9.037 -12.528 -1.627 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -9.782 -13.759 -0.628 1.00 0.00 H new ATOM 537 N ALA A 35 -7.149 -11.704 1.809 1.00 0.00 N ATOM 538 CA ALA A 35 -5.701 -11.858 1.781 1.00 0.00 C ATOM 539 C ALA A 35 -5.265 -13.064 2.605 1.00 0.00 C ATOM 540 O ALA A 35 -4.265 -13.714 2.295 1.00 0.00 O ATOM 541 CB ALA A 35 -5.025 -10.593 2.291 1.00 0.00 C ATOM 0 H ALA A 35 -7.471 -10.809 2.177 1.00 0.00 H new ATOM 0 HA ALA A 35 -5.396 -12.026 0.748 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -3.943 -10.723 2.264 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -5.305 -9.751 1.659 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -5.342 -10.399 3.316 1.00 0.00 H new ATOM 547 N ALA A 36 -6.022 -13.361 3.657 1.00 0.00 N ATOM 548 CA ALA A 36 -5.715 -14.490 4.525 1.00 0.00 C ATOM 549 C ALA A 36 -5.855 -15.811 3.775 1.00 0.00 C ATOM 550 O ALA A 36 -5.063 -16.733 3.967 1.00 0.00 O ATOM 551 CB ALA A 36 -6.619 -14.478 5.749 1.00 0.00 C ATOM 0 H ALA A 36 -6.853 -12.835 3.928 1.00 0.00 H new ATOM 0 HA ALA A 36 -4.680 -14.394 4.852 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -6.378 -15.328 6.388 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -6.468 -13.552 6.304 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -7.660 -14.546 5.433 1.00 0.00 H new ATOM 557 N ALA A 37 -6.867 -15.893 2.917 1.00 0.00 N ATOM 558 CA ALA A 37 -7.109 -17.101 2.136 1.00 0.00 C ATOM 559 C ALA A 37 -5.913 -17.426 1.249 1.00 0.00 C ATOM 560 O ALA A 37 -5.148 -18.347 1.534 1.00 0.00 O ATOM 561 CB ALA A 37 -8.369 -16.941 1.298 1.00 0.00 C ATOM 0 H ALA A 37 -7.532 -15.139 2.745 1.00 0.00 H new ATOM 0 HA ALA A 37 -7.251 -17.933 2.826 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -8.539 -17.849 0.720 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -9.222 -16.763 1.953 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -8.250 -16.096 0.620 1.00 0.00 H new ATOM 567 N SER A 38 -5.755 -16.661 0.174 1.00 0.00 N ATOM 568 CA SER A 38 -4.648 -16.867 -0.753 1.00 0.00 C ATOM 569 C SER A 38 -3.312 -16.594 -0.068 1.00 0.00 C ATOM 570 O SER A 38 -2.291 -17.187 -0.419 1.00 0.00 O ATOM 571 CB SER A 38 -4.801 -15.959 -1.976 1.00 0.00 C ATOM 572 OG SER A 38 -4.428 -14.627 -1.669 1.00 0.00 O ATOM 0 H SER A 38 -6.379 -15.894 -0.077 1.00 0.00 H new ATOM 0 HA SER A 38 -4.667 -17.907 -1.078 1.00 0.00 H new ATOM 0 HB2 SER A 38 -4.183 -16.335 -2.792 1.00 0.00 H new ATOM 0 HB3 SER A 38 -5.834 -15.981 -2.322 1.00 0.00 H new ATOM 0 HG SER A 38 -5.232 -14.091 -1.507 1.00 0.00 H new ATOM 578 N GLY A 39 -3.329 -15.696 0.911 1.00 0.00 N ATOM 579 CA GLY A 39 -2.115 -15.361 1.631 1.00 0.00 C ATOM 580 C GLY A 39 -1.332 -14.251 0.960 1.00 0.00 C ATOM 581 O GLY A 39 -0.102 -14.286 0.920 1.00 0.00 O ATOM 0 H GLY A 39 -4.162 -15.194 1.219 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -2.370 -15.059 2.647 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -1.487 -16.248 1.711 1.00 0.00 H new ATOM 585 N LEU A 40 -2.044 -13.261 0.432 1.00 0.00 N ATOM 586 CA LEU A 40 -1.405 -12.134 -0.239 1.00 0.00 C ATOM 587 C LEU A 40 -1.427 -10.886 0.644 1.00 0.00 C ATOM 588 O LEU A 40 -2.447 -10.572 1.260 1.00 0.00 O ATOM 589 CB LEU A 40 -2.097 -11.845 -1.574 1.00 0.00 C ATOM 590 CG LEU A 40 -3.507 -11.254 -1.468 1.00 0.00 C ATOM 591 CD1 LEU A 40 -3.444 -9.744 -1.298 1.00 0.00 C ATOM 592 CD2 LEU A 40 -4.332 -11.619 -2.694 1.00 0.00 C ATOM 0 H LEU A 40 -3.063 -13.216 0.455 1.00 0.00 H new ATOM 0 HA LEU A 40 -0.366 -12.401 -0.429 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -1.475 -11.156 -2.145 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -2.152 -12.772 -2.144 1.00 0.00 H new ATOM 0 HG LEU A 40 -3.991 -11.678 -0.588 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -4.455 -9.344 -1.225 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -2.891 -9.503 -0.390 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -2.940 -9.302 -2.157 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -5.330 -11.191 -2.601 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -3.849 -11.224 -3.588 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -4.408 -12.704 -2.772 1.00 0.00 H new ATOM 604 N PRO A 41 -0.302 -10.151 0.714 1.00 0.00 N ATOM 605 CA PRO A 41 -0.206 -8.931 1.521 1.00 0.00 C ATOM 606 C PRO A 41 -1.006 -7.789 0.909 1.00 0.00 C ATOM 607 O PRO A 41 -1.595 -7.940 -0.165 1.00 0.00 O ATOM 608 CB PRO A 41 1.288 -8.610 1.502 1.00 0.00 C ATOM 609 CG PRO A 41 1.783 -9.206 0.231 1.00 0.00 C ATOM 610 CD PRO A 41 0.960 -10.445 0.007 1.00 0.00 C ATOM 0 HA PRO A 41 -0.609 -9.064 2.525 1.00 0.00 H new ATOM 0 HB2 PRO A 41 1.463 -7.535 1.530 1.00 0.00 H new ATOM 0 HB3 PRO A 41 1.797 -9.038 2.366 1.00 0.00 H new ATOM 0 HG2 PRO A 41 1.670 -8.507 -0.598 1.00 0.00 H new ATOM 0 HG3 PRO A 41 2.843 -9.449 0.301 1.00 0.00 H new ATOM 0 HD2 PRO A 41 0.792 -10.629 -1.054 1.00 0.00 H new ATOM 0 HD3 PRO A 41 1.450 -11.331 0.411 1.00 0.00 H new ATOM 618 N LEU A 42 -1.034 -6.642 1.584 1.00 0.00 N ATOM 619 CA LEU A 42 -1.777 -5.505 1.065 1.00 0.00 C ATOM 620 C LEU A 42 -0.953 -4.228 1.097 1.00 0.00 C ATOM 621 O LEU A 42 -0.182 -3.988 2.023 1.00 0.00 O ATOM 622 CB LEU A 42 -3.080 -5.313 1.846 1.00 0.00 C ATOM 623 CG LEU A 42 -2.930 -4.707 3.244 1.00 0.00 C ATOM 624 CD1 LEU A 42 -4.191 -3.955 3.634 1.00 0.00 C ATOM 625 CD2 LEU A 42 -2.617 -5.791 4.263 1.00 0.00 C ATOM 0 H LEU A 42 -0.560 -6.480 2.473 1.00 0.00 H new ATOM 0 HA LEU A 42 -2.014 -5.720 0.023 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -3.742 -4.674 1.262 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -3.572 -6.281 1.940 1.00 0.00 H new ATOM 0 HG LEU A 42 -2.100 -4.001 3.228 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -4.068 -3.530 4.630 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -4.373 -3.154 2.918 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -5.038 -4.641 3.634 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -2.514 -5.343 5.251 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -3.427 -6.521 4.278 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -1.686 -6.288 3.991 1.00 0.00 H new ATOM 637 N MET A 43 -1.136 -3.410 0.072 1.00 0.00 N ATOM 638 CA MET A 43 -0.430 -2.140 -0.038 1.00 0.00 C ATOM 639 C MET A 43 -1.398 -0.983 0.217 1.00 0.00 C ATOM 640 O MET A 43 -2.614 -1.176 0.222 1.00 0.00 O ATOM 641 CB MET A 43 0.217 -2.021 -1.426 1.00 0.00 C ATOM 642 CG MET A 43 0.666 -0.610 -1.785 1.00 0.00 C ATOM 643 SD MET A 43 1.469 -0.521 -3.397 1.00 0.00 S ATOM 644 CE MET A 43 2.695 -1.816 -3.242 1.00 0.00 C ATOM 0 H MET A 43 -1.772 -3.604 -0.701 1.00 0.00 H new ATOM 0 HA MET A 43 0.359 -2.097 0.712 1.00 0.00 H new ATOM 0 HB2 MET A 43 1.078 -2.687 -1.472 1.00 0.00 H new ATOM 0 HB3 MET A 43 -0.493 -2.367 -2.177 1.00 0.00 H new ATOM 0 HG2 MET A 43 -0.198 0.054 -1.778 1.00 0.00 H new ATOM 0 HG3 MET A 43 1.354 -0.247 -1.021 1.00 0.00 H new ATOM 0 HE1 MET A 43 3.465 -1.681 -4.002 1.00 0.00 H new ATOM 0 HE2 MET A 43 3.150 -1.770 -2.253 1.00 0.00 H new ATOM 0 HE3 MET A 43 2.218 -2.787 -3.377 1.00 0.00 H new ATOM 654 N VAL A 44 -0.861 0.213 0.426 1.00 0.00 N ATOM 655 CA VAL A 44 -1.689 1.384 0.679 1.00 0.00 C ATOM 656 C VAL A 44 -1.129 2.615 -0.021 1.00 0.00 C ATOM 657 O VAL A 44 -0.121 3.179 0.405 1.00 0.00 O ATOM 658 CB VAL A 44 -1.812 1.676 2.187 1.00 0.00 C ATOM 659 CG1 VAL A 44 -2.642 2.927 2.433 1.00 0.00 C ATOM 660 CG2 VAL A 44 -2.414 0.486 2.909 1.00 0.00 C ATOM 0 H VAL A 44 0.142 0.397 0.425 1.00 0.00 H new ATOM 0 HA VAL A 44 -2.678 1.160 0.280 1.00 0.00 H new ATOM 0 HB VAL A 44 -0.812 1.852 2.582 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -2.714 3.111 3.505 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -2.166 3.780 1.949 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -3.642 2.787 2.021 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -2.494 0.708 3.973 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -3.405 0.279 2.506 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -1.776 -0.386 2.768 1.00 0.00 H new ATOM 670 N ILE A 45 -1.793 3.028 -1.091 1.00 0.00 N ATOM 671 CA ILE A 45 -1.370 4.197 -1.850 1.00 0.00 C ATOM 672 C ILE A 45 -2.202 5.417 -1.470 1.00 0.00 C ATOM 673 O ILE A 45 -3.341 5.560 -1.909 1.00 0.00 O ATOM 674 CB ILE A 45 -1.495 3.948 -3.369 1.00 0.00 C ATOM 675 CG1 ILE A 45 -0.612 2.769 -3.785 1.00 0.00 C ATOM 676 CG2 ILE A 45 -1.127 5.203 -4.151 1.00 0.00 C ATOM 677 CD1 ILE A 45 -0.537 2.562 -5.283 1.00 0.00 C ATOM 0 H ILE A 45 -2.629 2.570 -1.454 1.00 0.00 H new ATOM 0 HA ILE A 45 -0.324 4.384 -1.607 1.00 0.00 H new ATOM 0 HB ILE A 45 -2.532 3.701 -3.598 1.00 0.00 H new ATOM 0 HG12 ILE A 45 0.395 2.927 -3.398 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -0.993 1.860 -3.320 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -1.221 5.007 -5.219 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -1.797 6.016 -3.871 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -0.099 5.485 -3.923 1.00 0.00 H new ATOM 0 HD11 ILE A 45 0.106 1.709 -5.501 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -1.536 2.372 -5.675 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -0.127 3.455 -5.754 1.00 0.00 H new ATOM 689 N ILE A 46 -1.636 6.290 -0.646 1.00 0.00 N ATOM 690 CA ILE A 46 -2.334 7.485 -0.214 1.00 0.00 C ATOM 691 C ILE A 46 -1.709 8.716 -0.850 1.00 0.00 C ATOM 692 O ILE A 46 -0.486 8.835 -0.915 1.00 0.00 O ATOM 693 CB ILE A 46 -2.300 7.619 1.317 1.00 0.00 C ATOM 694 CG1 ILE A 46 -2.470 6.251 1.973 1.00 0.00 C ATOM 695 CG2 ILE A 46 -3.378 8.566 1.802 1.00 0.00 C ATOM 696 CD1 ILE A 46 -1.440 5.971 3.039 1.00 0.00 C ATOM 0 H ILE A 46 -0.695 6.189 -0.266 1.00 0.00 H new ATOM 0 HA ILE A 46 -3.373 7.402 -0.532 1.00 0.00 H new ATOM 0 HB ILE A 46 -1.331 8.030 1.599 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -3.465 6.187 2.413 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -2.410 5.478 1.207 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -3.333 8.643 2.888 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -3.222 9.551 1.361 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -4.356 8.186 1.506 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -1.617 4.984 3.465 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -0.443 6.003 2.599 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -1.515 6.724 3.824 1.00 0.00 H new ATOM 708 N HIS A 47 -2.546 9.623 -1.334 1.00 0.00 N ATOM 709 CA HIS A 47 -2.046 10.832 -1.980 1.00 0.00 C ATOM 710 C HIS A 47 -2.696 12.085 -1.412 1.00 0.00 C ATOM 711 O HIS A 47 -3.807 12.448 -1.794 1.00 0.00 O ATOM 712 CB HIS A 47 -2.278 10.764 -3.493 1.00 0.00 C ATOM 713 CG HIS A 47 -3.684 10.417 -3.871 1.00 0.00 C ATOM 714 ND1 HIS A 47 -4.456 9.356 -3.537 1.00 0.00 N flip ATOM 715 CD2 HIS A 47 -4.460 11.208 -4.693 1.00 0.00 C flip ATOM 716 CE1 HIS A 47 -5.669 9.523 -4.158 1.00 0.00 C flip ATOM 717 NE2 HIS A 47 -5.646 10.648 -4.849 1.00 0.00 N flip ATOM 0 H HIS A 47 -3.562 9.548 -1.294 1.00 0.00 H new ATOM 0 HA HIS A 47 -0.976 10.889 -1.781 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -2.019 11.726 -3.935 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -1.603 10.024 -3.922 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -4.146 12.140 -5.139 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -6.506 8.844 -4.092 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -6.413 11.021 -5.408 1.00 0.00 H new ATOM 726 N LYS A 48 -1.989 12.751 -0.504 1.00 0.00 N ATOM 727 CA LYS A 48 -2.502 13.976 0.104 1.00 0.00 C ATOM 728 C LYS A 48 -1.524 15.132 -0.087 1.00 0.00 C ATOM 729 O LYS A 48 -0.325 14.919 -0.265 1.00 0.00 O ATOM 730 CB LYS A 48 -2.780 13.762 1.593 1.00 0.00 C ATOM 731 CG LYS A 48 -4.139 13.145 1.874 1.00 0.00 C ATOM 732 CD LYS A 48 -4.558 13.351 3.321 1.00 0.00 C ATOM 733 CE LYS A 48 -5.082 14.758 3.554 1.00 0.00 C ATOM 734 NZ LYS A 48 -5.082 15.121 4.998 1.00 0.00 N ATOM 0 H LYS A 48 -1.066 12.467 -0.174 1.00 0.00 H new ATOM 0 HA LYS A 48 -3.437 14.231 -0.394 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -2.005 13.119 2.010 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -2.711 14.720 2.108 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -4.884 13.587 1.212 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -4.108 12.078 1.652 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -5.328 12.626 3.584 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -3.708 13.165 3.977 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -4.469 15.470 3.001 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -6.095 14.837 3.160 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -5.447 16.088 5.113 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -5.688 14.458 5.523 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -4.112 15.071 5.369 1.00 0.00 H new ATOM 748 N SER A 49 -2.046 16.356 -0.054 1.00 0.00 N ATOM 749 CA SER A 49 -1.220 17.549 -0.227 1.00 0.00 C ATOM 750 C SER A 49 -0.425 17.474 -1.528 1.00 0.00 C ATOM 751 O SER A 49 -0.610 16.556 -2.326 1.00 0.00 O ATOM 752 CB SER A 49 -0.267 17.710 0.960 1.00 0.00 C ATOM 753 OG SER A 49 -0.812 18.579 1.937 1.00 0.00 O ATOM 0 H SER A 49 -3.037 16.548 0.091 1.00 0.00 H new ATOM 0 HA SER A 49 -1.879 18.416 -0.274 1.00 0.00 H new ATOM 0 HB2 SER A 49 -0.068 16.735 1.406 1.00 0.00 H new ATOM 0 HB3 SER A 49 0.689 18.102 0.612 1.00 0.00 H new ATOM 0 HG SER A 49 -0.185 18.664 2.685 1.00 0.00 H new ATOM 759 N TRP A 50 0.467 18.444 -1.736 1.00 0.00 N ATOM 760 CA TRP A 50 1.291 18.479 -2.942 1.00 0.00 C ATOM 761 C TRP A 50 1.918 17.110 -3.202 1.00 0.00 C ATOM 762 O TRP A 50 2.363 16.439 -2.272 1.00 0.00 O ATOM 763 CB TRP A 50 2.386 19.538 -2.809 1.00 0.00 C ATOM 764 CG TRP A 50 3.173 19.422 -1.540 1.00 0.00 C ATOM 765 CD1 TRP A 50 4.300 18.680 -1.339 1.00 0.00 C ATOM 766 CD2 TRP A 50 2.889 20.068 -0.292 1.00 0.00 C ATOM 767 NE1 TRP A 50 4.737 18.824 -0.043 1.00 0.00 N ATOM 768 CE2 TRP A 50 3.887 19.672 0.619 1.00 0.00 C ATOM 769 CE3 TRP A 50 1.890 20.943 0.143 1.00 0.00 C ATOM 770 CZ2 TRP A 50 3.914 20.121 1.937 1.00 0.00 C ATOM 771 CZ3 TRP A 50 1.918 21.388 1.451 1.00 0.00 C ATOM 772 CH2 TRP A 50 2.923 20.977 2.334 1.00 0.00 C ATOM 0 H TRP A 50 0.636 19.212 -1.087 1.00 0.00 H new ATOM 0 HA TRP A 50 0.651 18.737 -3.786 1.00 0.00 H new ATOM 0 HB2 TRP A 50 3.065 19.457 -3.658 1.00 0.00 H new ATOM 0 HB3 TRP A 50 1.932 20.528 -2.857 1.00 0.00 H new ATOM 0 HD1 TRP A 50 4.779 18.068 -2.089 1.00 0.00 H new ATOM 0 HE1 TRP A 50 5.559 18.374 0.360 1.00 0.00 H new ATOM 0 HE3 TRP A 50 1.110 21.266 -0.531 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 4.688 19.805 2.620 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 1.151 22.065 1.798 1.00 0.00 H new ATOM 0 HH2 TRP A 50 2.916 21.343 3.350 1.00 0.00 H new ATOM 783 N CYS A 51 1.934 16.692 -4.463 1.00 0.00 N ATOM 784 CA CYS A 51 2.492 15.393 -4.814 1.00 0.00 C ATOM 785 C CYS A 51 2.618 15.233 -6.332 1.00 0.00 C ATOM 786 O CYS A 51 1.758 15.689 -7.087 1.00 0.00 O ATOM 787 CB CYS A 51 1.606 14.288 -4.201 1.00 0.00 C ATOM 788 SG CYS A 51 1.110 12.934 -5.326 1.00 0.00 S ATOM 0 H CYS A 51 1.571 17.228 -5.251 1.00 0.00 H new ATOM 0 HA CYS A 51 3.500 15.311 -4.407 1.00 0.00 H new ATOM 0 HB2 CYS A 51 2.137 13.853 -3.355 1.00 0.00 H new ATOM 0 HB3 CYS A 51 0.703 14.753 -3.805 1.00 0.00 H new ATOM 793 N GLY A 52 3.687 14.569 -6.772 1.00 0.00 N ATOM 794 CA GLY A 52 3.893 14.341 -8.194 1.00 0.00 C ATOM 795 C GLY A 52 3.515 12.931 -8.579 1.00 0.00 C ATOM 796 O GLY A 52 3.069 12.679 -9.698 1.00 0.00 O ATOM 0 H GLY A 52 4.414 14.185 -6.168 1.00 0.00 H new ATOM 0 HA2 GLY A 52 3.298 15.050 -8.769 1.00 0.00 H new ATOM 0 HA3 GLY A 52 4.938 14.523 -8.447 1.00 0.00 H new ATOM 800 N ALA A 53 3.671 12.009 -7.632 1.00 0.00 N ATOM 801 CA ALA A 53 3.312 10.618 -7.862 1.00 0.00 C ATOM 802 C ALA A 53 1.857 10.509 -8.268 1.00 0.00 C ATOM 803 O ALA A 53 1.420 9.480 -8.776 1.00 0.00 O ATOM 804 CB ALA A 53 3.585 9.779 -6.624 1.00 0.00 C ATOM 0 H ALA A 53 4.043 12.202 -6.702 1.00 0.00 H new ATOM 0 HA ALA A 53 3.929 10.235 -8.675 1.00 0.00 H new ATOM 0 HB1 ALA A 53 3.309 8.743 -6.819 1.00 0.00 H new ATOM 0 HB2 ALA A 53 4.645 9.832 -6.375 1.00 0.00 H new ATOM 0 HB3 ALA A 53 2.997 10.160 -5.789 1.00 0.00 H new ATOM 810 N CYS A 54 1.115 11.588 -8.054 1.00 0.00 N ATOM 811 CA CYS A 54 -0.281 11.630 -8.415 1.00 0.00 C ATOM 812 C CYS A 54 -0.442 12.314 -9.771 1.00 0.00 C ATOM 813 O CYS A 54 -1.240 11.889 -10.610 1.00 0.00 O ATOM 814 CB CYS A 54 -1.110 12.348 -7.337 1.00 0.00 C ATOM 815 SG CYS A 54 -0.284 13.774 -6.545 1.00 0.00 S ATOM 0 H CYS A 54 1.467 12.446 -7.629 1.00 0.00 H new ATOM 0 HA CYS A 54 -0.654 10.608 -8.488 1.00 0.00 H new ATOM 0 HB2 CYS A 54 -2.042 12.691 -7.786 1.00 0.00 H new ATOM 0 HB3 CYS A 54 -1.375 11.626 -6.564 1.00 0.00 H new ATOM 820 N LYS A 55 0.345 13.365 -9.990 1.00 0.00 N ATOM 821 CA LYS A 55 0.301 14.099 -11.249 1.00 0.00 C ATOM 822 C LYS A 55 0.569 13.164 -12.428 1.00 0.00 C ATOM 823 O LYS A 55 -0.176 13.160 -13.407 1.00 0.00 O ATOM 824 CB LYS A 55 1.297 15.269 -11.229 1.00 0.00 C ATOM 825 CG LYS A 55 2.659 14.956 -11.832 1.00 0.00 C ATOM 826 CD LYS A 55 3.666 16.052 -11.525 1.00 0.00 C ATOM 827 CE LYS A 55 5.060 15.677 -11.997 1.00 0.00 C ATOM 828 NZ LYS A 55 5.891 15.126 -10.890 1.00 0.00 N ATOM 0 H LYS A 55 1.018 13.725 -9.314 1.00 0.00 H new ATOM 0 HA LYS A 55 -0.700 14.514 -11.372 1.00 0.00 H new ATOM 0 HB2 LYS A 55 0.860 16.109 -11.769 1.00 0.00 H new ATOM 0 HB3 LYS A 55 1.437 15.591 -10.197 1.00 0.00 H new ATOM 0 HG2 LYS A 55 3.022 14.006 -11.440 1.00 0.00 H new ATOM 0 HG3 LYS A 55 2.563 14.840 -12.912 1.00 0.00 H new ATOM 0 HD2 LYS A 55 3.355 16.979 -12.007 1.00 0.00 H new ATOM 0 HD3 LYS A 55 3.683 16.241 -10.452 1.00 0.00 H new ATOM 0 HE2 LYS A 55 4.987 14.941 -12.797 1.00 0.00 H new ATOM 0 HE3 LYS A 55 5.550 16.556 -12.416 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 6.845 14.914 -11.245 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 5.954 15.825 -10.122 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 5.454 14.254 -10.529 1.00 0.00 H new ATOM 842 N ALA A 56 1.626 12.357 -12.323 1.00 0.00 N ATOM 843 CA ALA A 56 1.957 11.408 -13.384 1.00 0.00 C ATOM 844 C ALA A 56 1.114 10.144 -13.251 1.00 0.00 C ATOM 845 O ALA A 56 0.869 9.436 -14.224 1.00 0.00 O ATOM 846 CB ALA A 56 3.439 11.067 -13.342 1.00 0.00 C ATOM 0 H ALA A 56 2.260 12.342 -11.524 1.00 0.00 H new ATOM 0 HA ALA A 56 1.734 11.870 -14.346 1.00 0.00 H new ATOM 0 HB1 ALA A 56 3.672 10.359 -14.137 1.00 0.00 H new ATOM 0 HB2 ALA A 56 4.025 11.975 -13.481 1.00 0.00 H new ATOM 0 HB3 ALA A 56 3.683 10.622 -12.377 1.00 0.00 H new ATOM 852 N LEU A 57 0.683 9.874 -12.022 1.00 0.00 N ATOM 853 CA LEU A 57 -0.126 8.702 -11.694 1.00 0.00 C ATOM 854 C LEU A 57 -1.254 8.460 -12.699 1.00 0.00 C ATOM 855 O LEU A 57 -1.492 7.326 -13.108 1.00 0.00 O ATOM 856 CB LEU A 57 -0.673 8.881 -10.266 1.00 0.00 C ATOM 857 CG LEU A 57 -2.177 8.655 -10.040 1.00 0.00 C ATOM 858 CD1 LEU A 57 -2.419 8.053 -8.665 1.00 0.00 C ATOM 859 CD2 LEU A 57 -2.949 9.958 -10.170 1.00 0.00 C ATOM 0 H LEU A 57 0.887 10.467 -11.218 1.00 0.00 H new ATOM 0 HA LEU A 57 0.504 7.814 -11.748 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -0.130 8.199 -9.612 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -0.434 9.893 -9.940 1.00 0.00 H new ATOM 0 HG LEU A 57 -2.531 7.963 -10.804 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -3.488 7.898 -8.519 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -1.900 7.097 -8.590 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -2.042 8.731 -7.899 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -4.010 9.770 -10.006 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -2.588 10.671 -9.429 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -2.804 10.369 -11.169 1.00 0.00 H new ATOM 871 N LYS A 58 -1.970 9.512 -13.065 1.00 0.00 N ATOM 872 CA LYS A 58 -3.099 9.371 -13.995 1.00 0.00 C ATOM 873 C LYS A 58 -2.690 8.818 -15.375 1.00 0.00 C ATOM 874 O LYS A 58 -3.114 7.727 -15.764 1.00 0.00 O ATOM 875 CB LYS A 58 -3.871 10.698 -14.174 1.00 0.00 C ATOM 876 CG LYS A 58 -3.156 11.952 -13.677 1.00 0.00 C ATOM 877 CD LYS A 58 -3.689 12.406 -12.328 1.00 0.00 C ATOM 878 CE LYS A 58 -4.729 13.504 -12.482 1.00 0.00 C ATOM 879 NZ LYS A 58 -4.878 14.306 -11.235 1.00 0.00 N ATOM 0 H LYS A 58 -1.799 10.464 -12.742 1.00 0.00 H new ATOM 0 HA LYS A 58 -3.757 8.637 -13.529 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -4.096 10.826 -15.233 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -4.825 10.615 -13.653 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -2.087 11.754 -13.598 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -3.279 12.754 -14.405 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -4.129 11.557 -11.805 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -2.865 12.767 -11.713 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -4.445 14.161 -13.304 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -5.689 13.060 -12.745 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -5.596 15.044 -11.381 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -5.174 13.684 -10.456 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -3.968 14.750 -10.997 1.00 0.00 H new ATOM 893 N PRO A 59 -1.879 9.570 -16.139 1.00 0.00 N ATOM 894 CA PRO A 59 -1.447 9.170 -17.491 1.00 0.00 C ATOM 895 C PRO A 59 -0.403 8.064 -17.505 1.00 0.00 C ATOM 896 O PRO A 59 -0.174 7.432 -18.537 1.00 0.00 O ATOM 897 CB PRO A 59 -0.849 10.455 -18.055 1.00 0.00 C ATOM 898 CG PRO A 59 -0.352 11.183 -16.857 1.00 0.00 C ATOM 899 CD PRO A 59 -1.330 10.877 -15.757 1.00 0.00 C ATOM 0 HA PRO A 59 -2.280 8.760 -18.062 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -0.042 10.244 -18.756 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -1.595 11.038 -18.594 1.00 0.00 H new ATOM 0 HG2 PRO A 59 0.653 10.856 -16.589 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -0.298 12.255 -17.045 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -0.840 10.838 -14.784 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -2.110 11.636 -15.691 1.00 0.00 H new ATOM 907 N LYS A 60 0.229 7.829 -16.369 1.00 0.00 N ATOM 908 CA LYS A 60 1.243 6.795 -16.276 1.00 0.00 C ATOM 909 C LYS A 60 0.606 5.478 -15.889 1.00 0.00 C ATOM 910 O LYS A 60 0.673 4.492 -16.623 1.00 0.00 O ATOM 911 CB LYS A 60 2.303 7.159 -15.238 1.00 0.00 C ATOM 912 CG LYS A 60 3.005 5.943 -14.659 1.00 0.00 C ATOM 913 CD LYS A 60 3.675 5.129 -15.754 1.00 0.00 C ATOM 914 CE LYS A 60 4.829 5.895 -16.384 1.00 0.00 C ATOM 915 NZ LYS A 60 4.878 5.706 -17.860 1.00 0.00 N ATOM 0 H LYS A 60 0.059 8.338 -15.502 1.00 0.00 H new ATOM 0 HA LYS A 60 1.720 6.705 -17.252 1.00 0.00 H new ATOM 0 HB2 LYS A 60 3.043 7.815 -15.696 1.00 0.00 H new ATOM 0 HB3 LYS A 60 1.835 7.721 -14.430 1.00 0.00 H new ATOM 0 HG2 LYS A 60 3.750 6.261 -13.930 1.00 0.00 H new ATOM 0 HG3 LYS A 60 2.284 5.321 -14.128 1.00 0.00 H new ATOM 0 HD2 LYS A 60 4.042 4.190 -15.339 1.00 0.00 H new ATOM 0 HD3 LYS A 60 2.943 4.874 -16.521 1.00 0.00 H new ATOM 0 HE2 LYS A 60 4.728 6.956 -16.157 1.00 0.00 H new ATOM 0 HE3 LYS A 60 5.769 5.563 -15.944 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 5.677 6.243 -18.252 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 5.000 4.696 -18.077 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 3.991 6.046 -18.283 1.00 0.00 H new ATOM 929 N PHE A 61 -0.010 5.481 -14.718 1.00 0.00 N ATOM 930 CA PHE A 61 -0.666 4.306 -14.199 1.00 0.00 C ATOM 931 C PHE A 61 -1.654 3.761 -15.204 1.00 0.00 C ATOM 932 O PHE A 61 -1.994 2.582 -15.170 1.00 0.00 O ATOM 933 CB PHE A 61 -1.345 4.643 -12.895 1.00 0.00 C ATOM 934 CG PHE A 61 -1.729 3.435 -12.096 1.00 0.00 C ATOM 935 CD1 PHE A 61 -2.869 2.718 -12.411 1.00 0.00 C ATOM 936 CD2 PHE A 61 -0.948 3.013 -11.033 1.00 0.00 C ATOM 937 CE1 PHE A 61 -3.225 1.602 -11.682 1.00 0.00 C ATOM 938 CE2 PHE A 61 -1.299 1.898 -10.297 1.00 0.00 C ATOM 939 CZ PHE A 61 -2.441 1.192 -10.622 1.00 0.00 C ATOM 0 H PHE A 61 -0.066 6.297 -14.108 1.00 0.00 H new ATOM 0 HA PHE A 61 0.077 3.530 -14.015 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -0.680 5.268 -12.299 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -2.238 5.233 -13.101 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -3.488 3.035 -13.237 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -0.054 3.562 -10.776 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -4.116 1.050 -11.940 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -0.682 1.579 -9.470 1.00 0.00 H new ATOM 0 HZ PHE A 61 -2.720 0.321 -10.048 1.00 0.00 H new ATOM 949 N ALA A 62 -2.088 4.606 -16.137 1.00 0.00 N ATOM 950 CA ALA A 62 -2.990 4.154 -17.177 1.00 0.00 C ATOM 951 C ALA A 62 -2.372 2.936 -17.881 1.00 0.00 C ATOM 952 O ALA A 62 -3.070 2.127 -18.492 1.00 0.00 O ATOM 953 CB ALA A 62 -3.257 5.285 -18.159 1.00 0.00 C ATOM 0 H ALA A 62 -1.831 5.592 -16.189 1.00 0.00 H new ATOM 0 HA ALA A 62 -3.945 3.859 -16.743 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -3.936 4.938 -18.938 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -3.709 6.125 -17.632 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -2.318 5.603 -18.612 1.00 0.00 H new ATOM 959 N GLU A 63 -1.045 2.814 -17.748 1.00 0.00 N ATOM 960 CA GLU A 63 -0.274 1.707 -18.312 1.00 0.00 C ATOM 961 C GLU A 63 -0.450 0.451 -17.471 1.00 0.00 C ATOM 962 O GLU A 63 -0.105 -0.651 -17.897 1.00 0.00 O ATOM 963 CB GLU A 63 1.207 2.089 -18.385 1.00 0.00 C ATOM 964 CG GLU A 63 1.949 1.429 -19.536 1.00 0.00 C ATOM 965 CD GLU A 63 3.455 1.524 -19.387 1.00 0.00 C ATOM 966 OE1 GLU A 63 3.968 2.655 -19.243 1.00 0.00 O ATOM 967 OE2 GLU A 63 4.123 0.470 -19.417 1.00 0.00 O ATOM 0 H GLU A 63 -0.474 3.490 -17.240 1.00 0.00 H new ATOM 0 HA GLU A 63 -0.640 1.502 -19.318 1.00 0.00 H new ATOM 0 HB2 GLU A 63 1.290 3.171 -18.483 1.00 0.00 H new ATOM 0 HB3 GLU A 63 1.691 1.816 -17.447 1.00 0.00 H new ATOM 0 HG2 GLU A 63 1.659 0.380 -19.597 1.00 0.00 H new ATOM 0 HG3 GLU A 63 1.650 1.898 -20.473 1.00 0.00 H new ATOM 974 N SER A 64 -0.994 0.631 -16.275 1.00 0.00 N ATOM 975 CA SER A 64 -1.235 -0.463 -15.353 1.00 0.00 C ATOM 976 C SER A 64 -2.109 -1.553 -15.971 1.00 0.00 C ATOM 977 O SER A 64 -2.442 -2.526 -15.300 1.00 0.00 O ATOM 978 CB SER A 64 -1.902 0.070 -14.093 1.00 0.00 C ATOM 979 OG SER A 64 -1.000 0.840 -13.318 1.00 0.00 O ATOM 0 H SER A 64 -1.280 1.543 -15.919 1.00 0.00 H new ATOM 0 HA SER A 64 -0.271 -0.909 -15.111 1.00 0.00 H new ATOM 0 HB2 SER A 64 -2.763 0.680 -14.365 1.00 0.00 H new ATOM 0 HB3 SER A 64 -2.277 -0.763 -13.498 1.00 0.00 H new ATOM 0 HG SER A 64 -1.484 1.268 -12.582 1.00 0.00 H new ATOM 985 N THR A 65 -2.473 -1.408 -17.247 1.00 0.00 N ATOM 986 CA THR A 65 -3.285 -2.420 -17.915 1.00 0.00 C ATOM 987 C THR A 65 -2.705 -3.796 -17.618 1.00 0.00 C ATOM 988 O THR A 65 -3.433 -4.761 -17.390 1.00 0.00 O ATOM 989 CB THR A 65 -3.323 -2.174 -19.423 1.00 0.00 C ATOM 990 OG1 THR A 65 -3.013 -0.824 -19.720 1.00 0.00 O ATOM 991 CG2 THR A 65 -4.665 -2.486 -20.047 1.00 0.00 C ATOM 0 H THR A 65 -2.221 -0.610 -17.830 1.00 0.00 H new ATOM 0 HA THR A 65 -4.307 -2.365 -17.541 1.00 0.00 H new ATOM 0 HB THR A 65 -2.579 -2.851 -19.844 1.00 0.00 H new ATOM 0 HG1 THR A 65 -3.041 -0.688 -20.690 1.00 0.00 H new ATOM 0 HG21 THR A 65 -4.623 -2.290 -21.118 1.00 0.00 H new ATOM 0 HG22 THR A 65 -4.909 -3.535 -19.880 1.00 0.00 H new ATOM 0 HG23 THR A 65 -5.432 -1.858 -19.593 1.00 0.00 H new ATOM 999 N GLU A 66 -1.376 -3.855 -17.572 1.00 0.00 N ATOM 1000 CA GLU A 66 -0.677 -5.087 -17.246 1.00 0.00 C ATOM 1001 C GLU A 66 -0.694 -5.278 -15.743 1.00 0.00 C ATOM 1002 O GLU A 66 -0.763 -6.404 -15.250 1.00 0.00 O ATOM 1003 CB GLU A 66 0.762 -5.059 -17.768 1.00 0.00 C ATOM 1004 CG GLU A 66 1.118 -6.258 -18.631 1.00 0.00 C ATOM 1005 CD GLU A 66 2.557 -6.700 -18.450 1.00 0.00 C ATOM 1006 OE1 GLU A 66 2.922 -7.091 -17.321 1.00 0.00 O ATOM 1007 OE2 GLU A 66 3.320 -6.654 -19.439 1.00 0.00 O ATOM 0 H GLU A 66 -0.764 -3.060 -17.757 1.00 0.00 H new ATOM 0 HA GLU A 66 -1.183 -5.923 -17.728 1.00 0.00 H new ATOM 0 HB2 GLU A 66 0.912 -4.148 -18.347 1.00 0.00 H new ATOM 0 HB3 GLU A 66 1.446 -5.015 -16.921 1.00 0.00 H new ATOM 0 HG2 GLU A 66 0.454 -7.087 -18.387 1.00 0.00 H new ATOM 0 HG3 GLU A 66 0.947 -6.011 -19.679 1.00 0.00 H new ATOM 1014 N ILE A 67 -0.677 -4.165 -15.014 1.00 0.00 N ATOM 1015 CA ILE A 67 -0.740 -4.232 -13.566 1.00 0.00 C ATOM 1016 C ILE A 67 -2.120 -4.724 -13.141 1.00 0.00 C ATOM 1017 O ILE A 67 -2.315 -5.155 -12.003 1.00 0.00 O ATOM 1018 CB ILE A 67 -0.442 -2.864 -12.919 1.00 0.00 C ATOM 1019 CG1 ILE A 67 0.963 -2.393 -13.302 1.00 0.00 C ATOM 1020 CG2 ILE A 67 -0.592 -2.938 -11.403 1.00 0.00 C ATOM 1021 CD1 ILE A 67 1.373 -1.094 -12.640 1.00 0.00 C ATOM 0 H ILE A 67 -0.621 -3.222 -15.399 1.00 0.00 H new ATOM 0 HA ILE A 67 0.024 -4.930 -13.223 1.00 0.00 H new ATOM 0 HB ILE A 67 -1.165 -2.139 -13.293 1.00 0.00 H new ATOM 0 HG12 ILE A 67 1.681 -3.168 -13.036 1.00 0.00 H new ATOM 0 HG13 ILE A 67 1.013 -2.270 -14.384 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -0.377 -1.962 -10.968 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -1.612 -3.231 -11.152 1.00 0.00 H new ATOM 0 HG23 ILE A 67 0.105 -3.675 -11.004 1.00 0.00 H new ATOM 0 HD11 ILE A 67 2.380 -0.825 -12.960 1.00 0.00 H new ATOM 0 HD12 ILE A 67 0.678 -0.305 -12.926 1.00 0.00 H new ATOM 0 HD13 ILE A 67 1.357 -1.217 -11.557 1.00 0.00 H new ATOM 1033 N SER A 68 -3.074 -4.687 -14.076 1.00 0.00 N ATOM 1034 CA SER A 68 -4.419 -5.160 -13.802 1.00 0.00 C ATOM 1035 C SER A 68 -4.388 -6.665 -13.580 1.00 0.00 C ATOM 1036 O SER A 68 -5.172 -7.212 -12.805 1.00 0.00 O ATOM 1037 CB SER A 68 -5.358 -4.816 -14.961 1.00 0.00 C ATOM 1038 OG SER A 68 -6.636 -4.428 -14.486 1.00 0.00 O ATOM 0 H SER A 68 -2.933 -4.335 -15.023 1.00 0.00 H new ATOM 0 HA SER A 68 -4.793 -4.668 -12.904 1.00 0.00 H new ATOM 0 HB2 SER A 68 -4.927 -4.010 -15.555 1.00 0.00 H new ATOM 0 HB3 SER A 68 -5.458 -5.678 -15.620 1.00 0.00 H new ATOM 0 HG SER A 68 -7.216 -4.212 -15.246 1.00 0.00 H new ATOM 1044 N GLU A 69 -3.453 -7.326 -14.260 1.00 0.00 N ATOM 1045 CA GLU A 69 -3.287 -8.764 -14.135 1.00 0.00 C ATOM 1046 C GLU A 69 -2.401 -9.079 -12.939 1.00 0.00 C ATOM 1047 O GLU A 69 -2.690 -9.983 -12.157 1.00 0.00 O ATOM 1048 CB GLU A 69 -2.675 -9.348 -15.410 1.00 0.00 C ATOM 1049 CG GLU A 69 -3.288 -8.798 -16.688 1.00 0.00 C ATOM 1050 CD GLU A 69 -4.733 -9.221 -16.868 1.00 0.00 C ATOM 1051 OE1 GLU A 69 -4.971 -10.410 -17.165 1.00 0.00 O ATOM 1052 OE2 GLU A 69 -5.626 -8.362 -16.712 1.00 0.00 O ATOM 0 H GLU A 69 -2.799 -6.882 -14.904 1.00 0.00 H new ATOM 0 HA GLU A 69 -4.267 -9.217 -13.985 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -1.604 -9.145 -15.414 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -2.794 -10.431 -15.397 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -3.230 -7.710 -16.676 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -2.704 -9.138 -17.543 1.00 0.00 H new ATOM 1059 N LEU A 70 -1.326 -8.311 -12.795 1.00 0.00 N ATOM 1060 CA LEU A 70 -0.400 -8.496 -11.681 1.00 0.00 C ATOM 1061 C LEU A 70 -1.093 -8.236 -10.342 1.00 0.00 C ATOM 1062 O LEU A 70 -0.572 -8.590 -9.285 1.00 0.00 O ATOM 1063 CB LEU A 70 0.801 -7.561 -11.828 1.00 0.00 C ATOM 1064 CG LEU A 70 1.945 -8.107 -12.682 1.00 0.00 C ATOM 1065 CD1 LEU A 70 1.552 -8.121 -14.152 1.00 0.00 C ATOM 1066 CD2 LEU A 70 3.207 -7.283 -12.469 1.00 0.00 C ATOM 0 H LEU A 70 -1.074 -7.556 -13.433 1.00 0.00 H new ATOM 0 HA LEU A 70 -0.056 -9.530 -11.699 1.00 0.00 H new ATOM 0 HB2 LEU A 70 0.460 -6.622 -12.263 1.00 0.00 H new ATOM 0 HB3 LEU A 70 1.187 -7.331 -10.835 1.00 0.00 H new ATOM 0 HG LEU A 70 2.150 -9.132 -12.374 1.00 0.00 H new ATOM 0 HD11 LEU A 70 2.378 -8.513 -14.746 1.00 0.00 H new ATOM 0 HD12 LEU A 70 0.675 -8.754 -14.288 1.00 0.00 H new ATOM 0 HD13 LEU A 70 1.321 -7.106 -14.477 1.00 0.00 H new ATOM 0 HD21 LEU A 70 4.012 -7.685 -13.084 1.00 0.00 H new ATOM 0 HD22 LEU A 70 3.017 -6.247 -12.751 1.00 0.00 H new ATOM 0 HD23 LEU A 70 3.497 -7.326 -11.419 1.00 0.00 H new ATOM 1078 N SER A 71 -2.265 -7.610 -10.395 1.00 0.00 N ATOM 1079 CA SER A 71 -3.030 -7.292 -9.193 1.00 0.00 C ATOM 1080 C SER A 71 -3.598 -8.537 -8.526 1.00 0.00 C ATOM 1081 O SER A 71 -3.741 -8.580 -7.309 1.00 0.00 O ATOM 1082 CB SER A 71 -4.179 -6.362 -9.544 1.00 0.00 C ATOM 1083 OG SER A 71 -4.513 -5.521 -8.454 1.00 0.00 O ATOM 0 H SER A 71 -2.708 -7.311 -11.264 1.00 0.00 H new ATOM 0 HA SER A 71 -2.344 -6.812 -8.495 1.00 0.00 H new ATOM 0 HB2 SER A 71 -3.906 -5.753 -10.406 1.00 0.00 H new ATOM 0 HB3 SER A 71 -5.050 -6.950 -9.833 1.00 0.00 H new ATOM 0 HG SER A 71 -4.443 -6.027 -7.617 1.00 0.00 H new ATOM 1089 N HIS A 72 -3.932 -9.547 -9.322 1.00 0.00 N ATOM 1090 CA HIS A 72 -4.494 -10.781 -8.780 1.00 0.00 C ATOM 1091 C HIS A 72 -3.510 -11.442 -7.825 1.00 0.00 C ATOM 1092 O HIS A 72 -3.866 -12.345 -7.069 1.00 0.00 O ATOM 1093 CB HIS A 72 -4.884 -11.747 -9.907 1.00 0.00 C ATOM 1094 CG HIS A 72 -3.723 -12.332 -10.653 1.00 0.00 C ATOM 1095 ND1 HIS A 72 -3.646 -12.343 -12.031 1.00 0.00 N ATOM 1096 CD2 HIS A 72 -2.593 -12.940 -10.214 1.00 0.00 C ATOM 1097 CE1 HIS A 72 -2.524 -12.932 -12.405 1.00 0.00 C ATOM 1098 NE2 HIS A 72 -1.868 -13.303 -11.322 1.00 0.00 N ATOM 0 H HIS A 72 -3.825 -9.538 -10.336 1.00 0.00 H new ATOM 0 HA HIS A 72 -5.397 -10.527 -8.225 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -5.475 -12.560 -9.484 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -5.526 -11.221 -10.614 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -2.315 -13.108 -9.184 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -2.199 -13.084 -13.424 1.00 0.00 H new ATOM 0 HE2 HIS A 72 -0.968 -13.782 -11.310 1.00 0.00 H new ATOM 1107 N ASN A 73 -2.267 -10.983 -7.875 1.00 0.00 N ATOM 1108 CA ASN A 73 -1.213 -11.516 -7.033 1.00 0.00 C ATOM 1109 C ASN A 73 -1.257 -10.921 -5.623 1.00 0.00 C ATOM 1110 O ASN A 73 -0.494 -11.331 -4.749 1.00 0.00 O ATOM 1111 CB ASN A 73 0.134 -11.220 -7.678 1.00 0.00 C ATOM 1112 CG ASN A 73 0.337 -11.989 -8.969 1.00 0.00 C ATOM 1113 OD1 ASN A 73 -0.175 -11.443 -10.065 1.00 0.00 O flip ATOM 1114 ND2 ASN A 73 0.944 -13.059 -8.979 1.00 0.00 N flip ATOM 0 H ASN A 73 -1.965 -10.234 -8.498 1.00 0.00 H new ATOM 0 HA ASN A 73 -1.359 -12.592 -6.939 1.00 0.00 H new ATOM 0 HB2 ASN A 73 0.211 -10.151 -7.879 1.00 0.00 H new ATOM 0 HB3 ASN A 73 0.932 -11.471 -6.979 1.00 0.00 H new ATOM 0 HD21 ASN A 73 1.320 -13.440 -8.111 1.00 0.00 H new ATOM 0 HD22 ASN A 73 1.071 -13.565 -9.855 1.00 0.00 H new ATOM 1121 N PHE A 74 -2.148 -9.954 -5.409 1.00 0.00 N ATOM 1122 CA PHE A 74 -2.279 -9.305 -4.111 1.00 0.00 C ATOM 1123 C PHE A 74 -3.396 -8.255 -4.135 1.00 0.00 C ATOM 1124 O PHE A 74 -4.191 -8.216 -5.072 1.00 0.00 O ATOM 1125 CB PHE A 74 -0.941 -8.680 -3.691 1.00 0.00 C ATOM 1126 CG PHE A 74 -0.414 -7.604 -4.610 1.00 0.00 C ATOM 1127 CD1 PHE A 74 -0.747 -7.571 -5.960 1.00 0.00 C ATOM 1128 CD2 PHE A 74 0.430 -6.620 -4.115 1.00 0.00 C ATOM 1129 CE1 PHE A 74 -0.252 -6.583 -6.788 1.00 0.00 C ATOM 1130 CE2 PHE A 74 0.926 -5.628 -4.941 1.00 0.00 C ATOM 1131 CZ PHE A 74 0.584 -5.612 -6.279 1.00 0.00 C ATOM 0 H PHE A 74 -2.790 -9.604 -6.121 1.00 0.00 H new ATOM 0 HA PHE A 74 -2.551 -10.059 -3.373 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -1.054 -8.258 -2.692 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -0.195 -9.472 -3.621 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -1.401 -8.328 -6.366 1.00 0.00 H new ATOM 0 HD2 PHE A 74 0.703 -6.629 -3.070 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -0.520 -6.571 -7.834 1.00 0.00 H new ATOM 0 HE2 PHE A 74 1.580 -4.867 -4.541 1.00 0.00 H new ATOM 0 HZ PHE A 74 0.971 -4.839 -6.926 1.00 0.00 H new ATOM 1141 N VAL A 75 -3.470 -7.409 -3.105 1.00 0.00 N ATOM 1142 CA VAL A 75 -4.514 -6.380 -3.052 1.00 0.00 C ATOM 1143 C VAL A 75 -4.097 -5.195 -2.180 1.00 0.00 C ATOM 1144 O VAL A 75 -3.617 -5.380 -1.064 1.00 0.00 O ATOM 1145 CB VAL A 75 -5.838 -6.960 -2.512 1.00 0.00 C ATOM 1146 CG1 VAL A 75 -5.663 -7.467 -1.088 1.00 0.00 C ATOM 1147 CG2 VAL A 75 -6.950 -5.921 -2.587 1.00 0.00 C ATOM 0 H VAL A 75 -2.832 -7.413 -2.309 1.00 0.00 H new ATOM 0 HA VAL A 75 -4.660 -6.030 -4.074 1.00 0.00 H new ATOM 0 HB VAL A 75 -6.122 -7.806 -3.138 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -6.609 -7.872 -0.727 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -4.904 -8.249 -1.071 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -5.351 -6.644 -0.445 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -7.875 -6.350 -2.202 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -6.676 -5.051 -1.989 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -7.095 -5.618 -3.624 1.00 0.00 H new ATOM 1157 N MET A 76 -4.275 -3.969 -2.685 1.00 0.00 N ATOM 1158 CA MET A 76 -3.902 -2.790 -1.922 1.00 0.00 C ATOM 1159 C MET A 76 -5.120 -1.938 -1.580 1.00 0.00 C ATOM 1160 O MET A 76 -6.272 -2.369 -1.738 1.00 0.00 O ATOM 1161 CB MET A 76 -2.855 -1.934 -2.644 1.00 0.00 C ATOM 1162 CG MET A 76 -2.152 -2.595 -3.830 1.00 0.00 C ATOM 1163 SD MET A 76 -1.539 -4.253 -3.498 1.00 0.00 S ATOM 1164 CE MET A 76 -2.315 -5.134 -4.850 1.00 0.00 C ATOM 0 H MET A 76 -4.670 -3.776 -3.606 1.00 0.00 H new ATOM 0 HA MET A 76 -3.456 -3.156 -0.997 1.00 0.00 H new ATOM 0 HB2 MET A 76 -3.339 -1.023 -2.996 1.00 0.00 H new ATOM 0 HB3 MET A 76 -2.098 -1.633 -1.920 1.00 0.00 H new ATOM 0 HG2 MET A 76 -2.845 -2.638 -4.670 1.00 0.00 H new ATOM 0 HG3 MET A 76 -1.317 -1.966 -4.138 1.00 0.00 H new ATOM 0 HE1 MET A 76 -2.254 -6.207 -4.668 1.00 0.00 H new ATOM 0 HE2 MET A 76 -3.361 -4.838 -4.924 1.00 0.00 H new ATOM 0 HE3 MET A 76 -1.803 -4.894 -5.782 1.00 0.00 H new ATOM 1174 N VAL A 77 -4.852 -0.734 -1.077 1.00 0.00 N ATOM 1175 CA VAL A 77 -5.910 0.174 -0.667 1.00 0.00 C ATOM 1176 C VAL A 77 -5.551 1.639 -0.939 1.00 0.00 C ATOM 1177 O VAL A 77 -4.439 2.081 -0.654 1.00 0.00 O ATOM 1178 CB VAL A 77 -6.202 -0.045 0.829 1.00 0.00 C ATOM 1179 CG1 VAL A 77 -6.633 1.231 1.541 1.00 0.00 C ATOM 1180 CG2 VAL A 77 -7.241 -1.137 0.979 1.00 0.00 C ATOM 0 H VAL A 77 -3.909 -0.369 -0.945 1.00 0.00 H new ATOM 0 HA VAL A 77 -6.800 -0.044 -1.257 1.00 0.00 H new ATOM 0 HB VAL A 77 -5.274 -0.353 1.311 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -6.825 1.014 2.592 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -5.842 1.976 1.463 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -7.542 1.617 1.078 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -7.451 -1.296 2.037 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -8.157 -0.841 0.467 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -6.863 -2.061 0.541 1.00 0.00 H new ATOM 1190 N ASN A 78 -6.512 2.383 -1.487 1.00 0.00 N ATOM 1191 CA ASN A 78 -6.310 3.793 -1.793 1.00 0.00 C ATOM 1192 C ASN A 78 -6.990 4.689 -0.767 1.00 0.00 C ATOM 1193 O ASN A 78 -8.212 4.688 -0.635 1.00 0.00 O ATOM 1194 CB ASN A 78 -6.855 4.132 -3.178 1.00 0.00 C ATOM 1195 CG ASN A 78 -6.558 5.562 -3.587 1.00 0.00 C ATOM 1196 OD1 ASN A 78 -7.402 6.239 -4.172 1.00 0.00 O ATOM 1197 ND2 ASN A 78 -5.356 6.029 -3.277 1.00 0.00 N ATOM 0 H ASN A 78 -7.438 2.029 -1.727 1.00 0.00 H new ATOM 0 HA ASN A 78 -5.235 3.972 -1.766 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -6.423 3.451 -3.911 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -7.933 3.971 -3.190 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -5.101 6.985 -3.524 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -4.687 5.432 -2.791 1.00 0.00 H new ATOM 1204 N LEU A 79 -6.185 5.466 -0.063 1.00 0.00 N ATOM 1205 CA LEU A 79 -6.698 6.393 0.938 1.00 0.00 C ATOM 1206 C LEU A 79 -6.413 7.838 0.510 1.00 0.00 C ATOM 1207 O LEU A 79 -5.387 8.123 -0.116 1.00 0.00 O ATOM 1208 CB LEU A 79 -6.074 6.076 2.303 1.00 0.00 C ATOM 1209 CG LEU A 79 -6.078 7.219 3.321 1.00 0.00 C ATOM 1210 CD1 LEU A 79 -7.499 7.696 3.581 1.00 0.00 C ATOM 1211 CD2 LEU A 79 -5.417 6.778 4.618 1.00 0.00 C ATOM 0 H LEU A 79 -5.170 5.475 -0.165 1.00 0.00 H new ATOM 0 HA LEU A 79 -7.779 6.279 1.025 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -6.605 5.228 2.736 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -5.043 5.759 2.145 1.00 0.00 H new ATOM 0 HG LEU A 79 -5.507 8.051 2.909 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -7.483 8.509 4.307 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -7.940 8.050 2.649 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -8.094 6.871 3.973 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -5.428 7.603 5.331 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -5.962 5.931 5.034 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -4.386 6.484 4.419 1.00 0.00 H new ATOM 1223 N GLU A 80 -7.333 8.746 0.830 1.00 0.00 N ATOM 1224 CA GLU A 80 -7.176 10.149 0.459 1.00 0.00 C ATOM 1225 C GLU A 80 -7.731 11.080 1.535 1.00 0.00 C ATOM 1226 O GLU A 80 -8.137 10.635 2.609 1.00 0.00 O ATOM 1227 CB GLU A 80 -7.876 10.423 -0.874 1.00 0.00 C ATOM 1228 CG GLU A 80 -7.141 11.420 -1.754 1.00 0.00 C ATOM 1229 CD GLU A 80 -8.029 12.562 -2.206 1.00 0.00 C ATOM 1230 OE1 GLU A 80 -8.898 12.333 -3.073 1.00 0.00 O ATOM 1231 OE2 GLU A 80 -7.855 13.689 -1.694 1.00 0.00 O ATOM 0 H GLU A 80 -8.190 8.536 1.342 1.00 0.00 H new ATOM 0 HA GLU A 80 -6.109 10.347 0.358 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -7.986 9.484 -1.417 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -8.881 10.797 -0.677 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -6.288 11.822 -1.207 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -6.745 10.904 -2.629 1.00 0.00 H new ATOM 1238 N ASP A 81 -7.743 12.376 1.237 1.00 0.00 N ATOM 1239 CA ASP A 81 -8.243 13.380 2.174 1.00 0.00 C ATOM 1240 C ASP A 81 -9.606 12.987 2.738 1.00 0.00 C ATOM 1241 O ASP A 81 -9.958 13.367 3.855 1.00 0.00 O ATOM 1242 CB ASP A 81 -8.336 14.744 1.488 1.00 0.00 C ATOM 1243 CG ASP A 81 -8.255 15.893 2.474 1.00 0.00 C ATOM 1244 OD1 ASP A 81 -9.187 16.040 3.293 1.00 0.00 O ATOM 1245 OD2 ASP A 81 -7.259 16.646 2.427 1.00 0.00 O ATOM 0 H ASP A 81 -7.411 12.758 0.351 1.00 0.00 H new ATOM 0 HA ASP A 81 -7.539 13.441 3.004 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -7.531 14.837 0.759 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -9.274 14.807 0.937 1.00 0.00 H new ATOM 1250 N GLU A 82 -10.371 12.225 1.960 1.00 0.00 N ATOM 1251 CA GLU A 82 -11.696 11.782 2.389 1.00 0.00 C ATOM 1252 C GLU A 82 -11.633 11.129 3.767 1.00 0.00 C ATOM 1253 O GLU A 82 -12.610 11.141 4.517 1.00 0.00 O ATOM 1254 CB GLU A 82 -12.283 10.800 1.373 1.00 0.00 C ATOM 1255 CG GLU A 82 -12.790 11.467 0.104 1.00 0.00 C ATOM 1256 CD GLU A 82 -14.246 11.880 0.205 1.00 0.00 C ATOM 1257 OE1 GLU A 82 -14.607 12.549 1.197 1.00 0.00 O ATOM 1258 OE2 GLU A 82 -15.024 11.536 -0.709 1.00 0.00 O ATOM 0 H GLU A 82 -10.098 11.902 1.032 1.00 0.00 H new ATOM 0 HA GLU A 82 -12.341 12.658 2.451 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -11.522 10.066 1.108 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -13.103 10.255 1.840 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -12.181 12.345 -0.109 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -12.667 10.783 -0.736 1.00 0.00 H new ATOM 1265 N GLU A 83 -10.474 10.566 4.097 1.00 0.00 N ATOM 1266 CA GLU A 83 -10.278 9.914 5.386 1.00 0.00 C ATOM 1267 C GLU A 83 -8.899 10.247 5.947 1.00 0.00 C ATOM 1268 O GLU A 83 -7.880 9.980 5.311 1.00 0.00 O ATOM 1269 CB GLU A 83 -10.439 8.398 5.246 1.00 0.00 C ATOM 1270 CG GLU A 83 -11.547 7.821 6.111 1.00 0.00 C ATOM 1271 CD GLU A 83 -11.270 6.391 6.531 1.00 0.00 C ATOM 1272 OE1 GLU A 83 -11.100 5.533 5.639 1.00 0.00 O ATOM 1273 OE2 GLU A 83 -11.225 6.129 7.751 1.00 0.00 O ATOM 0 H GLU A 83 -9.656 10.549 3.488 1.00 0.00 H new ATOM 0 HA GLU A 83 -11.034 10.284 6.078 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -10.642 8.158 4.202 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -9.497 7.915 5.507 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -11.670 8.440 7.000 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -12.489 7.860 5.563 1.00 0.00 H new ATOM 1280 N GLU A 84 -8.873 10.834 7.137 1.00 0.00 N ATOM 1281 CA GLU A 84 -7.614 11.204 7.775 1.00 0.00 C ATOM 1282 C GLU A 84 -7.557 10.704 9.217 1.00 0.00 C ATOM 1283 O GLU A 84 -7.604 11.495 10.160 1.00 0.00 O ATOM 1284 CB GLU A 84 -7.431 12.723 7.740 1.00 0.00 C ATOM 1285 CG GLU A 84 -6.045 13.180 8.166 1.00 0.00 C ATOM 1286 CD GLU A 84 -6.048 14.572 8.764 1.00 0.00 C ATOM 1287 OE1 GLU A 84 -6.981 14.887 9.533 1.00 0.00 O ATOM 1288 OE2 GLU A 84 -5.117 15.349 8.465 1.00 0.00 O ATOM 0 H GLU A 84 -9.706 11.064 7.679 1.00 0.00 H new ATOM 0 HA GLU A 84 -6.804 10.732 7.220 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -7.628 13.081 6.729 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -8.173 13.185 8.392 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -5.643 12.476 8.895 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -5.379 13.161 7.303 1.00 0.00 H new ATOM 1295 N PRO A 85 -7.453 9.376 9.410 1.00 0.00 N ATOM 1296 CA PRO A 85 -7.387 8.776 10.746 1.00 0.00 C ATOM 1297 C PRO A 85 -6.202 9.295 11.557 1.00 0.00 C ATOM 1298 O PRO A 85 -6.174 9.167 12.782 1.00 0.00 O ATOM 1299 CB PRO A 85 -7.227 7.277 10.467 1.00 0.00 C ATOM 1300 CG PRO A 85 -7.726 7.090 9.075 1.00 0.00 C ATOM 1301 CD PRO A 85 -7.391 8.359 8.347 1.00 0.00 C ATOM 0 HA PRO A 85 -8.269 9.017 11.339 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -6.186 6.967 10.558 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -7.801 6.680 11.176 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -7.251 6.231 8.602 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -8.800 6.906 9.066 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -6.403 8.313 7.889 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -8.103 8.566 7.548 1.00 0.00 H new ATOM 1309 N LYS A 86 -5.225 9.879 10.867 1.00 0.00 N ATOM 1310 CA LYS A 86 -4.038 10.417 11.522 1.00 0.00 C ATOM 1311 C LYS A 86 -3.256 9.311 12.226 1.00 0.00 C ATOM 1312 O LYS A 86 -3.640 8.852 13.300 1.00 0.00 O ATOM 1313 CB LYS A 86 -4.426 11.503 12.528 1.00 0.00 C ATOM 1314 CG LYS A 86 -4.879 12.800 11.874 1.00 0.00 C ATOM 1315 CD LYS A 86 -6.053 13.420 12.617 1.00 0.00 C ATOM 1316 CE LYS A 86 -5.605 14.570 13.506 1.00 0.00 C ATOM 1317 NZ LYS A 86 -6.700 15.043 14.397 1.00 0.00 N ATOM 0 H LYS A 86 -5.233 9.991 9.853 1.00 0.00 H new ATOM 0 HA LYS A 86 -3.401 10.857 10.754 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -5.226 11.128 13.166 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -3.573 11.710 13.175 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -4.049 13.506 11.850 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -5.163 12.607 10.840 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -6.790 13.779 11.899 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -6.544 12.659 13.224 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -4.757 14.251 14.112 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -5.260 15.396 12.884 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -6.354 15.827 14.986 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -7.500 15.371 13.819 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -7.012 14.262 15.009 1.00 0.00 H new ATOM 1331 N ASP A 87 -2.155 8.889 11.609 1.00 0.00 N ATOM 1332 CA ASP A 87 -1.317 7.839 12.175 1.00 0.00 C ATOM 1333 C ASP A 87 -0.087 7.596 11.305 1.00 0.00 C ATOM 1334 O ASP A 87 -0.040 8.013 10.147 1.00 0.00 O ATOM 1335 CB ASP A 87 -2.116 6.543 12.321 1.00 0.00 C ATOM 1336 CG ASP A 87 -1.521 5.615 13.362 1.00 0.00 C ATOM 1337 OD1 ASP A 87 -1.494 5.995 14.552 1.00 0.00 O ATOM 1338 OD2 ASP A 87 -1.083 4.507 12.988 1.00 0.00 O ATOM 0 H ASP A 87 -1.824 9.259 10.718 1.00 0.00 H new ATOM 0 HA ASP A 87 -0.984 8.166 13.160 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -3.144 6.781 12.595 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -2.153 6.031 11.359 1.00 0.00 H new ATOM 1343 N GLU A 88 0.906 6.917 11.871 1.00 0.00 N ATOM 1344 CA GLU A 88 2.138 6.615 11.147 1.00 0.00 C ATOM 1345 C GLU A 88 1.880 5.642 9.997 1.00 0.00 C ATOM 1346 O GLU A 88 2.721 5.479 9.112 1.00 0.00 O ATOM 1347 CB GLU A 88 3.182 6.029 12.099 1.00 0.00 C ATOM 1348 CG GLU A 88 3.884 7.076 12.949 1.00 0.00 C ATOM 1349 CD GLU A 88 4.747 8.010 12.124 1.00 0.00 C ATOM 1350 OE1 GLU A 88 4.216 9.025 11.626 1.00 0.00 O ATOM 1351 OE2 GLU A 88 5.955 7.727 11.977 1.00 0.00 O ATOM 0 H GLU A 88 0.883 6.565 12.828 1.00 0.00 H new ATOM 0 HA GLU A 88 2.516 7.547 10.728 1.00 0.00 H new ATOM 0 HB2 GLU A 88 2.698 5.305 12.755 1.00 0.00 H new ATOM 0 HB3 GLU A 88 3.927 5.485 11.518 1.00 0.00 H new ATOM 0 HG2 GLU A 88 3.139 7.659 13.491 1.00 0.00 H new ATOM 0 HG3 GLU A 88 4.503 6.578 13.695 1.00 0.00 H new ATOM 1358 N ASP A 89 0.717 4.996 10.015 1.00 0.00 N ATOM 1359 CA ASP A 89 0.353 4.040 8.973 1.00 0.00 C ATOM 1360 C ASP A 89 0.335 4.704 7.594 1.00 0.00 C ATOM 1361 O ASP A 89 0.370 4.021 6.571 1.00 0.00 O ATOM 1362 CB ASP A 89 -1.016 3.422 9.281 1.00 0.00 C ATOM 1363 CG ASP A 89 -1.335 2.233 8.392 1.00 0.00 C ATOM 1364 OD1 ASP A 89 -1.858 2.452 7.279 1.00 0.00 O ATOM 1365 OD2 ASP A 89 -1.063 1.083 8.807 1.00 0.00 O ATOM 0 H ASP A 89 0.010 5.117 10.740 1.00 0.00 H new ATOM 0 HA ASP A 89 1.106 3.252 8.957 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -1.042 3.108 10.324 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -1.789 4.181 9.157 1.00 0.00 H new ATOM 1370 N PHE A 90 0.278 6.034 7.565 1.00 0.00 N ATOM 1371 CA PHE A 90 0.254 6.772 6.302 1.00 0.00 C ATOM 1372 C PHE A 90 1.638 7.319 5.948 1.00 0.00 C ATOM 1373 O PHE A 90 1.909 7.644 4.789 1.00 0.00 O ATOM 1374 CB PHE A 90 -0.756 7.916 6.378 1.00 0.00 C ATOM 1375 CG PHE A 90 -2.032 7.538 7.075 1.00 0.00 C ATOM 1376 CD1 PHE A 90 -2.850 6.549 6.555 1.00 0.00 C ATOM 1377 CD2 PHE A 90 -2.408 8.167 8.250 1.00 0.00 C ATOM 1378 CE1 PHE A 90 -4.021 6.193 7.194 1.00 0.00 C ATOM 1379 CE2 PHE A 90 -3.580 7.816 8.894 1.00 0.00 C ATOM 1380 CZ PHE A 90 -4.387 6.827 8.366 1.00 0.00 C ATOM 0 H PHE A 90 0.248 6.622 8.398 1.00 0.00 H new ATOM 0 HA PHE A 90 -0.046 6.078 5.516 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -0.301 8.758 6.899 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -0.988 8.254 5.368 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -2.569 6.050 5.639 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -1.779 8.940 8.668 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -4.650 5.420 6.778 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -3.864 8.315 9.809 1.00 0.00 H new ATOM 0 HZ PHE A 90 -5.302 6.550 8.868 1.00 0.00 H new ATOM 1390 N SER A 91 2.507 7.420 6.951 1.00 0.00 N ATOM 1391 CA SER A 91 3.859 7.927 6.746 1.00 0.00 C ATOM 1392 C SER A 91 4.756 7.561 7.929 1.00 0.00 C ATOM 1393 O SER A 91 5.155 8.425 8.709 1.00 0.00 O ATOM 1394 CB SER A 91 3.836 9.445 6.554 1.00 0.00 C ATOM 1395 OG SER A 91 2.563 9.885 6.112 1.00 0.00 O ATOM 0 H SER A 91 2.298 7.157 7.914 1.00 0.00 H new ATOM 0 HA SER A 91 4.265 7.465 5.846 1.00 0.00 H new ATOM 0 HB2 SER A 91 4.088 9.937 7.493 1.00 0.00 H new ATOM 0 HB3 SER A 91 4.596 9.734 5.828 1.00 0.00 H new ATOM 0 HG SER A 91 2.575 10.858 5.998 1.00 0.00 H new ATOM 1401 N PRO A 92 5.085 6.267 8.076 1.00 0.00 N ATOM 1402 CA PRO A 92 5.936 5.786 9.171 1.00 0.00 C ATOM 1403 C PRO A 92 7.296 6.477 9.199 1.00 0.00 C ATOM 1404 O PRO A 92 7.617 7.194 10.147 1.00 0.00 O ATOM 1405 CB PRO A 92 6.103 4.291 8.875 1.00 0.00 C ATOM 1406 CG PRO A 92 4.946 3.941 8.003 1.00 0.00 C ATOM 1407 CD PRO A 92 4.650 5.170 7.194 1.00 0.00 C ATOM 0 HA PRO A 92 5.491 5.992 10.145 1.00 0.00 H new ATOM 0 HB2 PRO A 92 7.050 4.091 8.374 1.00 0.00 H new ATOM 0 HB3 PRO A 92 6.098 3.703 9.793 1.00 0.00 H new ATOM 0 HG2 PRO A 92 5.186 3.097 7.356 1.00 0.00 H new ATOM 0 HG3 PRO A 92 4.082 3.649 8.600 1.00 0.00 H new ATOM 0 HD2 PRO A 92 5.195 5.172 6.250 1.00 0.00 H new ATOM 0 HD3 PRO A 92 3.590 5.246 6.950 1.00 0.00 H new ATOM 1415 N ASP A 93 8.093 6.255 8.159 1.00 0.00 N ATOM 1416 CA ASP A 93 9.420 6.857 8.070 1.00 0.00 C ATOM 1417 C ASP A 93 9.443 7.968 7.023 1.00 0.00 C ATOM 1418 O ASP A 93 10.171 7.889 6.032 1.00 0.00 O ATOM 1419 CB ASP A 93 10.466 5.789 7.739 1.00 0.00 C ATOM 1420 CG ASP A 93 11.665 5.850 8.665 1.00 0.00 C ATOM 1421 OD1 ASP A 93 11.494 5.601 9.877 1.00 0.00 O ATOM 1422 OD2 ASP A 93 12.777 6.146 8.178 1.00 0.00 O ATOM 0 H ASP A 93 7.844 5.663 7.366 1.00 0.00 H new ATOM 0 HA ASP A 93 9.662 7.297 9.037 1.00 0.00 H new ATOM 0 HB2 ASP A 93 10.008 4.802 7.806 1.00 0.00 H new ATOM 0 HB3 ASP A 93 10.799 5.917 6.709 1.00 0.00 H new ATOM 1427 N GLY A 94 8.642 9.002 7.250 1.00 0.00 N ATOM 1428 CA GLY A 94 8.586 10.113 6.319 1.00 0.00 C ATOM 1429 C GLY A 94 7.681 11.228 6.804 1.00 0.00 C ATOM 1430 O GLY A 94 6.608 10.973 7.346 1.00 0.00 O ATOM 0 H GLY A 94 8.031 9.091 8.062 1.00 0.00 H new ATOM 0 HA2 GLY A 94 9.591 10.506 6.165 1.00 0.00 H new ATOM 0 HA3 GLY A 94 8.232 9.756 5.352 1.00 0.00 H new ATOM 1434 N GLY A 95 8.118 12.467 6.606 1.00 0.00 N ATOM 1435 CA GLY A 95 7.328 13.606 7.032 1.00 0.00 C ATOM 1436 C GLY A 95 6.232 13.954 6.043 1.00 0.00 C ATOM 1437 O GLY A 95 5.237 14.581 6.407 1.00 0.00 O ATOM 0 H GLY A 95 9.004 12.702 6.159 1.00 0.00 H new ATOM 0 HA2 GLY A 95 6.882 13.392 8.003 1.00 0.00 H new ATOM 0 HA3 GLY A 95 7.981 14.468 7.164 1.00 0.00 H new ATOM 1441 N TYR A 96 6.416 13.549 4.788 1.00 0.00 N ATOM 1442 CA TYR A 96 5.431 13.828 3.743 1.00 0.00 C ATOM 1443 C TYR A 96 4.029 13.432 4.188 1.00 0.00 C ATOM 1444 O TYR A 96 3.846 12.865 5.264 1.00 0.00 O ATOM 1445 CB TYR A 96 5.780 13.102 2.439 1.00 0.00 C ATOM 1446 CG TYR A 96 6.430 11.746 2.633 1.00 0.00 C ATOM 1447 CD1 TYR A 96 7.807 11.636 2.795 1.00 0.00 C ATOM 1448 CD2 TYR A 96 5.674 10.580 2.653 1.00 0.00 C ATOM 1449 CE1 TYR A 96 8.408 10.408 2.974 1.00 0.00 C ATOM 1450 CE2 TYR A 96 6.269 9.344 2.828 1.00 0.00 C ATOM 1451 CZ TYR A 96 7.639 9.266 2.989 1.00 0.00 C ATOM 1452 OH TYR A 96 8.239 8.045 3.176 1.00 0.00 O ATOM 0 H TYR A 96 7.234 13.029 4.470 1.00 0.00 H new ATOM 0 HA TYR A 96 5.454 14.903 3.562 1.00 0.00 H new ATOM 0 HB2 TYR A 96 4.870 12.975 1.853 1.00 0.00 H new ATOM 0 HB3 TYR A 96 6.450 13.732 1.854 1.00 0.00 H new ATOM 0 HD1 TYR A 96 8.416 12.528 2.780 1.00 0.00 H new ATOM 0 HD2 TYR A 96 4.603 10.640 2.530 1.00 0.00 H new ATOM 0 HE1 TYR A 96 9.478 10.342 3.102 1.00 0.00 H new ATOM 0 HE2 TYR A 96 5.668 8.447 2.839 1.00 0.00 H new ATOM 0 HH TYR A 96 9.103 8.031 2.714 1.00 0.00 H new ATOM 1462 N ILE A 97 3.044 13.744 3.350 1.00 0.00 N ATOM 1463 CA ILE A 97 1.651 13.436 3.654 1.00 0.00 C ATOM 1464 C ILE A 97 0.804 13.355 2.347 1.00 0.00 C ATOM 1465 O ILE A 97 0.266 14.423 2.067 1.00 0.00 O ATOM 1466 CB ILE A 97 1.059 14.486 4.630 1.00 0.00 C ATOM 1467 CG1 ILE A 97 1.003 15.893 4.014 1.00 0.00 C ATOM 1468 CG2 ILE A 97 1.864 14.515 5.917 1.00 0.00 C ATOM 1469 CD1 ILE A 97 2.124 16.229 3.046 1.00 0.00 C ATOM 0 H ILE A 97 3.186 14.211 2.454 1.00 0.00 H new ATOM 0 HA ILE A 97 1.616 12.461 4.140 1.00 0.00 H new ATOM 0 HB ILE A 97 0.034 14.184 4.844 1.00 0.00 H new ATOM 0 HG12 ILE A 97 0.052 16.005 3.494 1.00 0.00 H new ATOM 0 HG13 ILE A 97 1.013 16.625 4.822 1.00 0.00 H new ATOM 0 HG21 ILE A 97 1.440 15.256 6.595 1.00 0.00 H new ATOM 0 HG22 ILE A 97 1.833 13.532 6.388 1.00 0.00 H new ATOM 0 HG23 ILE A 97 2.898 14.778 5.694 1.00 0.00 H new ATOM 0 HD11 ILE A 97 1.989 17.243 2.671 1.00 0.00 H new ATOM 0 HD12 ILE A 97 3.082 16.157 3.560 1.00 0.00 H new ATOM 0 HD13 ILE A 97 2.107 15.528 2.212 1.00 0.00 H new ATOM 1481 N PRO A 98 -0.001 12.261 2.291 1.00 0.00 N ATOM 1482 CA PRO A 98 0.227 10.801 2.527 1.00 0.00 C ATOM 1483 C PRO A 98 0.899 10.151 1.326 1.00 0.00 C ATOM 1484 O PRO A 98 0.772 10.645 0.201 1.00 0.00 O ATOM 1485 CB PRO A 98 -1.164 10.239 2.727 1.00 0.00 C ATOM 1486 CG PRO A 98 -1.631 11.205 3.683 1.00 0.00 C ATOM 1487 CD PRO A 98 -0.431 12.100 3.753 1.00 0.00 C ATOM 0 HA PRO A 98 0.884 10.616 3.377 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -1.754 10.227 1.811 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -1.160 9.221 3.117 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -2.524 11.730 3.343 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -1.873 10.755 4.646 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -0.676 13.061 4.205 1.00 0.00 H new ATOM 0 HD3 PRO A 98 0.362 11.657 4.356 1.00 0.00 H new ATOM 1495 N ARG A 99 1.632 9.066 1.579 1.00 0.00 N ATOM 1496 CA ARG A 99 2.367 8.358 0.535 1.00 0.00 C ATOM 1497 C ARG A 99 1.952 6.888 0.437 1.00 0.00 C ATOM 1498 O ARG A 99 0.958 6.467 1.025 1.00 0.00 O ATOM 1499 CB ARG A 99 3.867 8.465 0.817 1.00 0.00 C ATOM 1500 CG ARG A 99 4.590 9.487 -0.048 1.00 0.00 C ATOM 1501 CD ARG A 99 3.915 10.853 -0.013 1.00 0.00 C ATOM 1502 NE ARG A 99 4.245 11.659 -1.186 1.00 0.00 N ATOM 1503 CZ ARG A 99 3.902 12.938 -1.328 1.00 0.00 C ATOM 1504 NH1 ARG A 99 3.214 13.557 -0.377 1.00 0.00 N ATOM 1505 NH2 ARG A 99 4.250 13.600 -2.422 1.00 0.00 N ATOM 0 H ARG A 99 1.732 8.657 2.508 1.00 0.00 H new ATOM 0 HA ARG A 99 2.131 8.823 -0.422 1.00 0.00 H new ATOM 0 HB2 ARG A 99 4.011 8.725 1.866 1.00 0.00 H new ATOM 0 HB3 ARG A 99 4.325 7.488 0.665 1.00 0.00 H new ATOM 0 HG2 ARG A 99 5.621 9.584 0.293 1.00 0.00 H new ATOM 0 HG3 ARG A 99 4.627 9.128 -1.077 1.00 0.00 H new ATOM 0 HD2 ARG A 99 2.834 10.722 0.044 1.00 0.00 H new ATOM 0 HD3 ARG A 99 4.219 11.384 0.889 1.00 0.00 H new ATOM 0 HE ARG A 99 4.769 11.216 -1.941 1.00 0.00 H new ATOM 0 HH11 ARG A 99 2.945 13.053 0.468 1.00 0.00 H new ATOM 0 HH12 ARG A 99 2.954 14.537 -0.491 1.00 0.00 H new ATOM 0 HH21 ARG A 99 4.781 13.130 -3.155 1.00 0.00 H new ATOM 0 HH22 ARG A 99 3.987 14.580 -2.531 1.00 0.00 H new ATOM 1519 N ILE A 100 2.730 6.116 -0.326 1.00 0.00 N ATOM 1520 CA ILE A 100 2.461 4.688 -0.530 1.00 0.00 C ATOM 1521 C ILE A 100 3.225 3.827 0.478 1.00 0.00 C ATOM 1522 O ILE A 100 4.191 4.285 1.086 1.00 0.00 O ATOM 1523 CB ILE A 100 2.852 4.257 -1.959 1.00 0.00 C ATOM 1524 CG1 ILE A 100 2.137 5.128 -2.994 1.00 0.00 C ATOM 1525 CG2 ILE A 100 2.534 2.785 -2.184 1.00 0.00 C ATOM 1526 CD1 ILE A 100 3.071 5.982 -3.820 1.00 0.00 C ATOM 0 H ILE A 100 3.557 6.458 -0.816 1.00 0.00 H new ATOM 0 HA ILE A 100 1.391 4.538 -0.383 1.00 0.00 H new ATOM 0 HB ILE A 100 3.927 4.394 -2.077 1.00 0.00 H new ATOM 0 HG12 ILE A 100 1.561 4.486 -3.661 1.00 0.00 H new ATOM 0 HG13 ILE A 100 1.425 5.775 -2.482 1.00 0.00 H new ATOM 0 HG21 ILE A 100 2.818 2.502 -3.198 1.00 0.00 H new ATOM 0 HG22 ILE A 100 3.091 2.179 -1.469 1.00 0.00 H new ATOM 0 HG23 ILE A 100 1.466 2.618 -2.046 1.00 0.00 H new ATOM 0 HD11 ILE A 100 2.492 6.571 -4.531 1.00 0.00 H new ATOM 0 HD12 ILE A 100 3.629 6.650 -3.164 1.00 0.00 H new ATOM 0 HD13 ILE A 100 3.767 5.341 -4.361 1.00 0.00 H new ATOM 1538 N LEU A 101 2.789 2.575 0.659 1.00 0.00 N ATOM 1539 CA LEU A 101 3.448 1.677 1.608 1.00 0.00 C ATOM 1540 C LEU A 101 2.874 0.258 1.571 1.00 0.00 C ATOM 1541 O LEU A 101 1.684 0.062 1.340 1.00 0.00 O ATOM 1542 CB LEU A 101 3.334 2.246 3.025 1.00 0.00 C ATOM 1543 CG LEU A 101 2.167 3.216 3.247 1.00 0.00 C ATOM 1544 CD1 LEU A 101 1.259 2.701 4.337 1.00 0.00 C ATOM 1545 CD2 LEU A 101 2.669 4.609 3.594 1.00 0.00 C ATOM 0 H LEU A 101 1.994 2.167 0.167 1.00 0.00 H new ATOM 0 HA LEU A 101 4.495 1.609 1.314 1.00 0.00 H new ATOM 0 HB2 LEU A 101 3.235 1.417 3.725 1.00 0.00 H new ATOM 0 HB3 LEU A 101 4.264 2.760 3.269 1.00 0.00 H new ATOM 0 HG LEU A 101 1.602 3.283 2.317 1.00 0.00 H new ATOM 0 HD11 LEU A 101 0.435 3.399 4.484 1.00 0.00 H new ATOM 0 HD12 LEU A 101 0.863 1.727 4.050 1.00 0.00 H new ATOM 0 HD13 LEU A 101 1.823 2.604 5.265 1.00 0.00 H new ATOM 0 HD21 LEU A 101 1.819 5.275 3.746 1.00 0.00 H new ATOM 0 HD22 LEU A 101 3.263 4.565 4.507 1.00 0.00 H new ATOM 0 HD23 LEU A 101 3.285 4.987 2.778 1.00 0.00 H new ATOM 1557 N PHE A 102 3.741 -0.727 1.815 1.00 0.00 N ATOM 1558 CA PHE A 102 3.346 -2.138 1.823 1.00 0.00 C ATOM 1559 C PHE A 102 3.210 -2.649 3.259 1.00 0.00 C ATOM 1560 O PHE A 102 3.905 -2.175 4.160 1.00 0.00 O ATOM 1561 CB PHE A 102 4.397 -2.971 1.080 1.00 0.00 C ATOM 1562 CG PHE A 102 3.855 -3.786 -0.060 1.00 0.00 C ATOM 1563 CD1 PHE A 102 2.828 -4.694 0.138 1.00 0.00 C ATOM 1564 CD2 PHE A 102 4.387 -3.648 -1.332 1.00 0.00 C ATOM 1565 CE1 PHE A 102 2.340 -5.448 -0.913 1.00 0.00 C ATOM 1566 CE2 PHE A 102 3.906 -4.400 -2.384 1.00 0.00 C ATOM 1567 CZ PHE A 102 2.880 -5.301 -2.176 1.00 0.00 C ATOM 0 H PHE A 102 4.730 -0.571 2.011 1.00 0.00 H new ATOM 0 HA PHE A 102 2.382 -2.233 1.324 1.00 0.00 H new ATOM 0 HB2 PHE A 102 5.168 -2.302 0.697 1.00 0.00 H new ATOM 0 HB3 PHE A 102 4.880 -3.641 1.791 1.00 0.00 H new ATOM 0 HD1 PHE A 102 2.404 -4.814 1.124 1.00 0.00 H new ATOM 0 HD2 PHE A 102 5.188 -2.943 -1.502 1.00 0.00 H new ATOM 0 HE1 PHE A 102 1.537 -6.151 -0.747 1.00 0.00 H new ATOM 0 HE2 PHE A 102 4.332 -4.284 -3.370 1.00 0.00 H new ATOM 0 HZ PHE A 102 2.501 -5.889 -2.999 1.00 0.00 H new ATOM 1577 N LEU A 103 2.323 -3.621 3.478 1.00 0.00 N ATOM 1578 CA LEU A 103 2.135 -4.174 4.817 1.00 0.00 C ATOM 1579 C LEU A 103 1.826 -5.664 4.792 1.00 0.00 C ATOM 1580 O LEU A 103 1.614 -6.258 3.732 1.00 0.00 O ATOM 1581 CB LEU A 103 1.034 -3.438 5.581 1.00 0.00 C ATOM 1582 CG LEU A 103 -0.010 -2.708 4.739 1.00 0.00 C ATOM 1583 CD1 LEU A 103 -1.192 -2.292 5.594 1.00 0.00 C ATOM 1584 CD2 LEU A 103 0.594 -1.505 4.030 1.00 0.00 C ATOM 0 H LEU A 103 1.733 -4.035 2.757 1.00 0.00 H new ATOM 0 HA LEU A 103 3.084 -4.032 5.334 1.00 0.00 H new ATOM 0 HB2 LEU A 103 0.518 -4.160 6.214 1.00 0.00 H new ATOM 0 HB3 LEU A 103 1.506 -2.712 6.244 1.00 0.00 H new ATOM 0 HG LEU A 103 -0.365 -3.399 3.975 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -1.924 -1.774 4.975 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -1.651 -3.177 6.035 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -0.851 -1.626 6.387 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -0.175 -1.007 3.439 1.00 0.00 H new ATOM 0 HD22 LEU A 103 0.991 -0.809 4.769 1.00 0.00 H new ATOM 0 HD23 LEU A 103 1.399 -1.836 3.373 1.00 0.00 H new ATOM 1596 N ASP A 104 1.804 -6.255 5.985 1.00 0.00 N ATOM 1597 CA ASP A 104 1.529 -7.679 6.137 1.00 0.00 C ATOM 1598 C ASP A 104 0.046 -7.985 5.933 1.00 0.00 C ATOM 1599 O ASP A 104 -0.820 -7.165 6.265 1.00 0.00 O ATOM 1600 CB ASP A 104 1.978 -8.156 7.521 1.00 0.00 C ATOM 1601 CG ASP A 104 3.093 -9.181 7.446 1.00 0.00 C ATOM 1602 OD1 ASP A 104 3.197 -9.871 6.409 1.00 0.00 O ATOM 1603 OD2 ASP A 104 3.862 -9.294 8.425 1.00 0.00 O ATOM 0 H ASP A 104 1.974 -5.765 6.863 1.00 0.00 H new ATOM 0 HA ASP A 104 2.091 -8.213 5.371 1.00 0.00 H new ATOM 0 HB2 ASP A 104 2.314 -7.300 8.106 1.00 0.00 H new ATOM 0 HB3 ASP A 104 1.127 -8.587 8.047 1.00 0.00 H new ATOM 1608 N PRO A 105 -0.258 -9.185 5.387 1.00 0.00 N ATOM 1609 CA PRO A 105 -1.635 -9.626 5.133 1.00 0.00 C ATOM 1610 C PRO A 105 -2.522 -9.492 6.361 1.00 0.00 C ATOM 1611 O PRO A 105 -2.537 -10.363 7.229 1.00 0.00 O ATOM 1612 CB PRO A 105 -1.476 -11.097 4.747 1.00 0.00 C ATOM 1613 CG PRO A 105 -0.095 -11.197 4.202 1.00 0.00 C ATOM 1614 CD PRO A 105 0.727 -10.206 4.979 1.00 0.00 C ATOM 0 HA PRO A 105 -2.118 -9.022 4.366 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -1.609 -11.750 5.610 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -2.217 -11.394 4.005 1.00 0.00 H new ATOM 0 HG2 PRO A 105 0.298 -12.207 4.318 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -0.078 -10.968 3.136 1.00 0.00 H new ATOM 0 HD2 PRO A 105 1.205 -10.670 5.842 1.00 0.00 H new ATOM 0 HD3 PRO A 105 1.521 -9.776 4.368 1.00 0.00 H new ATOM 1622 N SER A 106 -3.255 -8.387 6.417 1.00 0.00 N ATOM 1623 CA SER A 106 -4.159 -8.090 7.526 1.00 0.00 C ATOM 1624 C SER A 106 -4.423 -6.591 7.591 1.00 0.00 C ATOM 1625 O SER A 106 -5.457 -6.149 8.091 1.00 0.00 O ATOM 1626 CB SER A 106 -3.573 -8.564 8.860 1.00 0.00 C ATOM 1627 OG SER A 106 -2.179 -8.322 8.917 1.00 0.00 O ATOM 0 H SER A 106 -3.241 -7.668 5.693 1.00 0.00 H new ATOM 0 HA SER A 106 -5.094 -8.622 7.352 1.00 0.00 H new ATOM 0 HB2 SER A 106 -4.069 -8.049 9.683 1.00 0.00 H new ATOM 0 HB3 SER A 106 -3.766 -9.629 8.988 1.00 0.00 H new ATOM 0 HG SER A 106 -1.828 -8.632 9.778 1.00 0.00 H new ATOM 1633 N GLY A 107 -3.468 -5.814 7.085 1.00 0.00 N ATOM 1634 CA GLY A 107 -3.596 -4.374 7.095 1.00 0.00 C ATOM 1635 C GLY A 107 -2.685 -3.741 8.123 1.00 0.00 C ATOM 1636 O GLY A 107 -3.112 -2.878 8.891 1.00 0.00 O ATOM 0 H GLY A 107 -2.605 -6.162 6.667 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -3.359 -3.980 6.107 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -4.630 -4.102 7.307 1.00 0.00 H new ATOM 1640 N LYS A 108 -1.427 -4.182 8.155 1.00 0.00 N ATOM 1641 CA LYS A 108 -0.472 -3.653 9.126 1.00 0.00 C ATOM 1642 C LYS A 108 0.753 -3.019 8.464 1.00 0.00 C ATOM 1643 O LYS A 108 1.795 -3.668 8.323 1.00 0.00 O ATOM 1644 CB LYS A 108 -0.030 -4.763 10.081 1.00 0.00 C ATOM 1645 CG LYS A 108 -0.705 -4.698 11.441 1.00 0.00 C ATOM 1646 CD LYS A 108 0.222 -5.177 12.546 1.00 0.00 C ATOM 1647 CE LYS A 108 -0.148 -6.574 13.019 1.00 0.00 C ATOM 1648 NZ LYS A 108 0.010 -6.722 14.492 1.00 0.00 N ATOM 0 H LYS A 108 -1.050 -4.894 7.529 1.00 0.00 H new ATOM 0 HA LYS A 108 -0.982 -2.865 9.680 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -0.243 -5.730 9.625 1.00 0.00 H new ATOM 0 HB3 LYS A 108 1.050 -4.705 10.217 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -1.017 -3.674 11.645 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -1.607 -5.310 11.430 1.00 0.00 H new ATOM 0 HD2 LYS A 108 1.251 -5.175 12.186 1.00 0.00 H new ATOM 0 HD3 LYS A 108 0.177 -4.484 13.386 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -1.180 -6.790 12.741 1.00 0.00 H new ATOM 0 HE3 LYS A 108 0.479 -7.307 12.511 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -0.252 -7.688 14.774 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 1.000 -6.541 14.755 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -0.607 -6.040 14.978 1.00 0.00 H new ATOM 1662 N VAL A 109 0.629 -1.745 8.073 1.00 0.00 N ATOM 1663 CA VAL A 109 1.715 -1.004 7.454 1.00 0.00 C ATOM 1664 C VAL A 109 3.046 -1.273 8.141 1.00 0.00 C ATOM 1665 O VAL A 109 3.331 -0.734 9.210 1.00 0.00 O ATOM 1666 CB VAL A 109 1.410 0.503 7.481 1.00 0.00 C ATOM 1667 CG1 VAL A 109 2.662 1.313 7.224 1.00 0.00 C ATOM 1668 CG2 VAL A 109 0.331 0.832 6.464 1.00 0.00 C ATOM 0 H VAL A 109 -0.230 -1.206 8.180 1.00 0.00 H new ATOM 0 HA VAL A 109 1.797 -1.342 6.421 1.00 0.00 H new ATOM 0 HB VAL A 109 1.045 0.767 8.473 1.00 0.00 H new ATOM 0 HG11 VAL A 109 2.419 2.375 7.248 1.00 0.00 H new ATOM 0 HG12 VAL A 109 3.402 1.092 7.993 1.00 0.00 H new ATOM 0 HG13 VAL A 109 3.067 1.056 6.245 1.00 0.00 H new ATOM 0 HG21 VAL A 109 0.121 1.901 6.490 1.00 0.00 H new ATOM 0 HG22 VAL A 109 0.673 0.553 5.467 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -0.576 0.278 6.704 1.00 0.00 H new ATOM 1678 N HIS A 110 3.860 -2.096 7.501 1.00 0.00 N ATOM 1679 CA HIS A 110 5.172 -2.428 8.023 1.00 0.00 C ATOM 1680 C HIS A 110 6.240 -1.748 7.179 1.00 0.00 C ATOM 1681 O HIS A 110 6.209 -1.832 5.952 1.00 0.00 O ATOM 1682 CB HIS A 110 5.381 -3.945 8.025 1.00 0.00 C ATOM 1683 CG HIS A 110 5.735 -4.496 9.372 1.00 0.00 C ATOM 1684 ND1 HIS A 110 6.988 -4.368 9.933 1.00 0.00 N ATOM 1685 CD2 HIS A 110 4.990 -5.179 10.273 1.00 0.00 C ATOM 1686 CE1 HIS A 110 7.000 -4.948 11.120 1.00 0.00 C ATOM 1687 NE2 HIS A 110 5.799 -5.448 11.349 1.00 0.00 N ATOM 0 H HIS A 110 3.632 -2.547 6.615 1.00 0.00 H new ATOM 0 HA HIS A 110 5.246 -2.074 9.051 1.00 0.00 H new ATOM 0 HB2 HIS A 110 4.472 -4.430 7.670 1.00 0.00 H new ATOM 0 HB3 HIS A 110 6.172 -4.196 7.319 1.00 0.00 H new ATOM 0 HD2 HIS A 110 3.953 -5.460 10.165 1.00 0.00 H new ATOM 0 HE1 HIS A 110 7.846 -5.004 11.788 1.00 0.00 H new ATOM 0 HE2 HIS A 110 5.518 -5.953 12.190 1.00 0.00 H new ATOM 1696 N PRO A 111 7.200 -1.057 7.814 1.00 0.00 N ATOM 1697 CA PRO A 111 8.271 -0.360 7.097 1.00 0.00 C ATOM 1698 C PRO A 111 9.232 -1.323 6.404 1.00 0.00 C ATOM 1699 O PRO A 111 10.440 -1.088 6.368 1.00 0.00 O ATOM 1700 CB PRO A 111 8.992 0.422 8.197 1.00 0.00 C ATOM 1701 CG PRO A 111 8.683 -0.315 9.454 1.00 0.00 C ATOM 1702 CD PRO A 111 7.309 -0.892 9.273 1.00 0.00 C ATOM 0 HA PRO A 111 7.880 0.270 6.298 1.00 0.00 H new ATOM 0 HB2 PRO A 111 10.066 0.461 8.015 1.00 0.00 H new ATOM 0 HB3 PRO A 111 8.639 1.452 8.246 1.00 0.00 H new ATOM 0 HG2 PRO A 111 9.415 -1.102 9.634 1.00 0.00 H new ATOM 0 HG3 PRO A 111 8.715 0.353 10.315 1.00 0.00 H new ATOM 0 HD2 PRO A 111 7.200 -1.843 9.795 1.00 0.00 H new ATOM 0 HD3 PRO A 111 6.539 -0.226 9.661 1.00 0.00 H new ATOM 1710 N GLU A 112 8.689 -2.402 5.849 1.00 0.00 N ATOM 1711 CA GLU A 112 9.499 -3.394 5.148 1.00 0.00 C ATOM 1712 C GLU A 112 9.650 -3.009 3.682 1.00 0.00 C ATOM 1713 O GLU A 112 10.665 -2.440 3.282 1.00 0.00 O ATOM 1714 CB GLU A 112 8.868 -4.783 5.272 1.00 0.00 C ATOM 1715 CG GLU A 112 9.266 -5.522 6.540 1.00 0.00 C ATOM 1716 CD GLU A 112 10.454 -6.440 6.330 1.00 0.00 C ATOM 1717 OE1 GLU A 112 11.566 -5.927 6.089 1.00 0.00 O ATOM 1718 OE2 GLU A 112 10.271 -7.675 6.408 1.00 0.00 O ATOM 0 H GLU A 112 7.691 -2.612 5.871 1.00 0.00 H new ATOM 0 HA GLU A 112 10.488 -3.422 5.605 1.00 0.00 H new ATOM 0 HB2 GLU A 112 7.783 -4.684 5.245 1.00 0.00 H new ATOM 0 HB3 GLU A 112 9.155 -5.382 4.407 1.00 0.00 H new ATOM 0 HG2 GLU A 112 9.504 -4.798 7.319 1.00 0.00 H new ATOM 0 HG3 GLU A 112 8.418 -6.107 6.897 1.00 0.00 H new ATOM 1725 N ILE A 113 8.627 -3.307 2.885 1.00 0.00 N ATOM 1726 CA ILE A 113 8.647 -2.968 1.468 1.00 0.00 C ATOM 1727 C ILE A 113 8.144 -1.545 1.265 1.00 0.00 C ATOM 1728 O ILE A 113 6.941 -1.293 1.255 1.00 0.00 O ATOM 1729 CB ILE A 113 7.784 -3.938 0.638 1.00 0.00 C ATOM 1730 CG1 ILE A 113 8.109 -5.386 1.005 1.00 0.00 C ATOM 1731 CG2 ILE A 113 8.006 -3.701 -0.851 1.00 0.00 C ATOM 1732 CD1 ILE A 113 7.117 -6.000 1.970 1.00 0.00 C ATOM 0 H ILE A 113 7.779 -3.780 3.196 1.00 0.00 H new ATOM 0 HA ILE A 113 9.678 -3.050 1.125 1.00 0.00 H new ATOM 0 HB ILE A 113 6.734 -3.753 0.865 1.00 0.00 H new ATOM 0 HG12 ILE A 113 8.138 -5.986 0.095 1.00 0.00 H new ATOM 0 HG13 ILE A 113 9.105 -5.426 1.445 1.00 0.00 H new ATOM 0 HG21 ILE A 113 7.390 -4.393 -1.425 1.00 0.00 H new ATOM 0 HG22 ILE A 113 7.731 -2.677 -1.101 1.00 0.00 H new ATOM 0 HG23 ILE A 113 9.056 -3.864 -1.093 1.00 0.00 H new ATOM 0 HD11 ILE A 113 7.409 -7.028 2.187 1.00 0.00 H new ATOM 0 HD12 ILE A 113 7.105 -5.424 2.895 1.00 0.00 H new ATOM 0 HD13 ILE A 113 6.122 -5.991 1.524 1.00 0.00 H new ATOM 1744 N ILE A 114 9.078 -0.613 1.126 1.00 0.00 N ATOM 1745 CA ILE A 114 8.735 0.791 0.947 1.00 0.00 C ATOM 1746 C ILE A 114 8.733 1.189 -0.523 1.00 0.00 C ATOM 1747 O ILE A 114 7.818 1.865 -0.991 1.00 0.00 O ATOM 1748 CB ILE A 114 9.717 1.708 1.704 1.00 0.00 C ATOM 1749 CG1 ILE A 114 11.166 1.224 1.520 1.00 0.00 C ATOM 1750 CG2 ILE A 114 9.345 1.787 3.179 1.00 0.00 C ATOM 1751 CD1 ILE A 114 11.653 0.274 2.598 1.00 0.00 C ATOM 0 H ILE A 114 10.080 -0.805 1.134 1.00 0.00 H new ATOM 0 HA ILE A 114 7.731 0.916 1.352 1.00 0.00 H new ATOM 0 HB ILE A 114 9.646 2.712 1.285 1.00 0.00 H new ATOM 0 HG12 ILE A 114 11.251 0.730 0.552 1.00 0.00 H new ATOM 0 HG13 ILE A 114 11.825 2.092 1.493 1.00 0.00 H new ATOM 0 HG21 ILE A 114 10.049 2.438 3.697 1.00 0.00 H new ATOM 0 HG22 ILE A 114 8.337 2.189 3.279 1.00 0.00 H new ATOM 0 HG23 ILE A 114 9.383 0.790 3.618 1.00 0.00 H new ATOM 0 HD11 ILE A 114 12.683 -0.016 2.389 1.00 0.00 H new ATOM 0 HD12 ILE A 114 11.605 0.769 3.568 1.00 0.00 H new ATOM 0 HD13 ILE A 114 11.022 -0.614 2.612 1.00 0.00 H new ATOM 1763 N ASN A 115 9.771 0.771 -1.238 1.00 0.00 N ATOM 1764 CA ASN A 115 9.924 1.080 -2.657 1.00 0.00 C ATOM 1765 C ASN A 115 11.342 0.738 -3.099 1.00 0.00 C ATOM 1766 O ASN A 115 11.550 0.155 -4.162 1.00 0.00 O ATOM 1767 CB ASN A 115 9.624 2.566 -2.924 1.00 0.00 C ATOM 1768 CG ASN A 115 9.996 3.006 -4.331 1.00 0.00 C ATOM 1769 OD1 ASN A 115 10.549 2.235 -5.115 1.00 0.00 O ATOM 1770 ND2 ASN A 115 9.688 4.255 -4.661 1.00 0.00 N ATOM 0 H ASN A 115 10.530 0.209 -0.852 1.00 0.00 H new ATOM 0 HA ASN A 115 9.214 0.484 -3.230 1.00 0.00 H new ATOM 0 HB2 ASN A 115 8.562 2.751 -2.761 1.00 0.00 H new ATOM 0 HB3 ASN A 115 10.169 3.176 -2.203 1.00 0.00 H new ATOM 0 HD21 ASN A 115 9.910 4.606 -5.593 1.00 0.00 H new ATOM 0 HD22 ASN A 115 9.230 4.863 -3.983 1.00 0.00 H new ATOM 1777 N GLU A 116 12.310 1.105 -2.263 1.00 0.00 N ATOM 1778 CA GLU A 116 13.721 0.846 -2.538 1.00 0.00 C ATOM 1779 C GLU A 116 14.214 1.671 -3.724 1.00 0.00 C ATOM 1780 O GLU A 116 15.135 2.477 -3.587 1.00 0.00 O ATOM 1781 CB GLU A 116 13.952 -0.644 -2.791 1.00 0.00 C ATOM 1782 CG GLU A 116 13.540 -1.521 -1.620 1.00 0.00 C ATOM 1783 CD GLU A 116 14.470 -1.380 -0.431 1.00 0.00 C ATOM 1784 OE1 GLU A 116 14.518 -0.280 0.159 1.00 0.00 O ATOM 1785 OE2 GLU A 116 15.149 -2.371 -0.089 1.00 0.00 O ATOM 0 H GLU A 116 12.140 1.588 -1.381 1.00 0.00 H new ATOM 0 HA GLU A 116 14.294 1.145 -1.660 1.00 0.00 H new ATOM 0 HB2 GLU A 116 13.394 -0.946 -3.677 1.00 0.00 H new ATOM 0 HB3 GLU A 116 15.007 -0.810 -3.007 1.00 0.00 H new ATOM 0 HG2 GLU A 116 12.526 -1.262 -1.316 1.00 0.00 H new ATOM 0 HG3 GLU A 116 13.521 -2.563 -1.940 1.00 0.00 H new ATOM 1792 N ASN A 117 13.596 1.475 -4.884 1.00 0.00 N ATOM 1793 CA ASN A 117 13.972 2.208 -6.087 1.00 0.00 C ATOM 1794 C ASN A 117 14.019 3.712 -5.826 1.00 0.00 C ATOM 1795 O ASN A 117 14.711 4.450 -6.528 1.00 0.00 O ATOM 1796 CB ASN A 117 12.990 1.908 -7.220 1.00 0.00 C ATOM 1797 CG ASN A 117 13.637 2.007 -8.588 1.00 0.00 C ATOM 1798 OD1 ASN A 117 14.180 0.893 -9.067 1.00 0.00 O flip ATOM 1799 ND2 ASN A 117 13.650 3.072 -9.206 1.00 0.00 N flip ATOM 0 H ASN A 117 12.831 0.813 -5.016 1.00 0.00 H new ATOM 0 HA ASN A 117 14.969 1.880 -6.380 1.00 0.00 H new ATOM 0 HB2 ASN A 117 12.581 0.907 -7.086 1.00 0.00 H new ATOM 0 HB3 ASN A 117 12.153 2.604 -7.166 1.00 0.00 H new ATOM 0 HD21 ASN A 117 13.220 3.903 -8.799 1.00 0.00 H new ATOM 0 HD22 ASN A 117 14.090 3.123 -10.125 1.00 0.00 H new ATOM 1806 N GLY A 118 13.282 4.164 -4.813 1.00 0.00 N ATOM 1807 CA GLY A 118 13.263 5.578 -4.489 1.00 0.00 C ATOM 1808 C GLY A 118 14.564 6.044 -3.867 1.00 0.00 C ATOM 1809 O GLY A 118 15.521 5.277 -3.767 1.00 0.00 O ATOM 0 H GLY A 118 12.701 3.578 -4.214 1.00 0.00 H new ATOM 0 HA2 GLY A 118 13.069 6.153 -5.394 1.00 0.00 H new ATOM 0 HA3 GLY A 118 12.442 5.780 -3.801 1.00 0.00 H new ATOM 1813 N ASN A 119 14.597 7.303 -3.449 1.00 0.00 N ATOM 1814 CA ASN A 119 15.787 7.872 -2.831 1.00 0.00 C ATOM 1815 C ASN A 119 15.832 7.538 -1.341 1.00 0.00 C ATOM 1816 O ASN A 119 14.801 7.218 -0.743 1.00 0.00 O ATOM 1817 CB ASN A 119 15.813 9.390 -3.033 1.00 0.00 C ATOM 1818 CG ASN A 119 14.694 10.095 -2.291 1.00 0.00 C ATOM 1819 OD1 ASN A 119 13.594 10.267 -2.817 1.00 0.00 O ATOM 1820 ND2 ASN A 119 14.969 10.505 -1.057 1.00 0.00 N ATOM 0 H ASN A 119 13.812 7.950 -3.527 1.00 0.00 H new ATOM 0 HA ASN A 119 16.665 7.437 -3.309 1.00 0.00 H new ATOM 0 HB2 ASN A 119 16.772 9.782 -2.694 1.00 0.00 H new ATOM 0 HB3 ASN A 119 15.736 9.613 -4.097 1.00 0.00 H new ATOM 0 HD21 ASN A 119 14.255 10.983 -0.507 1.00 0.00 H new ATOM 0 HD22 ASN A 119 15.894 10.342 -0.660 1.00 0.00 H new ATOM 1827 N PRO A 120 17.026 7.605 -0.722 1.00 0.00 N ATOM 1828 CA PRO A 120 17.196 7.307 0.704 1.00 0.00 C ATOM 1829 C PRO A 120 16.704 8.437 1.606 1.00 0.00 C ATOM 1830 O PRO A 120 17.413 8.878 2.511 1.00 0.00 O ATOM 1831 CB PRO A 120 18.707 7.133 0.844 1.00 0.00 C ATOM 1832 CG PRO A 120 19.281 8.005 -0.217 1.00 0.00 C ATOM 1833 CD PRO A 120 18.304 7.974 -1.363 1.00 0.00 C ATOM 0 HA PRO A 120 16.617 6.435 1.009 1.00 0.00 H new ATOM 0 HB2 PRO A 120 19.051 7.433 1.834 1.00 0.00 H new ATOM 0 HB3 PRO A 120 19.002 6.093 0.706 1.00 0.00 H new ATOM 0 HG2 PRO A 120 19.420 9.022 0.149 1.00 0.00 H new ATOM 0 HG3 PRO A 120 20.260 7.643 -0.531 1.00 0.00 H new ATOM 0 HD2 PRO A 120 18.238 8.942 -1.860 1.00 0.00 H new ATOM 0 HD3 PRO A 120 18.597 7.247 -2.120 1.00 0.00 H new ATOM 1841 N SER A 121 15.485 8.897 1.353 1.00 0.00 N ATOM 1842 CA SER A 121 14.882 9.970 2.134 1.00 0.00 C ATOM 1843 C SER A 121 13.449 10.183 1.672 1.00 0.00 C ATOM 1844 O SER A 121 12.947 11.306 1.638 1.00 0.00 O ATOM 1845 CB SER A 121 15.691 11.261 1.987 1.00 0.00 C ATOM 1846 OG SER A 121 16.436 11.533 3.161 1.00 0.00 O ATOM 0 H SER A 121 14.890 8.540 0.606 1.00 0.00 H new ATOM 0 HA SER A 121 14.882 9.691 3.188 1.00 0.00 H new ATOM 0 HB2 SER A 121 16.366 11.176 1.136 1.00 0.00 H new ATOM 0 HB3 SER A 121 15.019 12.093 1.778 1.00 0.00 H new ATOM 0 HG SER A 121 17.014 10.769 3.366 1.00 0.00 H new ATOM 1852 N TYR A 122 12.806 9.083 1.297 1.00 0.00 N ATOM 1853 CA TYR A 122 11.439 9.118 0.811 1.00 0.00 C ATOM 1854 C TYR A 122 10.851 7.712 0.783 1.00 0.00 C ATOM 1855 O TYR A 122 9.867 7.427 1.460 1.00 0.00 O ATOM 1856 CB TYR A 122 11.410 9.736 -0.586 1.00 0.00 C ATOM 1857 CG TYR A 122 10.819 11.127 -0.623 1.00 0.00 C ATOM 1858 CD1 TYR A 122 9.471 11.341 -0.361 1.00 0.00 C ATOM 1859 CD2 TYR A 122 11.611 12.230 -0.920 1.00 0.00 C ATOM 1860 CE1 TYR A 122 8.930 12.613 -0.395 1.00 0.00 C ATOM 1861 CE2 TYR A 122 11.079 13.505 -0.955 1.00 0.00 C ATOM 1862 CZ TYR A 122 9.738 13.690 -0.693 1.00 0.00 C ATOM 1863 OH TYR A 122 9.204 14.959 -0.726 1.00 0.00 O ATOM 0 H TYR A 122 13.217 8.150 1.322 1.00 0.00 H new ATOM 0 HA TYR A 122 10.835 9.727 1.483 1.00 0.00 H new ATOM 0 HB2 TYR A 122 12.426 9.772 -0.979 1.00 0.00 H new ATOM 0 HB3 TYR A 122 10.835 9.089 -1.248 1.00 0.00 H new ATOM 0 HD1 TYR A 122 8.835 10.500 -0.127 1.00 0.00 H new ATOM 0 HD2 TYR A 122 12.661 12.088 -1.127 1.00 0.00 H new ATOM 0 HE1 TYR A 122 7.880 12.762 -0.189 1.00 0.00 H new ATOM 0 HE2 TYR A 122 11.709 14.351 -1.186 1.00 0.00 H new ATOM 0 HH TYR A 122 9.907 15.604 -0.950 1.00 0.00 H new ATOM 1873 N LYS A 123 11.482 6.834 0.008 1.00 0.00 N ATOM 1874 CA LYS A 123 11.046 5.439 -0.104 1.00 0.00 C ATOM 1875 C LYS A 123 9.532 5.330 -0.332 1.00 0.00 C ATOM 1876 O LYS A 123 9.075 5.265 -1.475 1.00 0.00 O ATOM 1877 CB LYS A 123 11.454 4.673 1.154 1.00 0.00 C ATOM 1878 CG LYS A 123 12.952 4.450 1.280 1.00 0.00 C ATOM 1879 CD LYS A 123 13.441 3.388 0.306 1.00 0.00 C ATOM 1880 CE LYS A 123 14.270 3.992 -0.816 1.00 0.00 C ATOM 1881 NZ LYS A 123 15.666 3.476 -0.812 1.00 0.00 N ATOM 0 H LYS A 123 12.301 7.062 -0.555 1.00 0.00 H new ATOM 0 HA LYS A 123 11.535 5.000 -0.974 1.00 0.00 H new ATOM 0 HB2 LYS A 123 11.103 5.219 2.030 1.00 0.00 H new ATOM 0 HB3 LYS A 123 10.951 3.706 1.158 1.00 0.00 H new ATOM 0 HG2 LYS A 123 13.477 5.386 1.093 1.00 0.00 H new ATOM 0 HG3 LYS A 123 13.192 4.148 2.300 1.00 0.00 H new ATOM 0 HD2 LYS A 123 14.037 2.650 0.842 1.00 0.00 H new ATOM 0 HD3 LYS A 123 12.586 2.861 -0.117 1.00 0.00 H new ATOM 0 HE2 LYS A 123 13.802 3.767 -1.775 1.00 0.00 H new ATOM 0 HE3 LYS A 123 14.283 5.077 -0.714 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 16.328 4.266 -0.671 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 15.779 2.787 -0.041 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 15.868 3.014 -1.722 1.00 0.00 H new ATOM 1895 N TYR A 124 8.766 5.308 0.765 1.00 0.00 N ATOM 1896 CA TYR A 124 7.298 5.214 0.720 1.00 0.00 C ATOM 1897 C TYR A 124 6.728 5.928 -0.507 1.00 0.00 C ATOM 1898 O TYR A 124 5.756 5.474 -1.109 1.00 0.00 O ATOM 1899 CB TYR A 124 6.701 5.822 1.992 1.00 0.00 C ATOM 1900 CG TYR A 124 7.131 5.123 3.269 1.00 0.00 C ATOM 1901 CD1 TYR A 124 8.373 5.365 3.845 1.00 0.00 C ATOM 1902 CD2 TYR A 124 6.288 4.216 3.896 1.00 0.00 C ATOM 1903 CE1 TYR A 124 8.761 4.725 5.005 1.00 0.00 C ATOM 1904 CE2 TYR A 124 6.668 3.572 5.057 1.00 0.00 C ATOM 1905 CZ TYR A 124 7.905 3.828 5.608 1.00 0.00 C ATOM 1906 OH TYR A 124 8.287 3.187 6.765 1.00 0.00 O ATOM 0 H TYR A 124 9.145 5.355 1.711 1.00 0.00 H new ATOM 0 HA TYR A 124 7.031 4.159 0.653 1.00 0.00 H new ATOM 0 HB2 TYR A 124 6.988 6.872 2.050 1.00 0.00 H new ATOM 0 HB3 TYR A 124 5.614 5.792 1.922 1.00 0.00 H new ATOM 0 HD1 TYR A 124 9.047 6.067 3.376 1.00 0.00 H new ATOM 0 HD2 TYR A 124 5.318 4.010 3.468 1.00 0.00 H new ATOM 0 HE1 TYR A 124 9.730 4.926 5.438 1.00 0.00 H new ATOM 0 HE2 TYR A 124 5.998 2.870 5.532 1.00 0.00 H new ATOM 0 HH TYR A 124 9.163 2.768 6.633 1.00 0.00 H new ATOM 1916 N PHE A 125 7.346 7.050 -0.866 1.00 0.00 N ATOM 1917 CA PHE A 125 6.914 7.837 -2.018 1.00 0.00 C ATOM 1918 C PHE A 125 7.402 7.211 -3.322 1.00 0.00 C ATOM 1919 O PHE A 125 8.601 7.007 -3.514 1.00 0.00 O ATOM 1920 CB PHE A 125 7.443 9.272 -1.891 1.00 0.00 C ATOM 1921 CG PHE A 125 7.352 10.079 -3.158 1.00 0.00 C ATOM 1922 CD1 PHE A 125 6.126 10.340 -3.745 1.00 0.00 C ATOM 1923 CD2 PHE A 125 8.498 10.581 -3.755 1.00 0.00 C ATOM 1924 CE1 PHE A 125 6.043 11.087 -4.906 1.00 0.00 C ATOM 1925 CE2 PHE A 125 8.421 11.327 -4.915 1.00 0.00 C ATOM 1926 CZ PHE A 125 7.192 11.581 -5.491 1.00 0.00 C ATOM 0 H PHE A 125 8.151 7.436 -0.373 1.00 0.00 H new ATOM 0 HA PHE A 125 5.824 7.853 -2.038 1.00 0.00 H new ATOM 0 HB2 PHE A 125 6.886 9.784 -1.107 1.00 0.00 H new ATOM 0 HB3 PHE A 125 8.484 9.236 -1.571 1.00 0.00 H new ATOM 0 HD1 PHE A 125 5.224 9.956 -3.291 1.00 0.00 H new ATOM 0 HD2 PHE A 125 9.462 10.387 -3.308 1.00 0.00 H new ATOM 0 HE1 PHE A 125 5.080 11.284 -5.355 1.00 0.00 H new ATOM 0 HE2 PHE A 125 9.321 11.711 -5.371 1.00 0.00 H new ATOM 0 HZ PHE A 125 7.130 12.165 -6.397 1.00 0.00 H new ATOM 1936 N TYR A 126 6.467 6.920 -4.222 1.00 0.00 N ATOM 1937 CA TYR A 126 6.807 6.332 -5.511 1.00 0.00 C ATOM 1938 C TYR A 126 6.811 7.400 -6.599 1.00 0.00 C ATOM 1939 O TYR A 126 6.469 8.555 -6.349 1.00 0.00 O ATOM 1940 CB TYR A 126 5.811 5.228 -5.879 1.00 0.00 C ATOM 1941 CG TYR A 126 6.159 3.870 -5.310 1.00 0.00 C ATOM 1942 CD1 TYR A 126 7.143 3.082 -5.891 1.00 0.00 C ATOM 1943 CD2 TYR A 126 5.496 3.375 -4.195 1.00 0.00 C ATOM 1944 CE1 TYR A 126 7.459 1.838 -5.376 1.00 0.00 C ATOM 1945 CE2 TYR A 126 5.806 2.133 -3.673 1.00 0.00 C ATOM 1946 CZ TYR A 126 6.788 1.370 -4.267 1.00 0.00 C ATOM 1947 OH TYR A 126 7.098 0.132 -3.751 1.00 0.00 O ATOM 0 H TYR A 126 5.470 7.082 -4.081 1.00 0.00 H new ATOM 0 HA TYR A 126 7.804 5.898 -5.433 1.00 0.00 H new ATOM 0 HB2 TYR A 126 4.820 5.515 -5.527 1.00 0.00 H new ATOM 0 HB3 TYR A 126 5.754 5.152 -6.965 1.00 0.00 H new ATOM 0 HD1 TYR A 126 7.671 3.447 -6.760 1.00 0.00 H new ATOM 0 HD2 TYR A 126 4.725 3.970 -3.728 1.00 0.00 H new ATOM 0 HE1 TYR A 126 8.227 1.237 -5.840 1.00 0.00 H new ATOM 0 HE2 TYR A 126 5.282 1.763 -2.805 1.00 0.00 H new ATOM 0 HH TYR A 126 6.535 -0.047 -2.969 1.00 0.00 H new ATOM 1957 N VAL A 127 7.187 6.999 -7.806 1.00 0.00 N ATOM 1958 CA VAL A 127 7.227 7.900 -8.949 1.00 0.00 C ATOM 1959 C VAL A 127 7.354 7.097 -10.236 1.00 0.00 C ATOM 1960 O VAL A 127 8.439 6.631 -10.582 1.00 0.00 O ATOM 1961 CB VAL A 127 8.391 8.907 -8.858 1.00 0.00 C ATOM 1962 CG1 VAL A 127 8.030 10.053 -7.929 1.00 0.00 C ATOM 1963 CG2 VAL A 127 9.668 8.224 -8.395 1.00 0.00 C ATOM 0 H VAL A 127 7.472 6.043 -8.020 1.00 0.00 H new ATOM 0 HA VAL A 127 6.296 8.466 -8.947 1.00 0.00 H new ATOM 0 HB VAL A 127 8.569 9.311 -9.855 1.00 0.00 H new ATOM 0 HG11 VAL A 127 8.863 10.755 -7.876 1.00 0.00 H new ATOM 0 HG12 VAL A 127 7.147 10.566 -8.310 1.00 0.00 H new ATOM 0 HG13 VAL A 127 7.821 9.662 -6.933 1.00 0.00 H new ATOM 0 HG21 VAL A 127 10.473 8.957 -8.339 1.00 0.00 H new ATOM 0 HG22 VAL A 127 9.509 7.784 -7.410 1.00 0.00 H new ATOM 0 HG23 VAL A 127 9.939 7.441 -9.103 1.00 0.00 H new ATOM 1973 N SER A 128 6.227 6.931 -10.925 1.00 0.00 N ATOM 1974 CA SER A 128 6.170 6.170 -12.178 1.00 0.00 C ATOM 1975 C SER A 128 5.846 4.699 -11.911 1.00 0.00 C ATOM 1976 O SER A 128 6.280 4.120 -10.910 1.00 0.00 O ATOM 1977 CB SER A 128 7.480 6.287 -12.969 1.00 0.00 C ATOM 1978 OG SER A 128 8.382 5.247 -12.628 1.00 0.00 O ATOM 0 H SER A 128 5.329 7.317 -10.635 1.00 0.00 H new ATOM 0 HA SER A 128 5.371 6.601 -12.781 1.00 0.00 H new ATOM 0 HB2 SER A 128 7.267 6.251 -14.037 1.00 0.00 H new ATOM 0 HB3 SER A 128 7.943 7.253 -12.769 1.00 0.00 H new ATOM 0 HG SER A 128 8.972 5.549 -11.906 1.00 0.00 H new ATOM 1984 N ALA A 129 5.075 4.105 -12.817 1.00 0.00 N ATOM 1985 CA ALA A 129 4.674 2.709 -12.697 1.00 0.00 C ATOM 1986 C ALA A 129 5.873 1.771 -12.772 1.00 0.00 C ATOM 1987 O ALA A 129 5.884 0.714 -12.143 1.00 0.00 O ATOM 1988 CB ALA A 129 3.667 2.355 -13.780 1.00 0.00 C ATOM 0 H ALA A 129 4.714 4.574 -13.648 1.00 0.00 H new ATOM 0 HA ALA A 129 4.211 2.582 -11.719 1.00 0.00 H new ATOM 0 HB1 ALA A 129 3.376 1.309 -13.679 1.00 0.00 H new ATOM 0 HB2 ALA A 129 2.786 2.988 -13.678 1.00 0.00 H new ATOM 0 HB3 ALA A 129 4.116 2.513 -14.760 1.00 0.00 H new ATOM 1994 N GLU A 130 6.876 2.159 -13.553 1.00 0.00 N ATOM 1995 CA GLU A 130 8.082 1.351 -13.729 1.00 0.00 C ATOM 1996 C GLU A 130 8.626 0.836 -12.396 1.00 0.00 C ATOM 1997 O GLU A 130 8.938 -0.349 -12.254 1.00 0.00 O ATOM 1998 CB GLU A 130 9.159 2.165 -14.448 1.00 0.00 C ATOM 1999 CG GLU A 130 9.933 1.364 -15.484 1.00 0.00 C ATOM 2000 CD GLU A 130 11.429 1.583 -15.388 1.00 0.00 C ATOM 2001 OE1 GLU A 130 11.984 1.417 -14.281 1.00 0.00 O ATOM 2002 OE2 GLU A 130 12.047 1.921 -16.420 1.00 0.00 O ATOM 0 H GLU A 130 6.879 3.033 -14.078 1.00 0.00 H new ATOM 0 HA GLU A 130 7.810 0.485 -14.333 1.00 0.00 H new ATOM 0 HB2 GLU A 130 8.692 3.020 -14.936 1.00 0.00 H new ATOM 0 HB3 GLU A 130 9.857 2.561 -13.711 1.00 0.00 H new ATOM 0 HG2 GLU A 130 9.715 0.304 -15.355 1.00 0.00 H new ATOM 0 HG3 GLU A 130 9.592 1.641 -16.482 1.00 0.00 H new ATOM 2009 N GLN A 131 8.750 1.718 -11.417 1.00 0.00 N ATOM 2010 CA GLN A 131 9.272 1.304 -10.123 1.00 0.00 C ATOM 2011 C GLN A 131 8.210 0.606 -9.286 1.00 0.00 C ATOM 2012 O GLN A 131 8.398 -0.530 -8.858 1.00 0.00 O ATOM 2013 CB GLN A 131 9.862 2.456 -9.326 1.00 0.00 C ATOM 2014 CG GLN A 131 9.178 3.802 -9.520 1.00 0.00 C ATOM 2015 CD GLN A 131 9.978 4.940 -8.919 1.00 0.00 C ATOM 2016 OE1 GLN A 131 9.632 5.325 -7.698 1.00 0.00 O flip ATOM 2017 NE2 GLN A 131 10.900 5.464 -9.545 1.00 0.00 N flip ATOM 0 H GLN A 131 8.503 2.705 -11.489 1.00 0.00 H new ATOM 0 HA GLN A 131 10.076 0.602 -10.346 1.00 0.00 H new ATOM 0 HB2 GLN A 131 9.827 2.199 -8.267 1.00 0.00 H new ATOM 0 HB3 GLN A 131 10.913 2.560 -9.594 1.00 0.00 H new ATOM 0 HG2 GLN A 131 9.033 3.984 -10.585 1.00 0.00 H new ATOM 0 HG3 GLN A 131 8.189 3.774 -9.064 1.00 0.00 H new ATOM 0 HE21 GLN A 131 11.132 5.135 -10.482 1.00 0.00 H new ATOM 0 HE22 GLN A 131 11.432 6.227 -9.126 1.00 0.00 H new ATOM 2026 N VAL A 132 7.090 1.282 -9.042 1.00 0.00 N ATOM 2027 CA VAL A 132 6.028 0.683 -8.241 1.00 0.00 C ATOM 2028 C VAL A 132 5.652 -0.690 -8.791 1.00 0.00 C ATOM 2029 O VAL A 132 5.117 -1.529 -8.066 1.00 0.00 O ATOM 2030 CB VAL A 132 4.775 1.588 -8.138 1.00 0.00 C ATOM 2031 CG1 VAL A 132 4.509 2.318 -9.443 1.00 0.00 C ATOM 2032 CG2 VAL A 132 3.550 0.785 -7.709 1.00 0.00 C ATOM 0 H VAL A 132 6.897 2.225 -9.380 1.00 0.00 H new ATOM 0 HA VAL A 132 6.420 0.569 -7.230 1.00 0.00 H new ATOM 0 HB VAL A 132 4.976 2.337 -7.372 1.00 0.00 H new ATOM 0 HG11 VAL A 132 3.623 2.944 -9.336 1.00 0.00 H new ATOM 0 HG12 VAL A 132 5.367 2.943 -9.692 1.00 0.00 H new ATOM 0 HG13 VAL A 132 4.346 1.592 -10.239 1.00 0.00 H new ATOM 0 HG21 VAL A 132 2.686 1.446 -7.645 1.00 0.00 H new ATOM 0 HG22 VAL A 132 3.354 0.001 -8.441 1.00 0.00 H new ATOM 0 HG23 VAL A 132 3.734 0.333 -6.734 1.00 0.00 H new ATOM 2042 N VAL A 133 5.957 -0.932 -10.067 1.00 0.00 N ATOM 2043 CA VAL A 133 5.667 -2.222 -10.665 1.00 0.00 C ATOM 2044 C VAL A 133 6.733 -3.235 -10.278 1.00 0.00 C ATOM 2045 O VAL A 133 6.437 -4.416 -10.138 1.00 0.00 O ATOM 2046 CB VAL A 133 5.565 -2.173 -12.203 1.00 0.00 C ATOM 2047 CG1 VAL A 133 6.916 -1.877 -12.826 1.00 0.00 C ATOM 2048 CG2 VAL A 133 5.018 -3.493 -12.731 1.00 0.00 C ATOM 0 H VAL A 133 6.398 -0.258 -10.693 1.00 0.00 H new ATOM 0 HA VAL A 133 4.692 -2.519 -10.279 1.00 0.00 H new ATOM 0 HB VAL A 133 4.882 -1.369 -12.477 1.00 0.00 H new ATOM 0 HG11 VAL A 133 6.818 -1.848 -13.911 1.00 0.00 H new ATOM 0 HG12 VAL A 133 7.278 -0.913 -12.468 1.00 0.00 H new ATOM 0 HG13 VAL A 133 7.624 -2.657 -12.547 1.00 0.00 H new ATOM 0 HG21 VAL A 133 4.949 -3.450 -13.818 1.00 0.00 H new ATOM 0 HG22 VAL A 133 5.685 -4.305 -12.442 1.00 0.00 H new ATOM 0 HG23 VAL A 133 4.028 -3.670 -12.312 1.00 0.00 H new ATOM 2058 N GLN A 134 7.980 -2.778 -10.095 1.00 0.00 N ATOM 2059 CA GLN A 134 9.039 -3.707 -9.709 1.00 0.00 C ATOM 2060 C GLN A 134 8.923 -4.014 -8.227 1.00 0.00 C ATOM 2061 O GLN A 134 9.171 -5.137 -7.788 1.00 0.00 O ATOM 2062 CB GLN A 134 10.434 -3.166 -10.039 1.00 0.00 C ATOM 2063 CG GLN A 134 10.601 -1.686 -9.770 1.00 0.00 C ATOM 2064 CD GLN A 134 11.993 -1.186 -10.104 1.00 0.00 C ATOM 2065 OE1 GLN A 134 12.941 -1.402 -9.349 1.00 0.00 O ATOM 2066 NE2 GLN A 134 12.122 -0.513 -11.242 1.00 0.00 N ATOM 0 H GLN A 134 8.269 -1.806 -10.204 1.00 0.00 H new ATOM 0 HA GLN A 134 8.912 -4.622 -10.287 1.00 0.00 H new ATOM 0 HB2 GLN A 134 11.173 -3.716 -9.456 1.00 0.00 H new ATOM 0 HB3 GLN A 134 10.648 -3.360 -11.090 1.00 0.00 H new ATOM 0 HG2 GLN A 134 9.869 -1.129 -10.355 1.00 0.00 H new ATOM 0 HG3 GLN A 134 10.389 -1.485 -8.720 1.00 0.00 H new ATOM 0 HE21 GLN A 134 11.309 -0.357 -11.837 1.00 0.00 H new ATOM 0 HE22 GLN A 134 13.034 -0.152 -11.520 1.00 0.00 H new ATOM 2075 N GLY A 135 8.509 -3.011 -7.464 1.00 0.00 N ATOM 2076 CA GLY A 135 8.330 -3.193 -6.043 1.00 0.00 C ATOM 2077 C GLY A 135 7.067 -3.969 -5.732 1.00 0.00 C ATOM 2078 O GLY A 135 6.926 -4.528 -4.645 1.00 0.00 O ATOM 0 H GLY A 135 8.295 -2.075 -7.807 1.00 0.00 H new ATOM 0 HA2 GLY A 135 9.191 -3.720 -5.632 1.00 0.00 H new ATOM 0 HA3 GLY A 135 8.289 -2.220 -5.554 1.00 0.00 H new ATOM 2082 N MET A 136 6.141 -4.012 -6.694 1.00 0.00 N ATOM 2083 CA MET A 136 4.888 -4.736 -6.504 1.00 0.00 C ATOM 2084 C MET A 136 4.962 -6.122 -7.139 1.00 0.00 C ATOM 2085 O MET A 136 4.423 -7.094 -6.607 1.00 0.00 O ATOM 2086 CB MET A 136 3.715 -3.942 -7.090 1.00 0.00 C ATOM 2087 CG MET A 136 3.606 -4.023 -8.605 1.00 0.00 C ATOM 2088 SD MET A 136 2.678 -5.467 -9.162 1.00 0.00 S ATOM 2089 CE MET A 136 1.106 -4.721 -9.580 1.00 0.00 C ATOM 0 H MET A 136 6.236 -3.558 -7.602 1.00 0.00 H new ATOM 0 HA MET A 136 4.725 -4.858 -5.433 1.00 0.00 H new ATOM 0 HB2 MET A 136 2.787 -4.307 -6.650 1.00 0.00 H new ATOM 0 HB3 MET A 136 3.816 -2.896 -6.799 1.00 0.00 H new ATOM 0 HG2 MET A 136 3.123 -3.120 -8.979 1.00 0.00 H new ATOM 0 HG3 MET A 136 4.607 -4.051 -9.036 1.00 0.00 H new ATOM 0 HE1 MET A 136 0.296 -5.332 -9.182 1.00 0.00 H new ATOM 0 HE2 MET A 136 1.052 -3.721 -9.150 1.00 0.00 H new ATOM 0 HE3 MET A 136 1.011 -4.655 -10.664 1.00 0.00 H new ATOM 2099 N LYS A 137 5.639 -6.199 -8.277 1.00 0.00 N ATOM 2100 CA LYS A 137 5.799 -7.458 -8.995 1.00 0.00 C ATOM 2101 C LYS A 137 6.804 -8.364 -8.285 1.00 0.00 C ATOM 2102 O LYS A 137 6.892 -9.558 -8.574 1.00 0.00 O ATOM 2103 CB LYS A 137 6.217 -7.205 -10.450 1.00 0.00 C ATOM 2104 CG LYS A 137 7.664 -6.776 -10.626 1.00 0.00 C ATOM 2105 CD LYS A 137 7.871 -6.033 -11.944 1.00 0.00 C ATOM 2106 CE LYS A 137 7.283 -6.794 -13.124 1.00 0.00 C ATOM 2107 NZ LYS A 137 6.087 -6.119 -13.698 1.00 0.00 N ATOM 0 H LYS A 137 6.088 -5.401 -8.725 1.00 0.00 H new ATOM 0 HA LYS A 137 4.836 -7.969 -9.006 1.00 0.00 H new ATOM 0 HB2 LYS A 137 6.049 -8.115 -11.026 1.00 0.00 H new ATOM 0 HB3 LYS A 137 5.570 -6.436 -10.872 1.00 0.00 H new ATOM 0 HG2 LYS A 137 7.958 -6.134 -9.795 1.00 0.00 H new ATOM 0 HG3 LYS A 137 8.311 -7.653 -10.596 1.00 0.00 H new ATOM 0 HD2 LYS A 137 7.409 -5.048 -11.881 1.00 0.00 H new ATOM 0 HD3 LYS A 137 8.937 -5.876 -12.108 1.00 0.00 H new ATOM 0 HE2 LYS A 137 8.043 -6.901 -13.898 1.00 0.00 H new ATOM 0 HE3 LYS A 137 7.010 -7.800 -12.804 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 5.694 -6.702 -14.465 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 5.369 -5.994 -12.956 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 6.361 -5.189 -14.075 1.00 0.00 H new ATOM 2121 N GLU A 138 7.553 -7.790 -7.344 1.00 0.00 N ATOM 2122 CA GLU A 138 8.540 -8.541 -6.578 1.00 0.00 C ATOM 2123 C GLU A 138 8.000 -8.857 -5.193 1.00 0.00 C ATOM 2124 O GLU A 138 7.923 -10.019 -4.792 1.00 0.00 O ATOM 2125 CB GLU A 138 9.847 -7.752 -6.461 1.00 0.00 C ATOM 2126 CG GLU A 138 11.083 -8.633 -6.396 1.00 0.00 C ATOM 2127 CD GLU A 138 12.146 -8.079 -5.470 1.00 0.00 C ATOM 2128 OE1 GLU A 138 11.834 -7.838 -4.284 1.00 0.00 O ATOM 2129 OE2 GLU A 138 13.292 -7.883 -5.928 1.00 0.00 O ATOM 0 H GLU A 138 7.492 -6.803 -7.095 1.00 0.00 H new ATOM 0 HA GLU A 138 8.743 -9.475 -7.103 1.00 0.00 H new ATOM 0 HB2 GLU A 138 9.934 -7.080 -7.315 1.00 0.00 H new ATOM 0 HB3 GLU A 138 9.807 -7.129 -5.568 1.00 0.00 H new ATOM 0 HG2 GLU A 138 10.797 -9.629 -6.059 1.00 0.00 H new ATOM 0 HG3 GLU A 138 11.500 -8.742 -7.397 1.00 0.00 H new ATOM 2136 N ALA A 139 7.608 -7.813 -4.471 1.00 0.00 N ATOM 2137 CA ALA A 139 7.050 -7.976 -3.132 1.00 0.00 C ATOM 2138 C ALA A 139 5.906 -8.979 -3.156 1.00 0.00 C ATOM 2139 O ALA A 139 5.626 -9.651 -2.165 1.00 0.00 O ATOM 2140 CB ALA A 139 6.562 -6.640 -2.592 1.00 0.00 C ATOM 0 H ALA A 139 7.666 -6.846 -4.789 1.00 0.00 H new ATOM 0 HA ALA A 139 7.834 -8.352 -2.475 1.00 0.00 H new ATOM 0 HB1 ALA A 139 6.149 -6.780 -1.593 1.00 0.00 H new ATOM 0 HB2 ALA A 139 7.396 -5.940 -2.545 1.00 0.00 H new ATOM 0 HB3 ALA A 139 5.790 -6.241 -3.251 1.00 0.00 H new ATOM 2146 N GLN A 140 5.248 -9.067 -4.305 1.00 0.00 N ATOM 2147 CA GLN A 140 4.131 -9.974 -4.485 1.00 0.00 C ATOM 2148 C GLN A 140 4.561 -11.435 -4.352 1.00 0.00 C ATOM 2149 O GLN A 140 3.721 -12.324 -4.214 1.00 0.00 O ATOM 2150 CB GLN A 140 3.492 -9.740 -5.852 1.00 0.00 C ATOM 2151 CG GLN A 140 4.476 -9.808 -7.007 1.00 0.00 C ATOM 2152 CD GLN A 140 4.656 -11.216 -7.541 1.00 0.00 C ATOM 2153 OE1 GLN A 140 5.777 -11.718 -7.636 1.00 0.00 O ATOM 2154 NE2 GLN A 140 3.552 -11.859 -7.898 1.00 0.00 N ATOM 0 H GLN A 140 5.475 -8.514 -5.131 1.00 0.00 H new ATOM 0 HA GLN A 140 3.404 -9.771 -3.699 1.00 0.00 H new ATOM 0 HB2 GLN A 140 2.710 -10.482 -6.009 1.00 0.00 H new ATOM 0 HB3 GLN A 140 3.009 -8.763 -5.855 1.00 0.00 H new ATOM 0 HG2 GLN A 140 4.130 -9.160 -7.812 1.00 0.00 H new ATOM 0 HG3 GLN A 140 5.441 -9.422 -6.680 1.00 0.00 H new ATOM 0 HE21 GLN A 140 2.644 -11.405 -7.802 1.00 0.00 H new ATOM 0 HE22 GLN A 140 3.611 -12.808 -8.268 1.00 0.00 H new ATOM 2163 N GLU A 141 5.869 -11.685 -4.404 1.00 0.00 N ATOM 2164 CA GLU A 141 6.387 -13.046 -4.299 1.00 0.00 C ATOM 2165 C GLU A 141 7.131 -13.268 -2.980 1.00 0.00 C ATOM 2166 O GLU A 141 7.086 -14.360 -2.412 1.00 0.00 O ATOM 2167 CB GLU A 141 7.294 -13.354 -5.502 1.00 0.00 C ATOM 2168 CG GLU A 141 8.744 -13.616 -5.141 1.00 0.00 C ATOM 2169 CD GLU A 141 9.676 -13.487 -6.330 1.00 0.00 C ATOM 2170 OE1 GLU A 141 9.778 -12.373 -6.885 1.00 0.00 O ATOM 2171 OE2 GLU A 141 10.302 -14.501 -6.706 1.00 0.00 O ATOM 0 H GLU A 141 6.584 -10.967 -4.518 1.00 0.00 H new ATOM 0 HA GLU A 141 5.542 -13.734 -4.308 1.00 0.00 H new ATOM 0 HB2 GLU A 141 6.899 -14.225 -6.026 1.00 0.00 H new ATOM 0 HB3 GLU A 141 7.251 -12.516 -6.198 1.00 0.00 H new ATOM 0 HG2 GLU A 141 9.053 -12.916 -4.365 1.00 0.00 H new ATOM 0 HG3 GLU A 141 8.834 -14.618 -4.721 1.00 0.00 H new ATOM 2178 N ARG A 142 7.822 -12.239 -2.500 1.00 0.00 N ATOM 2179 CA ARG A 142 8.579 -12.346 -1.255 1.00 0.00 C ATOM 2180 C ARG A 142 7.708 -12.025 -0.044 1.00 0.00 C ATOM 2181 O ARG A 142 7.791 -12.698 0.983 1.00 0.00 O ATOM 2182 CB ARG A 142 9.792 -11.413 -1.288 1.00 0.00 C ATOM 2183 CG ARG A 142 9.438 -9.961 -1.566 1.00 0.00 C ATOM 2184 CD ARG A 142 10.635 -9.048 -1.355 1.00 0.00 C ATOM 2185 NE ARG A 142 11.785 -9.459 -2.157 1.00 0.00 N ATOM 2186 CZ ARG A 142 13.024 -9.017 -1.956 1.00 0.00 C ATOM 2187 NH1 ARG A 142 13.278 -8.154 -0.980 1.00 0.00 N ATOM 2188 NH2 ARG A 142 14.012 -9.442 -2.732 1.00 0.00 N ATOM 0 H ARG A 142 7.874 -11.325 -2.951 1.00 0.00 H new ATOM 0 HA ARG A 142 8.921 -13.377 -1.163 1.00 0.00 H new ATOM 0 HB2 ARG A 142 10.313 -11.474 -0.332 1.00 0.00 H new ATOM 0 HB3 ARG A 142 10.487 -11.761 -2.052 1.00 0.00 H new ATOM 0 HG2 ARG A 142 9.079 -9.862 -2.591 1.00 0.00 H new ATOM 0 HG3 ARG A 142 8.623 -9.652 -0.912 1.00 0.00 H new ATOM 0 HD2 ARG A 142 10.361 -8.025 -1.612 1.00 0.00 H new ATOM 0 HD3 ARG A 142 10.910 -9.048 -0.300 1.00 0.00 H new ATOM 0 HE ARG A 142 11.629 -10.123 -2.915 1.00 0.00 H new ATOM 0 HH11 ARG A 142 12.522 -7.826 -0.379 1.00 0.00 H new ATOM 0 HH12 ARG A 142 14.230 -7.819 -0.831 1.00 0.00 H new ATOM 0 HH21 ARG A 142 13.822 -10.107 -3.482 1.00 0.00 H new ATOM 0 HH22 ARG A 142 14.962 -9.104 -2.579 1.00 0.00 H new ATOM 2202 N LEU A 143 6.881 -10.995 -0.168 1.00 0.00 N ATOM 2203 CA LEU A 143 6.002 -10.586 0.920 1.00 0.00 C ATOM 2204 C LEU A 143 4.898 -11.614 1.149 1.00 0.00 C ATOM 2205 O LEU A 143 4.402 -11.769 2.264 1.00 0.00 O ATOM 2206 CB LEU A 143 5.394 -9.216 0.620 1.00 0.00 C ATOM 2207 CG LEU A 143 4.648 -8.571 1.789 1.00 0.00 C ATOM 2208 CD1 LEU A 143 5.531 -8.519 3.026 1.00 0.00 C ATOM 2209 CD2 LEU A 143 4.175 -7.176 1.409 1.00 0.00 C ATOM 0 H LEU A 143 6.800 -10.427 -1.012 1.00 0.00 H new ATOM 0 HA LEU A 143 6.597 -10.519 1.831 1.00 0.00 H new ATOM 0 HB2 LEU A 143 6.190 -8.544 0.301 1.00 0.00 H new ATOM 0 HB3 LEU A 143 4.706 -9.316 -0.220 1.00 0.00 H new ATOM 0 HG LEU A 143 3.775 -9.181 2.020 1.00 0.00 H new ATOM 0 HD11 LEU A 143 4.982 -8.057 3.846 1.00 0.00 H new ATOM 0 HD12 LEU A 143 5.821 -9.531 3.309 1.00 0.00 H new ATOM 0 HD13 LEU A 143 6.424 -7.932 2.811 1.00 0.00 H new ATOM 0 HD21 LEU A 143 3.646 -6.729 2.251 1.00 0.00 H new ATOM 0 HD22 LEU A 143 5.035 -6.558 1.152 1.00 0.00 H new ATOM 0 HD23 LEU A 143 3.505 -7.240 0.552 1.00 0.00 H new ATOM 2221 N THR A 144 4.516 -12.316 0.085 1.00 0.00 N ATOM 2222 CA THR A 144 3.475 -13.329 0.174 1.00 0.00 C ATOM 2223 C THR A 144 3.954 -14.534 0.975 1.00 0.00 C ATOM 2224 O THR A 144 4.800 -15.302 0.515 1.00 0.00 O ATOM 2225 CB THR A 144 3.053 -13.766 -1.226 1.00 0.00 C ATOM 2226 OG1 THR A 144 4.186 -14.065 -2.022 1.00 0.00 O ATOM 2227 CG2 THR A 144 2.239 -12.721 -1.960 1.00 0.00 C ATOM 0 H THR A 144 4.913 -12.200 -0.847 1.00 0.00 H new ATOM 0 HA THR A 144 2.618 -12.896 0.690 1.00 0.00 H new ATOM 0 HB THR A 144 2.431 -14.649 -1.077 1.00 0.00 H new ATOM 0 HG1 THR A 144 4.171 -13.514 -2.832 1.00 0.00 H new ATOM 0 HG21 THR A 144 1.972 -13.096 -2.948 1.00 0.00 H new ATOM 0 HG22 THR A 144 1.331 -12.505 -1.396 1.00 0.00 H new ATOM 0 HG23 THR A 144 2.827 -11.809 -2.064 1.00 0.00 H new ATOM 2235 N GLY A 145 3.407 -14.695 2.175 1.00 0.00 N ATOM 2236 CA GLY A 145 3.791 -15.808 3.022 1.00 0.00 C ATOM 2237 C GLY A 145 4.672 -15.376 4.178 1.00 0.00 C ATOM 2238 O GLY A 145 4.175 -14.948 5.220 1.00 0.00 O ATOM 0 H GLY A 145 2.704 -14.074 2.576 1.00 0.00 H new ATOM 0 HA2 GLY A 145 2.895 -16.291 3.412 1.00 0.00 H new ATOM 0 HA3 GLY A 145 4.319 -16.551 2.424 1.00 0.00 H new ATOM 2242 N ASP A 146 5.984 -15.490 3.996 1.00 0.00 N ATOM 2243 CA ASP A 146 6.935 -15.108 5.033 1.00 0.00 C ATOM 2244 C ASP A 146 8.351 -15.033 4.473 1.00 0.00 C ATOM 2245 O ASP A 146 9.324 -15.309 5.176 1.00 0.00 O ATOM 2246 CB ASP A 146 6.884 -16.104 6.194 1.00 0.00 C ATOM 2247 CG ASP A 146 5.889 -15.695 7.263 1.00 0.00 C ATOM 2248 OD1 ASP A 146 5.918 -14.518 7.680 1.00 0.00 O ATOM 2249 OD2 ASP A 146 5.083 -16.551 7.681 1.00 0.00 O ATOM 0 H ASP A 146 6.412 -15.844 3.140 1.00 0.00 H new ATOM 0 HA ASP A 146 6.657 -14.120 5.399 1.00 0.00 H new ATOM 0 HB2 ASP A 146 6.618 -17.090 5.812 1.00 0.00 H new ATOM 0 HB3 ASP A 146 7.875 -16.191 6.638 1.00 0.00 H new ATOM 2254 N ALA A 147 8.463 -14.654 3.204 1.00 0.00 N ATOM 2255 CA ALA A 147 9.762 -14.539 2.552 1.00 0.00 C ATOM 2256 C ALA A 147 10.261 -13.095 2.572 1.00 0.00 C ATOM 2257 O ALA A 147 11.100 -12.709 1.758 1.00 0.00 O ATOM 2258 CB ALA A 147 9.681 -15.051 1.123 1.00 0.00 C ATOM 0 H ALA A 147 7.670 -14.421 2.607 1.00 0.00 H new ATOM 0 HA ALA A 147 10.475 -15.150 3.106 1.00 0.00 H new ATOM 0 HB1 ALA A 147 10.658 -14.959 0.648 1.00 0.00 H new ATOM 0 HB2 ALA A 147 9.377 -16.098 1.128 1.00 0.00 H new ATOM 0 HB3 ALA A 147 8.950 -14.464 0.567 1.00 0.00 H new ATOM 2264 N PHE A 148 9.737 -12.303 3.501 1.00 0.00 N ATOM 2265 CA PHE A 148 10.127 -10.904 3.624 1.00 0.00 C ATOM 2266 C PHE A 148 10.811 -10.637 4.963 1.00 0.00 C ATOM 2267 O PHE A 148 11.633 -9.729 5.080 1.00 0.00 O ATOM 2268 CB PHE A 148 8.902 -9.999 3.478 1.00 0.00 C ATOM 2269 CG PHE A 148 7.793 -10.334 4.433 1.00 0.00 C ATOM 2270 CD1 PHE A 148 6.931 -11.389 4.174 1.00 0.00 C ATOM 2271 CD2 PHE A 148 7.611 -9.595 5.590 1.00 0.00 C ATOM 2272 CE1 PHE A 148 5.910 -11.698 5.052 1.00 0.00 C ATOM 2273 CE2 PHE A 148 6.592 -9.899 6.472 1.00 0.00 C ATOM 2274 CZ PHE A 148 5.740 -10.953 6.202 1.00 0.00 C ATOM 0 H PHE A 148 9.040 -12.607 4.181 1.00 0.00 H new ATOM 0 HA PHE A 148 10.837 -10.683 2.827 1.00 0.00 H new ATOM 0 HB2 PHE A 148 9.205 -8.963 3.634 1.00 0.00 H new ATOM 0 HB3 PHE A 148 8.526 -10.071 2.457 1.00 0.00 H new ATOM 0 HD1 PHE A 148 7.059 -11.975 3.276 1.00 0.00 H new ATOM 0 HD2 PHE A 148 8.274 -8.770 5.806 1.00 0.00 H new ATOM 0 HE1 PHE A 148 5.245 -12.522 4.839 1.00 0.00 H new ATOM 0 HE2 PHE A 148 6.462 -9.314 7.371 1.00 0.00 H new ATOM 0 HZ PHE A 148 4.942 -11.194 6.889 1.00 0.00 H new ATOM 2284 N ARG A 149 10.466 -11.433 5.972 1.00 0.00 N ATOM 2285 CA ARG A 149 11.041 -11.283 7.301 1.00 0.00 C ATOM 2286 C ARG A 149 12.564 -11.306 7.250 1.00 0.00 C ATOM 2287 O ARG A 149 13.222 -10.303 7.528 1.00 0.00 O ATOM 2288 CB ARG A 149 10.530 -12.393 8.220 1.00 0.00 C ATOM 2289 CG ARG A 149 9.031 -12.625 8.119 1.00 0.00 C ATOM 2290 CD ARG A 149 8.484 -13.302 9.367 1.00 0.00 C ATOM 2291 NE ARG A 149 7.455 -12.495 10.020 1.00 0.00 N ATOM 2292 CZ ARG A 149 6.572 -12.981 10.889 1.00 0.00 C ATOM 2293 NH1 ARG A 149 6.588 -14.269 11.213 1.00 0.00 N ATOM 2294 NH2 ARG A 149 5.670 -12.178 11.435 1.00 0.00 N ATOM 0 H ARG A 149 9.788 -12.191 5.891 1.00 0.00 H new ATOM 0 HA ARG A 149 10.731 -10.316 7.697 1.00 0.00 H new ATOM 0 HB2 ARG A 149 11.050 -13.320 7.979 1.00 0.00 H new ATOM 0 HB3 ARG A 149 10.782 -12.145 9.251 1.00 0.00 H new ATOM 0 HG2 ARG A 149 8.524 -11.672 7.969 1.00 0.00 H new ATOM 0 HG3 ARG A 149 8.816 -13.241 7.246 1.00 0.00 H new ATOM 0 HD2 ARG A 149 8.068 -14.273 9.100 1.00 0.00 H new ATOM 0 HD3 ARG A 149 9.299 -13.486 10.067 1.00 0.00 H new ATOM 0 HE ARG A 149 7.411 -11.501 9.796 1.00 0.00 H new ATOM 0 HH11 ARG A 149 7.280 -14.891 10.795 1.00 0.00 H new ATOM 0 HH12 ARG A 149 5.909 -14.636 11.880 1.00 0.00 H new ATOM 0 HH21 ARG A 149 5.653 -11.188 11.189 1.00 0.00 H new ATOM 0 HH22 ARG A 149 4.993 -12.550 12.101 1.00 0.00 H new ATOM 2308 N LYS A 150 13.118 -12.458 6.895 1.00 0.00 N ATOM 2309 CA LYS A 150 14.564 -12.617 6.808 1.00 0.00 C ATOM 2310 C LYS A 150 14.939 -13.638 5.741 1.00 0.00 C ATOM 2311 O LYS A 150 15.471 -13.287 4.688 1.00 0.00 O ATOM 2312 CB LYS A 150 15.134 -13.040 8.164 1.00 0.00 C ATOM 2313 CG LYS A 150 16.414 -12.313 8.541 1.00 0.00 C ATOM 2314 CD LYS A 150 16.871 -12.682 9.942 1.00 0.00 C ATOM 2315 CE LYS A 150 17.872 -11.675 10.486 1.00 0.00 C ATOM 2316 NZ LYS A 150 17.733 -11.493 11.958 1.00 0.00 N ATOM 0 H LYS A 150 12.587 -13.297 6.662 1.00 0.00 H new ATOM 0 HA LYS A 150 14.993 -11.655 6.526 1.00 0.00 H new ATOM 0 HB2 LYS A 150 14.384 -12.862 8.935 1.00 0.00 H new ATOM 0 HB3 LYS A 150 15.327 -14.113 8.149 1.00 0.00 H new ATOM 0 HG2 LYS A 150 17.198 -12.559 7.825 1.00 0.00 H new ATOM 0 HG3 LYS A 150 16.254 -11.237 8.481 1.00 0.00 H new ATOM 0 HD2 LYS A 150 16.008 -12.733 10.606 1.00 0.00 H new ATOM 0 HD3 LYS A 150 17.322 -13.674 9.929 1.00 0.00 H new ATOM 0 HE2 LYS A 150 18.884 -12.008 10.255 1.00 0.00 H new ATOM 0 HE3 LYS A 150 17.730 -10.716 9.987 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 18.433 -10.799 12.290 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 16.776 -11.151 12.177 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 17.893 -12.402 12.437 1.00 0.00 H new ATOM 2330 N LYS A 151 14.659 -14.902 6.024 1.00 0.00 N ATOM 2331 CA LYS A 151 14.966 -15.982 5.094 1.00 0.00 C ATOM 2332 C LYS A 151 13.693 -16.686 4.635 1.00 0.00 C ATOM 2333 O LYS A 151 12.624 -16.500 5.216 1.00 0.00 O ATOM 2334 CB LYS A 151 15.910 -16.994 5.747 1.00 0.00 C ATOM 2335 CG LYS A 151 17.265 -16.413 6.120 1.00 0.00 C ATOM 2336 CD LYS A 151 17.760 -16.967 7.446 1.00 0.00 C ATOM 2337 CE LYS A 151 18.575 -18.236 7.251 1.00 0.00 C ATOM 2338 NZ LYS A 151 18.882 -18.904 8.546 1.00 0.00 N ATOM 0 H LYS A 151 14.219 -15.207 6.892 1.00 0.00 H new ATOM 0 HA LYS A 151 15.455 -15.546 4.223 1.00 0.00 H new ATOM 0 HB2 LYS A 151 15.436 -17.393 6.644 1.00 0.00 H new ATOM 0 HB3 LYS A 151 16.059 -17.831 5.065 1.00 0.00 H new ATOM 0 HG2 LYS A 151 17.988 -16.640 5.337 1.00 0.00 H new ATOM 0 HG3 LYS A 151 17.192 -15.327 6.182 1.00 0.00 H new ATOM 0 HD2 LYS A 151 18.369 -16.217 7.950 1.00 0.00 H new ATOM 0 HD3 LYS A 151 16.909 -17.176 8.094 1.00 0.00 H new ATOM 0 HE2 LYS A 151 18.026 -18.925 6.609 1.00 0.00 H new ATOM 0 HE3 LYS A 151 19.506 -17.994 6.738 1.00 0.00 H new ATOM 0 HZ1 LYS A 151 19.439 -19.765 8.369 1.00 0.00 H new ATOM 0 HZ2 LYS A 151 19.428 -18.257 9.150 1.00 0.00 H new ATOM 0 HZ3 LYS A 151 17.994 -19.158 9.025 1.00 0.00 H new ATOM 2352 N HIS A 152 13.818 -17.498 3.591 1.00 0.00 N ATOM 2353 CA HIS A 152 12.680 -18.233 3.052 1.00 0.00 C ATOM 2354 C HIS A 152 12.630 -19.651 3.614 1.00 0.00 C ATOM 2355 O HIS A 152 13.656 -20.211 4.005 1.00 0.00 O ATOM 2356 CB HIS A 152 12.746 -18.279 1.524 1.00 0.00 C ATOM 2357 CG HIS A 152 14.045 -18.800 0.996 1.00 0.00 C ATOM 2358 ND1 HIS A 152 15.000 -19.392 1.795 1.00 0.00 N ATOM 2359 CD2 HIS A 152 14.548 -18.817 -0.262 1.00 0.00 C ATOM 2360 CE1 HIS A 152 16.032 -19.747 1.056 1.00 0.00 C ATOM 2361 NE2 HIS A 152 15.784 -19.411 -0.196 1.00 0.00 N ATOM 0 H HIS A 152 14.697 -17.664 3.101 1.00 0.00 H new ATOM 0 HA HIS A 152 11.772 -17.710 3.351 1.00 0.00 H new ATOM 0 HB2 HIS A 152 11.935 -18.905 1.152 1.00 0.00 H new ATOM 0 HB3 HIS A 152 12.580 -17.276 1.131 1.00 0.00 H new ATOM 0 HD1 HIS A 152 14.920 -19.533 2.802 1.00 0.00 H new ATOM 0 HD2 HIS A 152 14.067 -18.435 -1.150 1.00 0.00 H new ATOM 0 HE1 HIS A 152 16.929 -20.231 1.414 1.00 0.00 H new ATOM 2370 N LEU A 153 11.433 -20.226 3.653 1.00 0.00 N ATOM 2371 CA LEU A 153 11.250 -21.578 4.168 1.00 0.00 C ATOM 2372 C LEU A 153 10.074 -22.266 3.482 1.00 0.00 C ATOM 2373 O LEU A 153 9.148 -21.607 3.005 1.00 0.00 O ATOM 2374 CB LEU A 153 11.031 -21.544 5.683 1.00 0.00 C ATOM 2375 CG LEU A 153 12.001 -22.402 6.497 1.00 0.00 C ATOM 2376 CD1 LEU A 153 11.858 -23.869 6.124 1.00 0.00 C ATOM 2377 CD2 LEU A 153 13.432 -21.934 6.283 1.00 0.00 C ATOM 0 H LEU A 153 10.575 -19.777 3.334 1.00 0.00 H new ATOM 0 HA LEU A 153 12.154 -22.149 3.954 1.00 0.00 H new ATOM 0 HB2 LEU A 153 11.110 -20.511 6.023 1.00 0.00 H new ATOM 0 HB3 LEU A 153 10.014 -21.872 5.895 1.00 0.00 H new ATOM 0 HG LEU A 153 11.756 -22.291 7.553 1.00 0.00 H new ATOM 0 HD11 LEU A 153 12.556 -24.464 6.713 1.00 0.00 H new ATOM 0 HD12 LEU A 153 10.839 -24.198 6.327 1.00 0.00 H new ATOM 0 HD13 LEU A 153 12.076 -23.998 5.064 1.00 0.00 H new ATOM 0 HD21 LEU A 153 14.109 -22.555 6.869 1.00 0.00 H new ATOM 0 HD22 LEU A 153 13.687 -22.016 5.227 1.00 0.00 H new ATOM 0 HD23 LEU A 153 13.526 -20.895 6.600 1.00 0.00 H new ATOM 2389 N GLU A 154 10.115 -23.593 3.436 1.00 0.00 N ATOM 2390 CA GLU A 154 9.053 -24.370 2.806 1.00 0.00 C ATOM 2391 C GLU A 154 8.940 -24.034 1.323 1.00 0.00 C ATOM 2392 O GLU A 154 8.458 -22.964 0.953 1.00 0.00 O ATOM 2393 CB GLU A 154 7.716 -24.106 3.505 1.00 0.00 C ATOM 2394 CG GLU A 154 6.829 -25.336 3.607 1.00 0.00 C ATOM 2395 CD GLU A 154 5.512 -25.170 2.876 1.00 0.00 C ATOM 2396 OE1 GLU A 154 5.524 -25.151 1.627 1.00 0.00 O ATOM 2397 OE2 GLU A 154 4.468 -25.057 3.552 1.00 0.00 O ATOM 0 H GLU A 154 10.872 -24.153 3.827 1.00 0.00 H new ATOM 0 HA GLU A 154 9.303 -25.427 2.902 1.00 0.00 H new ATOM 0 HB2 GLU A 154 7.909 -23.723 4.507 1.00 0.00 H new ATOM 0 HB3 GLU A 154 7.180 -23.326 2.964 1.00 0.00 H new ATOM 0 HG2 GLU A 154 7.360 -26.196 3.200 1.00 0.00 H new ATOM 0 HG3 GLU A 154 6.632 -25.551 4.657 1.00 0.00 H new ATOM 2404 N ASP A 155 9.389 -24.955 0.478 1.00 0.00 N ATOM 2405 CA ASP A 155 9.341 -24.757 -0.966 1.00 0.00 C ATOM 2406 C ASP A 155 7.900 -24.737 -1.464 1.00 0.00 C ATOM 2407 O ASP A 155 6.968 -25.036 -0.717 1.00 0.00 O ATOM 2408 CB ASP A 155 10.125 -25.859 -1.680 1.00 0.00 C ATOM 2409 CG ASP A 155 9.630 -27.246 -1.320 1.00 0.00 C ATOM 2410 OD1 ASP A 155 8.565 -27.649 -1.832 1.00 0.00 O ATOM 2411 OD2 ASP A 155 10.311 -27.931 -0.526 1.00 0.00 O ATOM 0 H ASP A 155 9.791 -25.847 0.768 1.00 0.00 H new ATOM 0 HA ASP A 155 9.798 -23.793 -1.191 1.00 0.00 H new ATOM 0 HB2 ASP A 155 10.047 -25.717 -2.758 1.00 0.00 H new ATOM 0 HB3 ASP A 155 11.181 -25.775 -1.423 1.00 0.00 H new ATOM 2416 N GLU A 156 7.724 -24.383 -2.734 1.00 0.00 N ATOM 2417 CA GLU A 156 6.397 -24.324 -3.335 1.00 0.00 C ATOM 2418 C GLU A 156 6.106 -25.590 -4.135 1.00 0.00 C ATOM 2419 O GLU A 156 5.164 -26.325 -3.835 1.00 0.00 O ATOM 2420 CB GLU A 156 6.278 -23.093 -4.237 1.00 0.00 C ATOM 2421 CG GLU A 156 5.322 -22.039 -3.702 1.00 0.00 C ATOM 2422 CD GLU A 156 3.881 -22.514 -3.684 1.00 0.00 C ATOM 2423 OE1 GLU A 156 3.200 -22.386 -4.723 1.00 0.00 O ATOM 2424 OE2 GLU A 156 3.436 -23.017 -2.631 1.00 0.00 O ATOM 0 H GLU A 156 8.484 -24.133 -3.366 1.00 0.00 H new ATOM 0 HA GLU A 156 5.663 -24.248 -2.533 1.00 0.00 H new ATOM 0 HB2 GLU A 156 7.265 -22.647 -4.362 1.00 0.00 H new ATOM 0 HB3 GLU A 156 5.943 -23.408 -5.225 1.00 0.00 H new ATOM 0 HG2 GLU A 156 5.622 -21.761 -2.692 1.00 0.00 H new ATOM 0 HG3 GLU A 156 5.397 -21.141 -4.315 1.00 0.00 H new ATOM 2431 N LEU A 157 6.921 -25.839 -5.156 1.00 0.00 N ATOM 2432 CA LEU A 157 6.750 -27.016 -5.999 1.00 0.00 C ATOM 2433 C LEU A 157 7.837 -28.049 -5.713 1.00 0.00 C ATOM 2434 O LEU A 157 7.488 -29.172 -5.291 1.00 0.00 O ATOM 2435 CB LEU A 157 6.779 -26.617 -7.478 1.00 0.00 C ATOM 2436 CG LEU A 157 5.488 -26.897 -8.247 1.00 0.00 C ATOM 2437 CD1 LEU A 157 4.515 -25.737 -8.097 1.00 0.00 C ATOM 2438 CD2 LEU A 157 5.789 -27.156 -9.716 1.00 0.00 C ATOM 2439 OXT LEU A 157 9.027 -27.727 -5.915 1.00 0.00 O ATOM 0 H LEU A 157 7.705 -25.242 -5.419 1.00 0.00 H new ATOM 0 HA LEU A 157 5.782 -27.462 -5.771 1.00 0.00 H new ATOM 0 HB2 LEU A 157 7.002 -25.552 -7.547 1.00 0.00 H new ATOM 0 HB3 LEU A 157 7.597 -27.147 -7.966 1.00 0.00 H new ATOM 0 HG LEU A 157 5.024 -27.790 -7.828 1.00 0.00 H new ATOM 0 HD11 LEU A 157 3.602 -25.954 -8.651 1.00 0.00 H new ATOM 0 HD12 LEU A 157 4.275 -25.597 -7.043 1.00 0.00 H new ATOM 0 HD13 LEU A 157 4.970 -24.827 -8.489 1.00 0.00 H new ATOM 0 HD21 LEU A 157 4.859 -27.354 -10.249 1.00 0.00 H new ATOM 0 HD22 LEU A 157 6.275 -26.281 -10.147 1.00 0.00 H new ATOM 0 HD23 LEU A 157 6.449 -28.019 -9.806 1.00 0.00 H new TER 2451 LEU A 157