USER MOD reduce.3.24.130724 H: found=0, std=0, add=1098, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1101 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 65 THR OG1 : rot 180:sc=-0.00633 USER MOD Set 1.2: A 74 SER OG : rot 29:sc= 0.0768 USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 CYS SG : rot 66:sc= 0.372 USER MOD Single : A 14 TYR OH : rot 130:sc= -0.727 USER MOD Single : A 15 ASN : amide:sc= 0.872 K(o=0.87,f=0) USER MOD Single : A 22 SER OG : rot -52:sc= 0.139 USER MOD Single : A 28 THR OG1 : rot -120:sc= -1.17 USER MOD Single : A 30 LYS NZ :NH3+ 165:sc= 1.09 (180deg=0.936) USER MOD Single : A 31 TYR OH : rot 123:sc= 0.0963 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 170:sc= -0.124 USER MOD Single : A 41 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 45 TYR OH : rot -80:sc= 1.34 USER MOD Single : A 46 GLN : amide:sc= -0.218 X(o=-0.22,f=-0.05) USER MOD Single : A 47 HIS : no HD1:sc= -0.148 X(o=-0.15,f=-0.38) USER MOD Single : A 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 51 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 52 CYS SG : rot 150:sc= 1.83 USER MOD Single : A 53 THR OG1 : rot 180:sc= 0.0361 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 MET CE :methyl -111:sc= -1.35 (180deg=-1.51) USER MOD Single : A 71 SER OG : rot 27:sc= 0.107 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 THR OG1 : rot -98:sc= 0.347 USER MOD Single : A 85 ASN : amide:sc= -0.0221 X(o=-0.022,f=0) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 90 GLN : amide:sc= -0.556 X(o=-0.56,f=-0.71) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 THR OG1 : rot 23:sc=-0.00613 USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 LYS NZ :NH3+ -120:sc= 0 (180deg=-0.641) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ -113:sc= 0.977 (180deg=-0.061) USER MOD Single : A 106 GLN : amide:sc= 0.463 X(o=0.46,f=0) USER MOD Single : A 107 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 110 LYS NZ :NH3+ -164:sc= 0.235 (180deg=-0.305!) USER MOD Single : A 115 SER OG : rot 67:sc= 1.25 USER MOD Single : A 118 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0243) USER MOD Single : A 123 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 126 LYS NZ :NH3+ -123:sc= 0.682 (180deg=-0.000497) USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 LYS NZ :NH3+ -153:sc= 0.0241 (180deg=-0.971!) USER MOD Single : A 136 ASN : amide:sc= -0.278 X(o=-0.28,f=-0.012) USER MOD Single : A 137 TYR OH : rot 180:sc= 0 USER MOD Single : A 140 GLN : amide:sc= -0.237 X(o=-0.24,f=-0.01) USER MOD Single : A 141 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 2 -1.598 -20.884 -10.970 1.00 0.00 N ATOM 2 CA ALA A 2 -2.538 -19.824 -11.427 1.00 0.00 C ATOM 3 C ALA A 2 -2.696 -18.730 -10.373 1.00 0.00 C ATOM 4 O ALA A 2 -2.460 -18.960 -9.185 1.00 0.00 O ATOM 5 CB ALA A 2 -3.894 -20.430 -11.759 1.00 0.00 C ATOM 0 HA ALA A 2 -2.119 -19.370 -12.325 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -4.572 -19.644 -12.092 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -3.778 -21.169 -12.552 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -4.305 -20.911 -10.871 1.00 0.00 H new ATOM 13 N THR A 3 -3.102 -17.542 -10.818 1.00 0.00 N ATOM 14 CA THR A 3 -3.301 -16.409 -9.920 1.00 0.00 C ATOM 15 C THR A 3 -4.640 -15.730 -10.201 1.00 0.00 C ATOM 16 O THR A 3 -4.841 -15.157 -11.273 1.00 0.00 O ATOM 17 CB THR A 3 -2.160 -15.400 -10.070 1.00 0.00 C ATOM 18 OG1 THR A 3 -0.903 -16.054 -10.053 1.00 0.00 O ATOM 19 CG2 THR A 3 -2.146 -14.350 -8.981 1.00 0.00 C ATOM 0 H THR A 3 -3.300 -17.340 -11.798 1.00 0.00 H new ATOM 0 HA THR A 3 -3.307 -16.783 -8.896 1.00 0.00 H new ATOM 0 HB THR A 3 -2.334 -14.908 -11.027 1.00 0.00 H new ATOM 0 HG1 THR A 3 -0.188 -15.391 -10.152 1.00 0.00 H new ATOM 0 HG21 THR A 3 -1.313 -13.666 -9.146 1.00 0.00 H new ATOM 0 HG22 THR A 3 -3.083 -13.793 -9.001 1.00 0.00 H new ATOM 0 HG23 THR A 3 -2.032 -14.834 -8.011 1.00 0.00 H new ATOM 27 N LYS A 4 -5.555 -15.807 -9.236 1.00 0.00 N ATOM 28 CA LYS A 4 -6.877 -15.206 -9.385 1.00 0.00 C ATOM 29 C LYS A 4 -6.994 -13.908 -8.590 1.00 0.00 C ATOM 30 O LYS A 4 -6.259 -13.687 -7.626 1.00 0.00 O ATOM 31 CB LYS A 4 -7.962 -16.189 -8.936 1.00 0.00 C ATOM 32 CG LYS A 4 -8.846 -16.678 -10.073 1.00 0.00 C ATOM 33 CD LYS A 4 -10.163 -17.240 -9.559 1.00 0.00 C ATOM 34 CE LYS A 4 -10.612 -18.443 -10.375 1.00 0.00 C ATOM 35 NZ LYS A 4 -12.076 -18.692 -10.247 1.00 0.00 N ATOM 0 H LYS A 4 -5.404 -16.279 -8.344 1.00 0.00 H new ATOM 0 HA LYS A 4 -7.016 -14.972 -10.440 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -7.489 -17.047 -8.459 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -8.586 -15.710 -8.182 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -9.045 -15.855 -10.760 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -8.319 -17.446 -10.640 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -10.053 -17.529 -8.514 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -10.930 -16.466 -9.597 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -10.362 -18.283 -11.424 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -10.064 -19.327 -10.048 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -12.339 -19.520 -10.819 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -12.312 -18.871 -9.250 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -12.600 -17.859 -10.583 1.00 0.00 H new ATOM 49 N ILE A 5 -7.936 -13.060 -8.999 1.00 0.00 N ATOM 50 CA ILE A 5 -8.174 -11.787 -8.328 1.00 0.00 C ATOM 51 C ILE A 5 -9.655 -11.631 -7.988 1.00 0.00 C ATOM 52 O ILE A 5 -10.510 -11.626 -8.877 1.00 0.00 O ATOM 53 CB ILE A 5 -7.706 -10.590 -9.190 1.00 0.00 C ATOM 54 CG1 ILE A 5 -7.868 -9.279 -8.413 1.00 0.00 C ATOM 55 CG2 ILE A 5 -8.475 -10.531 -10.505 1.00 0.00 C ATOM 56 CD1 ILE A 5 -6.614 -8.434 -8.384 1.00 0.00 C ATOM 0 H ILE A 5 -8.549 -13.234 -9.796 1.00 0.00 H new ATOM 0 HA ILE A 5 -7.590 -11.790 -7.408 1.00 0.00 H new ATOM 0 HB ILE A 5 -6.650 -10.730 -9.423 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -8.676 -8.700 -8.859 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -8.166 -9.507 -7.390 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -8.127 -9.681 -11.092 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -8.309 -11.451 -11.065 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -9.539 -10.419 -10.299 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -6.803 -7.522 -7.817 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -5.808 -8.995 -7.911 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -6.326 -8.175 -9.403 1.00 0.00 H new ATOM 68 N ASP A 6 -9.953 -11.514 -6.697 1.00 0.00 N ATOM 69 CA ASP A 6 -11.330 -11.367 -6.243 1.00 0.00 C ATOM 70 C ASP A 6 -11.807 -9.928 -6.408 1.00 0.00 C ATOM 71 O ASP A 6 -11.332 -9.021 -5.721 1.00 0.00 O ATOM 72 CB ASP A 6 -11.466 -11.801 -4.780 1.00 0.00 C ATOM 73 CG ASP A 6 -12.898 -12.141 -4.397 1.00 0.00 C ATOM 74 OD1 ASP A 6 -13.723 -12.385 -5.305 1.00 0.00 O ATOM 75 OD2 ASP A 6 -13.193 -12.166 -3.185 1.00 0.00 O ATOM 0 H ASP A 6 -9.260 -11.518 -5.949 1.00 0.00 H new ATOM 0 HA ASP A 6 -11.956 -12.012 -6.860 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -10.831 -12.669 -4.603 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -11.102 -11.003 -4.134 1.00 0.00 H new ATOM 80 N LYS A 7 -12.752 -9.728 -7.325 1.00 0.00 N ATOM 81 CA LYS A 7 -13.301 -8.401 -7.587 1.00 0.00 C ATOM 82 C LYS A 7 -14.273 -7.984 -6.485 1.00 0.00 C ATOM 83 O LYS A 7 -14.318 -6.818 -6.101 1.00 0.00 O ATOM 84 CB LYS A 7 -14.010 -8.376 -8.944 1.00 0.00 C ATOM 85 CG LYS A 7 -13.089 -8.045 -10.109 1.00 0.00 C ATOM 86 CD LYS A 7 -13.699 -8.463 -11.440 1.00 0.00 C ATOM 87 CE LYS A 7 -12.805 -9.443 -12.183 1.00 0.00 C ATOM 88 NZ LYS A 7 -12.782 -10.783 -11.531 1.00 0.00 N ATOM 0 H LYS A 7 -13.153 -10.470 -7.899 1.00 0.00 H new ATOM 0 HA LYS A 7 -12.473 -7.692 -7.604 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -14.471 -9.348 -9.121 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -14.816 -7.643 -8.910 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -12.887 -6.974 -10.121 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -12.132 -8.549 -9.972 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -14.674 -8.919 -11.267 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -13.865 -7.581 -12.058 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -13.155 -9.546 -13.210 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -11.791 -9.045 -12.230 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -12.161 -11.420 -12.069 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -12.424 -10.690 -10.559 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -13.745 -11.175 -11.509 1.00 0.00 H new ATOM 102 N GLU A 8 -15.048 -8.948 -5.982 1.00 0.00 N ATOM 103 CA GLU A 8 -16.020 -8.683 -4.926 1.00 0.00 C ATOM 104 C GLU A 8 -15.337 -8.128 -3.676 1.00 0.00 C ATOM 105 O GLU A 8 -15.697 -7.053 -3.191 1.00 0.00 O ATOM 106 CB GLU A 8 -16.791 -9.962 -4.582 1.00 0.00 C ATOM 107 CG GLU A 8 -18.124 -9.708 -3.892 1.00 0.00 C ATOM 108 CD GLU A 8 -18.042 -9.871 -2.387 1.00 0.00 C ATOM 109 OE1 GLU A 8 -17.715 -8.880 -1.699 1.00 0.00 O ATOM 110 OE2 GLU A 8 -18.302 -10.990 -1.896 1.00 0.00 O ATOM 0 H GLU A 8 -15.019 -9.919 -6.292 1.00 0.00 H new ATOM 0 HA GLU A 8 -16.721 -7.933 -5.292 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -16.968 -10.526 -5.498 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -16.172 -10.586 -3.938 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -18.464 -8.699 -4.126 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -18.871 -10.396 -4.288 1.00 0.00 H new ATOM 117 N ALA A 9 -14.350 -8.864 -3.163 1.00 0.00 N ATOM 118 CA ALA A 9 -13.617 -8.442 -1.971 1.00 0.00 C ATOM 119 C ALA A 9 -12.936 -7.094 -2.192 1.00 0.00 C ATOM 120 O ALA A 9 -13.070 -6.182 -1.375 1.00 0.00 O ATOM 121 CB ALA A 9 -12.596 -9.498 -1.573 1.00 0.00 C ATOM 0 H ALA A 9 -14.041 -9.754 -3.554 1.00 0.00 H new ATOM 0 HA ALA A 9 -14.333 -8.326 -1.158 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -12.059 -9.168 -0.684 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -13.107 -10.437 -1.361 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -11.889 -9.647 -2.389 1.00 0.00 H new ATOM 127 N CYS A 10 -12.210 -6.972 -3.306 1.00 0.00 N ATOM 128 CA CYS A 10 -11.512 -5.731 -3.639 1.00 0.00 C ATOM 129 C CYS A 10 -12.490 -4.560 -3.718 1.00 0.00 C ATOM 130 O CYS A 10 -12.240 -3.492 -3.156 1.00 0.00 O ATOM 131 CB CYS A 10 -10.763 -5.879 -4.967 1.00 0.00 C ATOM 132 SG CYS A 10 -9.649 -4.505 -5.345 1.00 0.00 S ATOM 0 H CYS A 10 -12.091 -7.718 -3.991 1.00 0.00 H new ATOM 0 HA CYS A 10 -10.792 -5.526 -2.847 1.00 0.00 H new ATOM 0 HB2 CYS A 10 -10.187 -6.804 -4.946 1.00 0.00 H new ATOM 0 HB3 CYS A 10 -11.490 -5.975 -5.773 1.00 0.00 H new ATOM 0 HG CYS A 10 -8.679 -4.482 -4.480 1.00 0.00 H new ATOM 138 N ARG A 11 -13.607 -4.771 -4.415 1.00 0.00 N ATOM 139 CA ARG A 11 -14.629 -3.738 -4.566 1.00 0.00 C ATOM 140 C ARG A 11 -15.220 -3.353 -3.211 1.00 0.00 C ATOM 141 O ARG A 11 -15.361 -2.168 -2.902 1.00 0.00 O ATOM 142 CB ARG A 11 -15.740 -4.217 -5.502 1.00 0.00 C ATOM 143 CG ARG A 11 -15.475 -3.916 -6.969 1.00 0.00 C ATOM 144 CD ARG A 11 -16.647 -4.331 -7.847 1.00 0.00 C ATOM 145 NE ARG A 11 -16.214 -5.082 -9.025 1.00 0.00 N ATOM 146 CZ ARG A 11 -15.686 -4.524 -10.117 1.00 0.00 C ATOM 147 NH1 ARG A 11 -15.530 -3.205 -10.195 1.00 0.00 N ATOM 148 NH2 ARG A 11 -15.316 -5.288 -11.139 1.00 0.00 N ATOM 0 H ARG A 11 -13.826 -5.650 -4.884 1.00 0.00 H new ATOM 0 HA ARG A 11 -14.155 -2.858 -5.000 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -15.869 -5.292 -5.378 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -16.679 -3.748 -5.208 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -15.286 -2.850 -7.094 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -14.575 -4.439 -7.292 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -17.338 -4.939 -7.264 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -17.194 -3.443 -8.165 1.00 0.00 H new ATOM 0 HE ARG A 11 -16.322 -6.096 -9.011 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -15.815 -2.611 -9.416 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -15.126 -2.788 -11.033 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -15.435 -6.300 -11.089 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -14.913 -4.863 -11.974 1.00 0.00 H new ATOM 162 N ALA A 12 -15.557 -4.363 -2.405 1.00 0.00 N ATOM 163 CA ALA A 12 -16.126 -4.136 -1.078 1.00 0.00 C ATOM 164 C ALA A 12 -15.204 -3.259 -0.236 1.00 0.00 C ATOM 165 O ALA A 12 -15.655 -2.317 0.419 1.00 0.00 O ATOM 166 CB ALA A 12 -16.385 -5.460 -0.373 1.00 0.00 C ATOM 0 H ALA A 12 -15.445 -5.347 -2.650 1.00 0.00 H new ATOM 0 HA ALA A 12 -17.076 -3.616 -1.202 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -16.809 -5.270 0.613 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -17.085 -6.054 -0.960 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -15.447 -6.005 -0.266 1.00 0.00 H new ATOM 172 N ALA A 13 -13.907 -3.572 -0.265 1.00 0.00 N ATOM 173 CA ALA A 13 -12.913 -2.812 0.486 1.00 0.00 C ATOM 174 C ALA A 13 -12.840 -1.368 -0.004 1.00 0.00 C ATOM 175 O ALA A 13 -12.834 -0.436 0.798 1.00 0.00 O ATOM 176 CB ALA A 13 -11.548 -3.478 0.383 1.00 0.00 C ATOM 0 H ALA A 13 -13.523 -4.349 -0.803 1.00 0.00 H new ATOM 0 HA ALA A 13 -13.218 -2.798 1.532 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -10.817 -2.899 0.948 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -11.604 -4.488 0.790 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -11.244 -3.524 -0.663 1.00 0.00 H new ATOM 182 N TYR A 14 -12.789 -1.194 -1.327 1.00 0.00 N ATOM 183 CA TYR A 14 -12.721 0.139 -1.928 1.00 0.00 C ATOM 184 C TYR A 14 -13.895 1.004 -1.470 1.00 0.00 C ATOM 185 O TYR A 14 -13.719 2.182 -1.161 1.00 0.00 O ATOM 186 CB TYR A 14 -12.711 0.039 -3.457 1.00 0.00 C ATOM 187 CG TYR A 14 -12.179 1.280 -4.146 1.00 0.00 C ATOM 188 CD1 TYR A 14 -12.924 2.452 -4.175 1.00 0.00 C ATOM 189 CD2 TYR A 14 -10.935 1.277 -4.764 1.00 0.00 C ATOM 190 CE1 TYR A 14 -12.443 3.588 -4.801 1.00 0.00 C ATOM 191 CE2 TYR A 14 -10.448 2.408 -5.392 1.00 0.00 C ATOM 192 CZ TYR A 14 -11.206 3.561 -5.407 1.00 0.00 C ATOM 193 OH TYR A 14 -10.725 4.690 -6.028 1.00 0.00 O ATOM 0 H TYR A 14 -12.794 -1.959 -2.001 1.00 0.00 H new ATOM 0 HA TYR A 14 -11.795 0.609 -1.598 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -12.105 -0.818 -3.752 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -13.726 -0.153 -3.806 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -13.894 2.477 -3.701 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -10.339 0.377 -4.754 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -13.034 4.492 -4.815 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -9.479 2.389 -5.869 1.00 0.00 H new ATOM 0 HH TYR A 14 -9.814 4.872 -5.716 1.00 0.00 H new ATOM 203 N ASN A 15 -15.089 0.410 -1.426 1.00 0.00 N ATOM 204 CA ASN A 15 -16.291 1.125 -1.000 1.00 0.00 C ATOM 205 C ASN A 15 -16.135 1.653 0.425 1.00 0.00 C ATOM 206 O ASN A 15 -16.479 2.800 0.711 1.00 0.00 O ATOM 207 CB ASN A 15 -17.516 0.209 -1.080 1.00 0.00 C ATOM 208 CG ASN A 15 -18.193 0.259 -2.436 1.00 0.00 C ATOM 209 OD1 ASN A 15 -19.118 1.043 -2.650 1.00 0.00 O ATOM 210 ND2 ASN A 15 -17.740 -0.580 -3.362 1.00 0.00 N ATOM 0 H ASN A 15 -15.248 -0.565 -1.680 1.00 0.00 H new ATOM 0 HA ASN A 15 -16.433 1.971 -1.672 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -17.213 -0.816 -0.867 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -18.232 0.497 -0.310 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -18.161 -0.590 -4.291 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -16.971 -1.214 -3.144 1.00 0.00 H new ATOM 217 N LEU A 16 -15.611 0.805 1.310 1.00 0.00 N ATOM 218 CA LEU A 16 -15.404 1.177 2.707 1.00 0.00 C ATOM 219 C LEU A 16 -14.365 2.292 2.831 1.00 0.00 C ATOM 220 O LEU A 16 -14.552 3.242 3.592 1.00 0.00 O ATOM 221 CB LEU A 16 -14.960 -0.044 3.520 1.00 0.00 C ATOM 222 CG LEU A 16 -15.495 -0.105 4.953 1.00 0.00 C ATOM 223 CD1 LEU A 16 -14.875 0.992 5.804 1.00 0.00 C ATOM 224 CD2 LEU A 16 -17.013 0.003 4.960 1.00 0.00 C ATOM 0 H LEU A 16 -15.322 -0.146 1.082 1.00 0.00 H new ATOM 0 HA LEU A 16 -16.351 1.546 3.102 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -15.275 -0.945 2.993 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -13.871 -0.060 3.555 1.00 0.00 H new ATOM 0 HG LEU A 16 -15.217 -1.067 5.383 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -15.268 0.931 6.819 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -13.792 0.867 5.826 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -15.119 1.965 5.378 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -17.376 -0.042 5.987 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -17.312 0.950 4.510 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -17.439 -0.821 4.388 1.00 0.00 H new ATOM 236 N VAL A 17 -13.275 2.166 2.076 1.00 0.00 N ATOM 237 CA VAL A 17 -12.204 3.160 2.097 1.00 0.00 C ATOM 238 C VAL A 17 -12.640 4.460 1.417 1.00 0.00 C ATOM 239 O VAL A 17 -12.191 5.544 1.794 1.00 0.00 O ATOM 240 CB VAL A 17 -10.927 2.627 1.411 1.00 0.00 C ATOM 241 CG1 VAL A 17 -9.769 3.603 1.577 1.00 0.00 C ATOM 242 CG2 VAL A 17 -10.553 1.260 1.967 1.00 0.00 C ATOM 0 H VAL A 17 -13.110 1.384 1.442 1.00 0.00 H new ATOM 0 HA VAL A 17 -11.982 3.364 3.145 1.00 0.00 H new ATOM 0 HB VAL A 17 -11.135 2.525 0.346 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -8.883 3.203 1.085 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -10.033 4.560 1.128 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -9.562 3.745 2.638 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -9.651 0.900 1.472 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -10.371 1.340 3.039 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -11.369 0.559 1.789 1.00 0.00 H new ATOM 252 N ARG A 18 -13.521 4.345 0.419 1.00 0.00 N ATOM 253 CA ARG A 18 -14.021 5.511 -0.308 1.00 0.00 C ATOM 254 C ARG A 18 -14.555 6.568 0.657 1.00 0.00 C ATOM 255 O ARG A 18 -14.343 7.765 0.454 1.00 0.00 O ATOM 256 CB ARG A 18 -15.122 5.101 -1.292 1.00 0.00 C ATOM 257 CG ARG A 18 -14.802 5.442 -2.739 1.00 0.00 C ATOM 258 CD ARG A 18 -16.049 5.417 -3.610 1.00 0.00 C ATOM 259 NE ARG A 18 -16.193 6.641 -4.398 1.00 0.00 N ATOM 260 CZ ARG A 18 -16.660 7.795 -3.913 1.00 0.00 C ATOM 261 NH1 ARG A 18 -17.035 7.890 -2.641 1.00 0.00 N ATOM 262 NH2 ARG A 18 -16.751 8.858 -4.705 1.00 0.00 N ATOM 0 H ARG A 18 -13.902 3.455 0.097 1.00 0.00 H new ATOM 0 HA ARG A 18 -13.188 5.939 -0.866 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -15.291 4.027 -1.209 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -16.053 5.593 -1.009 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -14.343 6.430 -2.788 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -14.072 4.732 -3.128 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -16.006 4.558 -4.280 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -16.929 5.286 -2.980 1.00 0.00 H new ATOM 0 HE ARG A 18 -15.919 6.612 -5.380 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -16.967 7.078 -2.027 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -17.390 8.775 -2.279 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -16.465 8.792 -5.682 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -17.107 9.740 -4.336 1.00 0.00 H new ATOM 276 N ASP A 19 -15.235 6.118 1.711 1.00 0.00 N ATOM 277 CA ASP A 19 -15.784 7.025 2.708 1.00 0.00 C ATOM 278 C ASP A 19 -14.749 7.330 3.783 1.00 0.00 C ATOM 279 O ASP A 19 -14.081 6.427 4.292 1.00 0.00 O ATOM 280 CB ASP A 19 -17.039 6.434 3.350 1.00 0.00 C ATOM 281 CG ASP A 19 -17.907 7.501 3.989 1.00 0.00 C ATOM 282 OD1 ASP A 19 -18.322 8.436 3.271 1.00 0.00 O ATOM 283 OD2 ASP A 19 -18.167 7.406 5.207 1.00 0.00 O ATOM 0 H ASP A 19 -15.417 5.131 1.893 1.00 0.00 H new ATOM 0 HA ASP A 19 -16.054 7.952 2.203 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -17.616 5.902 2.594 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -16.750 5.702 4.104 1.00 0.00 H new ATOM 288 N ASP A 20 -14.625 8.607 4.125 1.00 0.00 N ATOM 289 CA ASP A 20 -13.671 9.043 5.141 1.00 0.00 C ATOM 290 C ASP A 20 -14.356 9.249 6.496 1.00 0.00 C ATOM 291 O ASP A 20 -13.892 10.040 7.320 1.00 0.00 O ATOM 292 CB ASP A 20 -12.971 10.332 4.694 1.00 0.00 C ATOM 293 CG ASP A 20 -13.948 11.434 4.327 1.00 0.00 C ATOM 294 OD1 ASP A 20 -14.451 11.425 3.182 1.00 0.00 O ATOM 295 OD2 ASP A 20 -14.210 12.305 5.182 1.00 0.00 O ATOM 0 H ASP A 20 -15.174 9.361 3.713 1.00 0.00 H new ATOM 0 HA ASP A 20 -12.924 8.258 5.260 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -12.319 10.682 5.494 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -12.335 10.116 3.836 1.00 0.00 H new ATOM 300 N GLY A 21 -15.453 8.524 6.722 1.00 0.00 N ATOM 301 CA GLY A 21 -16.175 8.631 7.977 1.00 0.00 C ATOM 302 C GLY A 21 -16.272 7.301 8.704 1.00 0.00 C ATOM 303 O GLY A 21 -17.254 7.044 9.402 1.00 0.00 O ATOM 0 H GLY A 21 -15.853 7.864 6.055 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -15.677 9.357 8.619 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -17.178 9.011 7.785 1.00 0.00 H new ATOM 307 N SER A 22 -15.257 6.451 8.536 1.00 0.00 N ATOM 308 CA SER A 22 -15.240 5.135 9.180 1.00 0.00 C ATOM 309 C SER A 22 -13.885 4.841 9.832 1.00 0.00 C ATOM 310 O SER A 22 -13.527 3.679 10.035 1.00 0.00 O ATOM 311 CB SER A 22 -15.573 4.046 8.157 1.00 0.00 C ATOM 312 OG SER A 22 -16.007 2.858 8.795 1.00 0.00 O ATOM 0 H SER A 22 -14.438 6.649 7.961 1.00 0.00 H new ATOM 0 HA SER A 22 -15.995 5.141 9.966 1.00 0.00 H new ATOM 0 HB2 SER A 22 -16.350 4.404 7.481 1.00 0.00 H new ATOM 0 HB3 SER A 22 -14.694 3.834 7.548 1.00 0.00 H new ATOM 0 HG SER A 22 -15.357 2.599 9.481 1.00 0.00 H new ATOM 318 N ALA A 23 -13.141 5.896 10.167 1.00 0.00 N ATOM 319 CA ALA A 23 -11.830 5.754 10.800 1.00 0.00 C ATOM 320 C ALA A 23 -10.897 4.843 9.994 1.00 0.00 C ATOM 321 O ALA A 23 -10.023 4.185 10.562 1.00 0.00 O ATOM 322 CB ALA A 23 -11.986 5.228 12.221 1.00 0.00 C ATOM 0 H ALA A 23 -13.426 6.863 10.009 1.00 0.00 H new ATOM 0 HA ALA A 23 -11.372 6.743 10.830 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -11.003 5.127 12.681 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -12.589 5.925 12.803 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -12.477 4.255 12.197 1.00 0.00 H new ATOM 328 N VAL A 24 -11.084 4.805 8.672 1.00 0.00 N ATOM 329 CA VAL A 24 -10.253 3.969 7.806 1.00 0.00 C ATOM 330 C VAL A 24 -9.403 4.819 6.858 1.00 0.00 C ATOM 331 O VAL A 24 -9.909 5.737 6.210 1.00 0.00 O ATOM 332 CB VAL A 24 -11.109 2.989 6.973 1.00 0.00 C ATOM 333 CG1 VAL A 24 -10.223 2.012 6.213 1.00 0.00 C ATOM 334 CG2 VAL A 24 -12.092 2.240 7.863 1.00 0.00 C ATOM 0 H VAL A 24 -11.800 5.341 8.181 1.00 0.00 H new ATOM 0 HA VAL A 24 -9.596 3.398 8.462 1.00 0.00 H new ATOM 0 HB VAL A 24 -11.679 3.569 6.248 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -10.846 1.331 5.633 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -9.566 2.564 5.541 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -9.622 1.440 6.920 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -12.684 1.556 7.256 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -11.543 1.675 8.616 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -12.753 2.953 8.355 1.00 0.00 H new ATOM 344 N ILE A 25 -8.109 4.500 6.780 1.00 0.00 N ATOM 345 CA ILE A 25 -7.188 5.230 5.907 1.00 0.00 C ATOM 346 C ILE A 25 -6.372 4.279 5.027 1.00 0.00 C ATOM 347 O ILE A 25 -6.153 4.556 3.846 1.00 0.00 O ATOM 348 CB ILE A 25 -6.227 6.136 6.714 1.00 0.00 C ATOM 349 CG1 ILE A 25 -5.277 5.293 7.573 1.00 0.00 C ATOM 350 CG2 ILE A 25 -7.016 7.108 7.580 1.00 0.00 C ATOM 351 CD1 ILE A 25 -4.324 6.118 8.413 1.00 0.00 C ATOM 0 H ILE A 25 -7.676 3.743 7.309 1.00 0.00 H new ATOM 0 HA ILE A 25 -7.806 5.860 5.267 1.00 0.00 H new ATOM 0 HB ILE A 25 -5.625 6.711 6.010 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -5.866 4.653 8.230 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -4.699 4.636 6.923 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -6.326 7.738 8.141 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -7.644 7.733 6.945 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -7.644 6.550 8.274 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -3.683 5.455 8.994 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -3.709 6.738 7.762 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -4.894 6.756 9.089 1.00 0.00 H new ATOM 363 N TRP A 26 -5.922 3.160 5.603 1.00 0.00 N ATOM 364 CA TRP A 26 -5.133 2.178 4.862 1.00 0.00 C ATOM 365 C TRP A 26 -5.779 0.792 4.915 1.00 0.00 C ATOM 366 O TRP A 26 -6.501 0.466 5.860 1.00 0.00 O ATOM 367 CB TRP A 26 -3.698 2.108 5.412 1.00 0.00 C ATOM 368 CG TRP A 26 -3.598 1.484 6.775 1.00 0.00 C ATOM 369 CD1 TRP A 26 -3.400 2.133 7.958 1.00 0.00 C ATOM 370 CD2 TRP A 26 -3.688 0.088 7.096 1.00 0.00 C ATOM 371 NE1 TRP A 26 -3.372 1.231 8.994 1.00 0.00 N ATOM 372 CE2 TRP A 26 -3.547 -0.030 8.490 1.00 0.00 C ATOM 373 CE3 TRP A 26 -3.882 -1.074 6.340 1.00 0.00 C ATOM 374 CZ2 TRP A 26 -3.593 -1.259 9.143 1.00 0.00 C ATOM 375 CZ3 TRP A 26 -3.927 -2.291 6.990 1.00 0.00 C ATOM 376 CH2 TRP A 26 -3.785 -2.376 8.376 1.00 0.00 C ATOM 0 H TRP A 26 -6.092 2.914 6.578 1.00 0.00 H new ATOM 0 HA TRP A 26 -5.099 2.501 3.822 1.00 0.00 H new ATOM 0 HB2 TRP A 26 -3.080 1.540 4.717 1.00 0.00 H new ATOM 0 HB3 TRP A 26 -3.286 3.116 5.454 1.00 0.00 H new ATOM 0 HD1 TRP A 26 -3.282 3.201 8.065 1.00 0.00 H new ATOM 0 HE1 TRP A 26 -3.242 1.463 9.979 1.00 0.00 H new ATOM 0 HE3 TRP A 26 -3.994 -1.019 5.267 1.00 0.00 H new ATOM 0 HZ2 TRP A 26 -3.481 -1.328 10.215 1.00 0.00 H new ATOM 0 HZ3 TRP A 26 -4.075 -3.194 6.416 1.00 0.00 H new ATOM 0 HH2 TRP A 26 -3.828 -3.344 8.853 1.00 0.00 H new ATOM 387 N VAL A 27 -5.492 -0.025 3.901 1.00 0.00 N ATOM 388 CA VAL A 27 -6.015 -1.391 3.827 1.00 0.00 C ATOM 389 C VAL A 27 -4.928 -2.346 3.339 1.00 0.00 C ATOM 390 O VAL A 27 -4.001 -1.928 2.641 1.00 0.00 O ATOM 391 CB VAL A 27 -7.227 -1.502 2.876 1.00 0.00 C ATOM 392 CG1 VAL A 27 -7.943 -2.832 3.073 1.00 0.00 C ATOM 393 CG2 VAL A 27 -8.189 -0.339 3.073 1.00 0.00 C ATOM 0 H VAL A 27 -4.897 0.237 3.115 1.00 0.00 H new ATOM 0 HA VAL A 27 -6.338 -1.659 4.833 1.00 0.00 H new ATOM 0 HB VAL A 27 -6.855 -1.458 1.852 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -8.794 -2.891 2.394 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -7.254 -3.650 2.864 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -8.294 -2.907 4.102 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -9.032 -0.444 2.390 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -8.552 -0.338 4.101 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -7.672 0.599 2.870 1.00 0.00 H new ATOM 403 N THR A 28 -5.045 -3.628 3.687 1.00 0.00 N ATOM 404 CA THR A 28 -4.055 -4.617 3.248 1.00 0.00 C ATOM 405 C THR A 28 -4.564 -5.379 2.026 1.00 0.00 C ATOM 406 O THR A 28 -5.730 -5.261 1.656 1.00 0.00 O ATOM 407 CB THR A 28 -3.701 -5.609 4.370 1.00 0.00 C ATOM 408 OG1 THR A 28 -4.134 -5.143 5.635 1.00 0.00 O ATOM 409 CG2 THR A 28 -2.213 -5.882 4.473 1.00 0.00 C ATOM 0 H THR A 28 -5.800 -4.003 4.261 1.00 0.00 H new ATOM 0 HA THR A 28 -3.150 -4.071 2.982 1.00 0.00 H new ATOM 0 HB THR A 28 -4.218 -6.530 4.100 1.00 0.00 H new ATOM 0 HG1 THR A 28 -3.362 -5.049 6.231 1.00 0.00 H new ATOM 0 HG21 THR A 28 -2.028 -6.589 5.282 1.00 0.00 H new ATOM 0 HG22 THR A 28 -1.855 -6.304 3.534 1.00 0.00 H new ATOM 0 HG23 THR A 28 -1.685 -4.950 4.677 1.00 0.00 H new ATOM 417 N PHE A 29 -3.681 -6.156 1.406 1.00 0.00 N ATOM 418 CA PHE A 29 -4.034 -6.949 0.229 1.00 0.00 C ATOM 419 C PHE A 29 -3.166 -8.203 0.165 1.00 0.00 C ATOM 420 O PHE A 29 -2.037 -8.163 -0.326 1.00 0.00 O ATOM 421 CB PHE A 29 -3.872 -6.124 -1.052 1.00 0.00 C ATOM 422 CG PHE A 29 -5.146 -5.472 -1.513 1.00 0.00 C ATOM 423 CD1 PHE A 29 -5.550 -4.255 -0.985 1.00 0.00 C ATOM 424 CD2 PHE A 29 -5.942 -6.076 -2.476 1.00 0.00 C ATOM 425 CE1 PHE A 29 -6.721 -3.654 -1.407 1.00 0.00 C ATOM 426 CE2 PHE A 29 -7.114 -5.478 -2.901 1.00 0.00 C ATOM 427 CZ PHE A 29 -7.503 -4.266 -2.367 1.00 0.00 C ATOM 0 H PHE A 29 -2.709 -6.255 1.700 1.00 0.00 H new ATOM 0 HA PHE A 29 -5.080 -7.245 0.313 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -3.119 -5.354 -0.885 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -3.497 -6.770 -1.845 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -4.942 -3.771 -0.235 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -5.643 -7.024 -2.898 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -7.024 -2.707 -0.986 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -7.725 -5.959 -3.651 1.00 0.00 H new ATOM 0 HZ PHE A 29 -8.417 -3.797 -2.699 1.00 0.00 H new ATOM 437 N LYS A 30 -3.694 -9.313 0.678 1.00 0.00 N ATOM 438 CA LYS A 30 -2.959 -10.576 0.693 1.00 0.00 C ATOM 439 C LYS A 30 -3.719 -11.678 -0.043 1.00 0.00 C ATOM 440 O LYS A 30 -4.888 -11.514 -0.398 1.00 0.00 O ATOM 441 CB LYS A 30 -2.683 -11.011 2.135 1.00 0.00 C ATOM 442 CG LYS A 30 -3.942 -11.266 2.953 1.00 0.00 C ATOM 443 CD LYS A 30 -3.647 -11.264 4.445 1.00 0.00 C ATOM 444 CE LYS A 30 -4.896 -11.555 5.264 1.00 0.00 C ATOM 445 NZ LYS A 30 -5.270 -12.996 5.230 1.00 0.00 N ATOM 0 H LYS A 30 -4.627 -9.363 1.088 1.00 0.00 H new ATOM 0 HA LYS A 30 -2.014 -10.413 0.175 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -2.080 -11.919 2.121 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -2.090 -10.242 2.629 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -4.685 -10.501 2.727 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -4.374 -12.225 2.668 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -2.884 -12.010 4.666 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -3.239 -10.296 4.734 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -4.730 -11.249 6.297 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -5.725 -10.958 4.884 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -5.956 -13.195 5.986 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -5.696 -13.223 4.309 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -4.420 -13.579 5.371 1.00 0.00 H new ATOM 459 N TYR A 31 -3.040 -12.807 -0.262 1.00 0.00 N ATOM 460 CA TYR A 31 -3.636 -13.950 -0.944 1.00 0.00 C ATOM 461 C TYR A 31 -4.509 -14.758 0.015 1.00 0.00 C ATOM 462 O TYR A 31 -4.119 -15.025 1.155 1.00 0.00 O ATOM 463 CB TYR A 31 -2.539 -14.847 -1.535 1.00 0.00 C ATOM 464 CG TYR A 31 -2.070 -14.422 -2.912 1.00 0.00 C ATOM 465 CD1 TYR A 31 -2.698 -14.897 -4.055 1.00 0.00 C ATOM 466 CD2 TYR A 31 -0.996 -13.553 -3.068 1.00 0.00 C ATOM 467 CE1 TYR A 31 -2.273 -14.520 -5.315 1.00 0.00 C ATOM 468 CE2 TYR A 31 -0.564 -13.169 -4.325 1.00 0.00 C ATOM 469 CZ TYR A 31 -1.206 -13.655 -5.447 1.00 0.00 C ATOM 470 OH TYR A 31 -0.780 -13.279 -6.704 1.00 0.00 O ATOM 0 H TYR A 31 -2.072 -12.950 0.026 1.00 0.00 H new ATOM 0 HA TYR A 31 -4.264 -13.575 -1.752 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -1.685 -14.853 -0.858 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -2.911 -15.870 -1.589 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -3.534 -15.574 -3.958 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -0.490 -13.171 -2.193 1.00 0.00 H new ATOM 0 HE1 TYR A 31 -2.774 -14.901 -6.193 1.00 0.00 H new ATOM 0 HE2 TYR A 31 0.271 -12.492 -4.428 1.00 0.00 H new ATOM 0 HH TYR A 31 -0.811 -12.303 -6.782 1.00 0.00 H new ATOM 480 N ASP A 32 -5.690 -15.147 -0.460 1.00 0.00 N ATOM 481 CA ASP A 32 -6.632 -15.929 0.334 1.00 0.00 C ATOM 482 C ASP A 32 -7.532 -16.755 -0.583 1.00 0.00 C ATOM 483 O ASP A 32 -8.296 -16.202 -1.374 1.00 0.00 O ATOM 484 CB ASP A 32 -7.488 -15.013 1.213 1.00 0.00 C ATOM 485 CG ASP A 32 -6.800 -14.633 2.512 1.00 0.00 C ATOM 486 OD1 ASP A 32 -6.689 -15.501 3.404 1.00 0.00 O ATOM 487 OD2 ASP A 32 -6.374 -13.464 2.639 1.00 0.00 O ATOM 0 H ASP A 32 -6.019 -14.930 -1.401 1.00 0.00 H new ATOM 0 HA ASP A 32 -6.064 -16.600 0.979 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -7.731 -14.107 0.657 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -8.431 -15.511 1.439 1.00 0.00 H new ATOM 492 N GLY A 33 -7.433 -18.079 -0.476 1.00 0.00 N ATOM 493 CA GLY A 33 -8.244 -18.959 -1.304 1.00 0.00 C ATOM 494 C GLY A 33 -7.838 -18.938 -2.768 1.00 0.00 C ATOM 495 O GLY A 33 -8.697 -18.957 -3.651 1.00 0.00 O ATOM 0 H GLY A 33 -6.805 -18.558 0.170 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -8.166 -19.978 -0.926 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -9.291 -18.666 -1.219 1.00 0.00 H new ATOM 499 N SER A 34 -6.527 -18.904 -3.026 1.00 0.00 N ATOM 500 CA SER A 34 -6.004 -18.885 -4.395 1.00 0.00 C ATOM 501 C SER A 34 -6.444 -17.626 -5.146 1.00 0.00 C ATOM 502 O SER A 34 -6.570 -17.638 -6.373 1.00 0.00 O ATOM 503 CB SER A 34 -6.456 -20.136 -5.161 1.00 0.00 C ATOM 504 OG SER A 34 -6.324 -21.305 -4.368 1.00 0.00 O ATOM 0 H SER A 34 -5.808 -18.889 -2.303 1.00 0.00 H new ATOM 0 HA SER A 34 -4.916 -18.879 -4.331 1.00 0.00 H new ATOM 0 HB2 SER A 34 -7.495 -20.020 -5.470 1.00 0.00 H new ATOM 0 HB3 SER A 34 -5.863 -20.242 -6.070 1.00 0.00 H new ATOM 0 HG SER A 34 -6.621 -22.084 -4.882 1.00 0.00 H new ATOM 510 N THR A 35 -6.672 -16.539 -4.408 1.00 0.00 N ATOM 511 CA THR A 35 -7.091 -15.280 -5.012 1.00 0.00 C ATOM 512 C THR A 35 -6.722 -14.100 -4.116 1.00 0.00 C ATOM 513 O THR A 35 -6.678 -14.225 -2.890 1.00 0.00 O ATOM 514 CB THR A 35 -8.599 -15.296 -5.296 1.00 0.00 C ATOM 515 OG1 THR A 35 -9.029 -14.050 -5.815 1.00 0.00 O ATOM 516 CG2 THR A 35 -9.446 -15.604 -4.079 1.00 0.00 C ATOM 0 H THR A 35 -6.573 -16.508 -3.393 1.00 0.00 H new ATOM 0 HA THR A 35 -6.565 -15.163 -5.959 1.00 0.00 H new ATOM 0 HB THR A 35 -8.739 -16.097 -6.022 1.00 0.00 H new ATOM 0 HG1 THR A 35 -9.951 -14.131 -6.138 1.00 0.00 H new ATOM 0 HG21 THR A 35 -10.500 -15.598 -4.358 1.00 0.00 H new ATOM 0 HG22 THR A 35 -9.180 -16.587 -3.690 1.00 0.00 H new ATOM 0 HG23 THR A 35 -9.269 -14.850 -3.312 1.00 0.00 H new ATOM 524 N ILE A 36 -6.448 -12.959 -4.741 1.00 0.00 N ATOM 525 CA ILE A 36 -6.071 -11.752 -4.016 1.00 0.00 C ATOM 526 C ILE A 36 -7.293 -11.069 -3.410 1.00 0.00 C ATOM 527 O ILE A 36 -8.306 -10.870 -4.086 1.00 0.00 O ATOM 528 CB ILE A 36 -5.333 -10.756 -4.935 1.00 0.00 C ATOM 529 CG1 ILE A 36 -4.192 -11.458 -5.677 1.00 0.00 C ATOM 530 CG2 ILE A 36 -4.799 -9.580 -4.131 1.00 0.00 C ATOM 531 CD1 ILE A 36 -4.004 -10.973 -7.098 1.00 0.00 C ATOM 0 H ILE A 36 -6.481 -12.846 -5.754 1.00 0.00 H new ATOM 0 HA ILE A 36 -5.400 -12.058 -3.213 1.00 0.00 H new ATOM 0 HB ILE A 36 -6.043 -10.376 -5.670 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -3.264 -11.308 -5.125 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -4.385 -12.531 -5.691 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -4.282 -8.889 -4.797 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -5.628 -9.065 -3.646 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -4.104 -9.943 -3.374 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -3.179 -11.514 -7.561 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -4.918 -11.148 -7.666 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -3.780 -9.906 -7.092 1.00 0.00 H new ATOM 543 N VAL A 37 -7.189 -10.708 -2.132 1.00 0.00 N ATOM 544 CA VAL A 37 -8.278 -10.042 -1.423 1.00 0.00 C ATOM 545 C VAL A 37 -7.732 -9.015 -0.428 1.00 0.00 C ATOM 546 O VAL A 37 -6.602 -9.144 0.048 1.00 0.00 O ATOM 547 CB VAL A 37 -9.168 -11.058 -0.671 1.00 0.00 C ATOM 548 CG1 VAL A 37 -9.888 -11.973 -1.651 1.00 0.00 C ATOM 549 CG2 VAL A 37 -8.344 -11.871 0.319 1.00 0.00 C ATOM 0 H VAL A 37 -6.356 -10.867 -1.565 1.00 0.00 H new ATOM 0 HA VAL A 37 -8.884 -9.533 -2.172 1.00 0.00 H new ATOM 0 HB VAL A 37 -9.919 -10.501 -0.111 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -10.509 -12.680 -1.100 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -10.517 -11.376 -2.311 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -9.155 -12.519 -2.244 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -8.991 -12.579 0.836 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -7.566 -12.415 -0.216 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -7.885 -11.202 1.046 1.00 0.00 H new ATOM 559 N PRO A 38 -8.525 -7.977 -0.097 1.00 0.00 N ATOM 560 CA PRO A 38 -8.104 -6.934 0.848 1.00 0.00 C ATOM 561 C PRO A 38 -7.896 -7.481 2.262 1.00 0.00 C ATOM 562 O PRO A 38 -8.352 -8.580 2.586 1.00 0.00 O ATOM 563 CB PRO A 38 -9.260 -5.930 0.822 1.00 0.00 C ATOM 564 CG PRO A 38 -10.434 -6.710 0.344 1.00 0.00 C ATOM 565 CD PRO A 38 -9.888 -7.737 -0.607 1.00 0.00 C ATOM 0 HA PRO A 38 -7.145 -6.498 0.569 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -9.441 -5.510 1.811 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -9.043 -5.095 0.156 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -10.952 -7.186 1.177 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -11.157 -6.063 -0.153 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -10.486 -8.648 -0.602 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -9.875 -7.369 -1.633 1.00 0.00 H new ATOM 573 N GLY A 39 -7.199 -6.710 3.096 1.00 0.00 N ATOM 574 CA GLY A 39 -6.934 -7.121 4.453 1.00 0.00 C ATOM 575 C GLY A 39 -7.259 -6.034 5.455 1.00 0.00 C ATOM 576 O GLY A 39 -8.103 -5.177 5.200 1.00 0.00 O ATOM 0 H GLY A 39 -6.813 -5.800 2.846 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -7.520 -8.011 4.682 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -5.884 -7.398 4.548 1.00 0.00 H new ATOM 580 N GLU A 40 -6.580 -6.087 6.594 1.00 0.00 N ATOM 581 CA GLU A 40 -6.771 -5.136 7.689 1.00 0.00 C ATOM 582 C GLU A 40 -7.058 -3.720 7.202 1.00 0.00 C ATOM 583 O GLU A 40 -6.481 -3.251 6.222 1.00 0.00 O ATOM 584 CB GLU A 40 -5.548 -5.128 8.611 1.00 0.00 C ATOM 585 CG GLU A 40 -5.564 -6.231 9.658 1.00 0.00 C ATOM 586 CD GLU A 40 -5.360 -7.610 9.059 1.00 0.00 C ATOM 587 OE1 GLU A 40 -4.200 -7.960 8.756 1.00 0.00 O ATOM 588 OE2 GLU A 40 -6.362 -8.337 8.889 1.00 0.00 O ATOM 0 H GLU A 40 -5.874 -6.797 6.788 1.00 0.00 H new ATOM 0 HA GLU A 40 -7.649 -5.472 8.241 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -4.647 -5.227 8.006 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -5.490 -4.163 9.114 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -4.783 -6.040 10.393 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -6.515 -6.208 10.190 1.00 0.00 H new ATOM 595 N GLN A 41 -7.953 -3.050 7.919 1.00 0.00 N ATOM 596 CA GLN A 41 -8.345 -1.678 7.609 1.00 0.00 C ATOM 597 C GLN A 41 -8.398 -0.852 8.891 1.00 0.00 C ATOM 598 O GLN A 41 -9.253 -1.082 9.748 1.00 0.00 O ATOM 599 CB GLN A 41 -9.711 -1.646 6.915 1.00 0.00 C ATOM 600 CG GLN A 41 -9.743 -2.386 5.587 1.00 0.00 C ATOM 601 CD GLN A 41 -11.047 -3.130 5.365 1.00 0.00 C ATOM 602 OE1 GLN A 41 -11.166 -4.309 5.697 1.00 0.00 O ATOM 603 NE2 GLN A 41 -12.035 -2.445 4.797 1.00 0.00 N ATOM 0 H GLN A 41 -8.428 -3.442 8.732 1.00 0.00 H new ATOM 0 HA GLN A 41 -7.603 -1.252 6.933 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -10.456 -2.081 7.581 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -9.999 -0.608 6.749 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -9.592 -1.675 4.775 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -8.914 -3.093 5.549 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -11.895 -1.469 4.537 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -12.933 -2.896 4.621 1.00 0.00 H new ATOM 612 N GLY A 42 -7.477 0.098 9.028 1.00 0.00 N ATOM 613 CA GLY A 42 -7.445 0.923 10.225 1.00 0.00 C ATOM 614 C GLY A 42 -6.719 2.238 10.034 1.00 0.00 C ATOM 615 O GLY A 42 -6.031 2.441 9.033 1.00 0.00 O ATOM 0 H GLY A 42 -6.757 0.311 8.338 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -8.467 1.125 10.545 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -6.964 0.365 11.028 1.00 0.00 H new ATOM 619 N ALA A 43 -6.871 3.129 11.011 1.00 0.00 N ATOM 620 CA ALA A 43 -6.224 4.438 10.978 1.00 0.00 C ATOM 621 C ALA A 43 -4.817 4.368 11.574 1.00 0.00 C ATOM 622 O ALA A 43 -3.990 5.250 11.335 1.00 0.00 O ATOM 623 CB ALA A 43 -7.070 5.463 11.723 1.00 0.00 C ATOM 0 H ALA A 43 -7.441 2.966 11.841 1.00 0.00 H new ATOM 0 HA ALA A 43 -6.133 4.749 9.937 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -6.577 6.434 11.691 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -8.050 5.538 11.251 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -7.190 5.151 12.760 1.00 0.00 H new ATOM 629 N GLU A 44 -4.551 3.313 12.350 1.00 0.00 N ATOM 630 CA GLU A 44 -3.246 3.127 12.980 1.00 0.00 C ATOM 631 C GLU A 44 -2.320 2.315 12.077 1.00 0.00 C ATOM 632 O GLU A 44 -2.623 1.171 11.733 1.00 0.00 O ATOM 633 CB GLU A 44 -3.401 2.425 14.331 1.00 0.00 C ATOM 634 CG GLU A 44 -4.043 3.292 15.403 1.00 0.00 C ATOM 635 CD GLU A 44 -3.032 3.827 16.397 1.00 0.00 C ATOM 636 OE1 GLU A 44 -2.720 3.110 17.372 1.00 0.00 O ATOM 637 OE2 GLU A 44 -2.550 4.962 16.201 1.00 0.00 O ATOM 0 H GLU A 44 -5.225 2.575 12.555 1.00 0.00 H new ATOM 0 HA GLU A 44 -2.804 4.110 13.139 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -4.002 1.526 14.196 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -2.419 2.103 14.677 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -4.560 4.127 14.930 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -4.797 2.710 15.933 1.00 0.00 H new ATOM 644 N TYR A 45 -1.191 2.911 11.694 1.00 0.00 N ATOM 645 CA TYR A 45 -0.226 2.236 10.828 1.00 0.00 C ATOM 646 C TYR A 45 0.538 1.140 11.571 1.00 0.00 C ATOM 647 O TYR A 45 1.053 0.213 10.946 1.00 0.00 O ATOM 648 CB TYR A 45 0.762 3.237 10.236 1.00 0.00 C ATOM 649 CG TYR A 45 1.434 2.735 8.979 1.00 0.00 C ATOM 650 CD1 TYR A 45 0.741 2.666 7.779 1.00 0.00 C ATOM 651 CD2 TYR A 45 2.763 2.335 8.994 1.00 0.00 C ATOM 652 CE1 TYR A 45 1.355 2.215 6.627 1.00 0.00 C ATOM 653 CE2 TYR A 45 3.384 1.880 7.847 1.00 0.00 C ATOM 654 CZ TYR A 45 2.676 1.824 6.665 1.00 0.00 C ATOM 655 OH TYR A 45 3.289 1.377 5.516 1.00 0.00 O ATOM 0 H TYR A 45 -0.923 3.856 11.969 1.00 0.00 H new ATOM 0 HA TYR A 45 -0.794 1.769 10.023 1.00 0.00 H new ATOM 0 HB2 TYR A 45 0.239 4.167 10.014 1.00 0.00 H new ATOM 0 HB3 TYR A 45 1.524 3.470 10.980 1.00 0.00 H new ATOM 0 HD1 TYR A 45 -0.295 2.970 7.745 1.00 0.00 H new ATOM 0 HD2 TYR A 45 3.321 2.380 9.918 1.00 0.00 H new ATOM 0 HE1 TYR A 45 0.802 2.169 5.700 1.00 0.00 H new ATOM 0 HE2 TYR A 45 4.418 1.570 7.876 1.00 0.00 H new ATOM 0 HH TYR A 45 3.046 0.441 5.358 1.00 0.00 H new ATOM 665 N GLN A 46 0.609 1.245 12.901 1.00 0.00 N ATOM 666 CA GLN A 46 1.311 0.249 13.712 1.00 0.00 C ATOM 667 C GLN A 46 0.879 -1.167 13.324 1.00 0.00 C ATOM 668 O GLN A 46 1.698 -2.087 13.293 1.00 0.00 O ATOM 669 CB GLN A 46 1.048 0.494 15.203 1.00 0.00 C ATOM 670 CG GLN A 46 2.088 -0.134 16.120 1.00 0.00 C ATOM 671 CD GLN A 46 3.423 0.589 16.076 1.00 0.00 C ATOM 672 OE1 GLN A 46 3.642 1.555 16.804 1.00 0.00 O ATOM 673 NE2 GLN A 46 4.326 0.122 15.218 1.00 0.00 N ATOM 0 H GLN A 46 0.191 2.006 13.436 1.00 0.00 H new ATOM 0 HA GLN A 46 2.380 0.346 13.523 1.00 0.00 H new ATOM 0 HB2 GLN A 46 1.017 1.568 15.386 1.00 0.00 H new ATOM 0 HB3 GLN A 46 0.065 0.099 15.459 1.00 0.00 H new ATOM 0 HG2 GLN A 46 1.712 -0.132 17.143 1.00 0.00 H new ATOM 0 HG3 GLN A 46 2.235 -1.176 15.836 1.00 0.00 H new ATOM 0 HE21 GLN A 46 4.104 -0.683 14.632 1.00 0.00 H new ATOM 0 HE22 GLN A 46 5.240 0.568 15.147 1.00 0.00 H new ATOM 682 N HIS A 47 -0.409 -1.325 13.013 1.00 0.00 N ATOM 683 CA HIS A 47 -0.955 -2.619 12.608 1.00 0.00 C ATOM 684 C HIS A 47 -0.357 -3.084 11.281 1.00 0.00 C ATOM 685 O HIS A 47 -0.171 -4.282 11.068 1.00 0.00 O ATOM 686 CB HIS A 47 -2.479 -2.541 12.485 1.00 0.00 C ATOM 687 CG HIS A 47 -3.214 -2.920 13.735 1.00 0.00 C ATOM 688 ND1 HIS A 47 -2.595 -3.102 14.957 1.00 0.00 N ATOM 689 CD2 HIS A 47 -4.531 -3.149 13.947 1.00 0.00 C ATOM 690 CE1 HIS A 47 -3.499 -3.428 15.863 1.00 0.00 C ATOM 691 NE2 HIS A 47 -4.682 -3.462 15.276 1.00 0.00 N ATOM 0 H HIS A 47 -1.094 -0.570 13.034 1.00 0.00 H new ATOM 0 HA HIS A 47 -0.691 -3.344 13.378 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -2.759 -1.525 12.206 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -2.801 -3.195 11.674 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -5.317 -3.096 13.208 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -3.304 -3.632 16.906 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -5.565 -3.685 15.735 1.00 0.00 H new ATOM 700 N PHE A 48 -0.056 -2.136 10.388 1.00 0.00 N ATOM 701 CA PHE A 48 0.519 -2.476 9.092 1.00 0.00 C ATOM 702 C PHE A 48 1.975 -2.910 9.235 1.00 0.00 C ATOM 703 O PHE A 48 2.406 -3.879 8.610 1.00 0.00 O ATOM 704 CB PHE A 48 0.418 -1.292 8.128 1.00 0.00 C ATOM 705 CG PHE A 48 0.764 -1.662 6.717 1.00 0.00 C ATOM 706 CD1 PHE A 48 -0.149 -2.333 5.922 1.00 0.00 C ATOM 707 CD2 PHE A 48 2.008 -1.355 6.193 1.00 0.00 C ATOM 708 CE1 PHE A 48 0.172 -2.690 4.628 1.00 0.00 C ATOM 709 CE2 PHE A 48 2.334 -1.706 4.899 1.00 0.00 C ATOM 710 CZ PHE A 48 1.416 -2.376 4.115 1.00 0.00 C ATOM 0 H PHE A 48 -0.201 -1.138 10.540 1.00 0.00 H new ATOM 0 HA PHE A 48 -0.051 -3.311 8.685 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -0.595 -0.892 8.156 1.00 0.00 H new ATOM 0 HB3 PHE A 48 1.084 -0.497 8.464 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -1.123 -2.580 6.318 1.00 0.00 H new ATOM 0 HD2 PHE A 48 2.731 -0.835 6.804 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -0.548 -3.214 4.017 1.00 0.00 H new ATOM 0 HE2 PHE A 48 3.306 -1.457 4.500 1.00 0.00 H new ATOM 0 HZ PHE A 48 1.670 -2.654 3.103 1.00 0.00 H new ATOM 720 N ILE A 49 2.727 -2.187 10.066 1.00 0.00 N ATOM 721 CA ILE A 49 4.137 -2.496 10.299 1.00 0.00 C ATOM 722 C ILE A 49 4.302 -3.883 10.921 1.00 0.00 C ATOM 723 O ILE A 49 5.212 -4.631 10.562 1.00 0.00 O ATOM 724 CB ILE A 49 4.803 -1.448 11.223 1.00 0.00 C ATOM 725 CG1 ILE A 49 4.575 -0.032 10.684 1.00 0.00 C ATOM 726 CG2 ILE A 49 6.294 -1.729 11.362 1.00 0.00 C ATOM 727 CD1 ILE A 49 4.476 1.021 11.767 1.00 0.00 C ATOM 0 H ILE A 49 2.382 -1.382 10.589 1.00 0.00 H new ATOM 0 HA ILE A 49 4.628 -2.474 9.326 1.00 0.00 H new ATOM 0 HB ILE A 49 4.344 -1.520 12.209 1.00 0.00 H new ATOM 0 HG12 ILE A 49 5.392 0.227 10.011 1.00 0.00 H new ATOM 0 HG13 ILE A 49 3.659 -0.020 10.093 1.00 0.00 H new ATOM 0 HG21 ILE A 49 6.746 -0.982 12.015 1.00 0.00 H new ATOM 0 HG22 ILE A 49 6.439 -2.721 11.790 1.00 0.00 H new ATOM 0 HG23 ILE A 49 6.766 -1.685 10.380 1.00 0.00 H new ATOM 0 HD11 ILE A 49 4.315 1.998 11.311 1.00 0.00 H new ATOM 0 HD12 ILE A 49 3.641 0.786 12.427 1.00 0.00 H new ATOM 0 HD13 ILE A 49 5.401 1.038 12.344 1.00 0.00 H new ATOM 739 N GLN A 50 3.413 -4.215 11.859 1.00 0.00 N ATOM 740 CA GLN A 50 3.450 -5.506 12.543 1.00 0.00 C ATOM 741 C GLN A 50 3.077 -6.653 11.600 1.00 0.00 C ATOM 742 O GLN A 50 3.658 -7.738 11.673 1.00 0.00 O ATOM 743 CB GLN A 50 2.498 -5.490 13.741 1.00 0.00 C ATOM 744 CG GLN A 50 2.971 -6.334 14.915 1.00 0.00 C ATOM 745 CD GLN A 50 2.500 -5.787 16.250 1.00 0.00 C ATOM 746 OE1 GLN A 50 3.299 -5.296 17.048 1.00 0.00 O ATOM 747 NE2 GLN A 50 1.197 -5.866 16.500 1.00 0.00 N ATOM 0 H GLN A 50 2.655 -3.603 12.162 1.00 0.00 H new ATOM 0 HA GLN A 50 4.471 -5.672 12.888 1.00 0.00 H new ATOM 0 HB2 GLN A 50 2.367 -4.461 14.075 1.00 0.00 H new ATOM 0 HB3 GLN A 50 1.520 -5.847 13.420 1.00 0.00 H new ATOM 0 HG2 GLN A 50 2.607 -7.354 14.795 1.00 0.00 H new ATOM 0 HG3 GLN A 50 4.060 -6.381 14.909 1.00 0.00 H new ATOM 0 HE21 GLN A 50 0.570 -6.281 15.811 1.00 0.00 H new ATOM 0 HE22 GLN A 50 0.824 -5.512 17.381 1.00 0.00 H new ATOM 756 N GLN A 51 2.104 -6.409 10.721 1.00 0.00 N ATOM 757 CA GLN A 51 1.648 -7.423 9.769 1.00 0.00 C ATOM 758 C GLN A 51 2.664 -7.631 8.644 1.00 0.00 C ATOM 759 O GLN A 51 2.932 -8.764 8.243 1.00 0.00 O ATOM 760 CB GLN A 51 0.291 -7.025 9.175 1.00 0.00 C ATOM 761 CG GLN A 51 -0.822 -8.024 9.460 1.00 0.00 C ATOM 762 CD GLN A 51 -1.274 -8.006 10.908 1.00 0.00 C ATOM 763 OE1 GLN A 51 -1.075 -8.972 11.643 1.00 0.00 O ATOM 764 NE2 GLN A 51 -1.887 -6.904 11.330 1.00 0.00 N ATOM 0 H GLN A 51 1.616 -5.516 10.649 1.00 0.00 H new ATOM 0 HA GLN A 51 1.543 -8.362 10.312 1.00 0.00 H new ATOM 0 HB2 GLN A 51 0.003 -6.051 9.572 1.00 0.00 H new ATOM 0 HB3 GLN A 51 0.397 -6.911 8.096 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -1.674 -7.805 8.816 1.00 0.00 H new ATOM 0 HG3 GLN A 51 -0.478 -9.026 9.204 1.00 0.00 H new ATOM 0 HE21 GLN A 51 -2.033 -6.124 10.689 1.00 0.00 H new ATOM 0 HE22 GLN A 51 -2.211 -6.838 12.295 1.00 0.00 H new ATOM 773 N CYS A 52 3.213 -6.529 8.131 1.00 0.00 N ATOM 774 CA CYS A 52 4.185 -6.585 7.043 1.00 0.00 C ATOM 775 C CYS A 52 5.585 -6.925 7.550 1.00 0.00 C ATOM 776 O CYS A 52 6.410 -6.038 7.778 1.00 0.00 O ATOM 777 CB CYS A 52 4.207 -5.255 6.284 1.00 0.00 C ATOM 778 SG CYS A 52 2.958 -5.129 4.984 1.00 0.00 S ATOM 0 H CYS A 52 2.999 -5.585 8.454 1.00 0.00 H new ATOM 0 HA CYS A 52 3.876 -7.381 6.366 1.00 0.00 H new ATOM 0 HB2 CYS A 52 4.061 -4.441 6.994 1.00 0.00 H new ATOM 0 HB3 CYS A 52 5.193 -5.118 5.840 1.00 0.00 H new ATOM 0 HG CYS A 52 2.599 -3.887 4.847 1.00 0.00 H new ATOM 784 N THR A 53 5.847 -8.220 7.711 1.00 0.00 N ATOM 785 CA THR A 53 7.150 -8.696 8.173 1.00 0.00 C ATOM 786 C THR A 53 8.021 -9.109 6.988 1.00 0.00 C ATOM 787 O THR A 53 7.512 -9.338 5.887 1.00 0.00 O ATOM 788 CB THR A 53 6.981 -9.877 9.135 1.00 0.00 C ATOM 789 OG1 THR A 53 5.902 -10.704 8.736 1.00 0.00 O ATOM 790 CG2 THR A 53 6.728 -9.451 10.566 1.00 0.00 C ATOM 0 H THR A 53 5.171 -8.962 7.528 1.00 0.00 H new ATOM 0 HA THR A 53 7.642 -7.880 8.702 1.00 0.00 H new ATOM 0 HB THR A 53 7.926 -10.418 9.094 1.00 0.00 H new ATOM 0 HG1 THR A 53 5.814 -11.452 9.363 1.00 0.00 H new ATOM 0 HG21 THR A 53 6.618 -10.335 11.195 1.00 0.00 H new ATOM 0 HG22 THR A 53 7.568 -8.855 10.922 1.00 0.00 H new ATOM 0 HG23 THR A 53 5.816 -8.856 10.613 1.00 0.00 H new ATOM 798 N ASP A 54 9.332 -9.204 7.210 1.00 0.00 N ATOM 799 CA ASP A 54 10.260 -9.590 6.150 1.00 0.00 C ATOM 800 C ASP A 54 10.301 -11.111 5.973 1.00 0.00 C ATOM 801 O ASP A 54 11.333 -11.749 6.185 1.00 0.00 O ATOM 802 CB ASP A 54 11.664 -9.044 6.439 1.00 0.00 C ATOM 803 CG ASP A 54 11.889 -7.683 5.808 1.00 0.00 C ATOM 804 OD1 ASP A 54 12.040 -7.623 4.569 1.00 0.00 O ATOM 805 OD2 ASP A 54 11.908 -6.679 6.551 1.00 0.00 O ATOM 0 H ASP A 54 9.773 -9.020 8.111 1.00 0.00 H new ATOM 0 HA ASP A 54 9.902 -9.155 5.217 1.00 0.00 H new ATOM 0 HB2 ASP A 54 11.809 -8.972 7.517 1.00 0.00 H new ATOM 0 HB3 ASP A 54 12.409 -9.745 6.063 1.00 0.00 H new ATOM 810 N ASP A 55 9.161 -11.681 5.582 1.00 0.00 N ATOM 811 CA ASP A 55 9.044 -13.124 5.370 1.00 0.00 C ATOM 812 C ASP A 55 7.716 -13.466 4.697 1.00 0.00 C ATOM 813 O ASP A 55 7.043 -14.422 5.082 1.00 0.00 O ATOM 814 CB ASP A 55 9.159 -13.863 6.707 1.00 0.00 C ATOM 815 CG ASP A 55 9.867 -15.198 6.578 1.00 0.00 C ATOM 816 OD1 ASP A 55 9.372 -16.064 5.827 1.00 0.00 O ATOM 817 OD2 ASP A 55 10.917 -15.376 7.228 1.00 0.00 O ATOM 0 H ASP A 55 8.301 -11.162 5.405 1.00 0.00 H new ATOM 0 HA ASP A 55 9.855 -13.442 4.715 1.00 0.00 H new ATOM 0 HB2 ASP A 55 9.698 -13.237 7.418 1.00 0.00 H new ATOM 0 HB3 ASP A 55 8.161 -14.023 7.116 1.00 0.00 H new ATOM 822 N VAL A 56 7.348 -12.668 3.694 1.00 0.00 N ATOM 823 CA VAL A 56 6.094 -12.860 2.955 1.00 0.00 C ATOM 824 C VAL A 56 5.874 -11.718 1.970 1.00 0.00 C ATOM 825 O VAL A 56 6.311 -10.593 2.205 1.00 0.00 O ATOM 826 CB VAL A 56 4.858 -12.931 3.890 1.00 0.00 C ATOM 827 CG1 VAL A 56 4.485 -14.376 4.192 1.00 0.00 C ATOM 828 CG2 VAL A 56 5.095 -12.150 5.178 1.00 0.00 C ATOM 0 H VAL A 56 7.904 -11.876 3.371 1.00 0.00 H new ATOM 0 HA VAL A 56 6.193 -13.811 2.431 1.00 0.00 H new ATOM 0 HB VAL A 56 4.020 -12.468 3.368 1.00 0.00 H new ATOM 0 HG11 VAL A 56 3.616 -14.398 4.849 1.00 0.00 H new ATOM 0 HG12 VAL A 56 4.250 -14.893 3.262 1.00 0.00 H new ATOM 0 HG13 VAL A 56 5.322 -14.873 4.682 1.00 0.00 H new ATOM 0 HG21 VAL A 56 4.212 -12.218 5.813 1.00 0.00 H new ATOM 0 HG22 VAL A 56 5.953 -12.568 5.704 1.00 0.00 H new ATOM 0 HG23 VAL A 56 5.290 -11.105 4.939 1.00 0.00 H new ATOM 838 N ARG A 57 5.182 -12.009 0.874 1.00 0.00 N ATOM 839 CA ARG A 57 4.896 -10.999 -0.141 1.00 0.00 C ATOM 840 C ARG A 57 3.412 -10.641 -0.144 1.00 0.00 C ATOM 841 O ARG A 57 2.556 -11.509 -0.325 1.00 0.00 O ATOM 842 CB ARG A 57 5.328 -11.492 -1.526 1.00 0.00 C ATOM 843 CG ARG A 57 4.740 -12.841 -1.917 1.00 0.00 C ATOM 844 CD ARG A 57 3.481 -12.679 -2.757 1.00 0.00 C ATOM 845 NE ARG A 57 2.450 -13.650 -2.393 1.00 0.00 N ATOM 846 CZ ARG A 57 2.254 -14.809 -3.025 1.00 0.00 C ATOM 847 NH1 ARG A 57 3.035 -15.165 -4.043 1.00 0.00 N ATOM 848 NH2 ARG A 57 1.280 -15.622 -2.633 1.00 0.00 N ATOM 0 H ARG A 57 4.809 -12.935 0.665 1.00 0.00 H new ATOM 0 HA ARG A 57 5.465 -10.102 0.102 1.00 0.00 H new ATOM 0 HB2 ARG A 57 5.037 -10.751 -2.271 1.00 0.00 H new ATOM 0 HB3 ARG A 57 6.416 -11.560 -1.553 1.00 0.00 H new ATOM 0 HG2 ARG A 57 5.480 -13.413 -2.476 1.00 0.00 H new ATOM 0 HG3 ARG A 57 4.508 -13.412 -1.018 1.00 0.00 H new ATOM 0 HD2 ARG A 57 3.089 -11.670 -2.631 1.00 0.00 H new ATOM 0 HD3 ARG A 57 3.732 -12.795 -3.812 1.00 0.00 H new ATOM 0 HE ARG A 57 1.841 -13.427 -1.605 1.00 0.00 H new ATOM 0 HH11 ARG A 57 3.790 -14.550 -4.346 1.00 0.00 H new ATOM 0 HH12 ARG A 57 2.878 -16.053 -4.520 1.00 0.00 H new ATOM 0 HH21 ARG A 57 0.682 -15.361 -1.849 1.00 0.00 H new ATOM 0 HH22 ARG A 57 1.130 -16.508 -3.116 1.00 0.00 H new ATOM 862 N LEU A 58 3.113 -9.360 0.067 1.00 0.00 N ATOM 863 CA LEU A 58 1.730 -8.889 0.097 1.00 0.00 C ATOM 864 C LEU A 58 1.606 -7.489 -0.502 1.00 0.00 C ATOM 865 O LEU A 58 2.606 -6.843 -0.816 1.00 0.00 O ATOM 866 CB LEU A 58 1.196 -8.882 1.536 1.00 0.00 C ATOM 867 CG LEU A 58 1.715 -10.006 2.440 1.00 0.00 C ATOM 868 CD1 LEU A 58 1.687 -9.575 3.898 1.00 0.00 C ATOM 869 CD2 LEU A 58 0.896 -11.273 2.240 1.00 0.00 C ATOM 0 H LEU A 58 3.810 -8.631 0.220 1.00 0.00 H new ATOM 0 HA LEU A 58 1.136 -9.576 -0.506 1.00 0.00 H new ATOM 0 HB2 LEU A 58 1.449 -7.926 1.994 1.00 0.00 H new ATOM 0 HB3 LEU A 58 0.108 -8.941 1.501 1.00 0.00 H new ATOM 0 HG LEU A 58 2.748 -10.219 2.166 1.00 0.00 H new ATOM 0 HD11 LEU A 58 2.059 -10.386 4.524 1.00 0.00 H new ATOM 0 HD12 LEU A 58 2.318 -8.696 4.030 1.00 0.00 H new ATOM 0 HD13 LEU A 58 0.664 -9.334 4.187 1.00 0.00 H new ATOM 0 HD21 LEU A 58 1.279 -12.060 2.890 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -0.147 -11.075 2.486 1.00 0.00 H new ATOM 0 HD23 LEU A 58 0.969 -11.593 1.201 1.00 0.00 H new ATOM 881 N PHE A 59 0.369 -7.024 -0.647 1.00 0.00 N ATOM 882 CA PHE A 59 0.099 -5.697 -1.194 1.00 0.00 C ATOM 883 C PHE A 59 -0.608 -4.831 -0.155 1.00 0.00 C ATOM 884 O PHE A 59 -0.994 -5.319 0.910 1.00 0.00 O ATOM 885 CB PHE A 59 -0.756 -5.806 -2.460 1.00 0.00 C ATOM 886 CG PHE A 59 0.043 -6.063 -3.707 1.00 0.00 C ATOM 887 CD1 PHE A 59 0.536 -7.328 -3.982 1.00 0.00 C ATOM 888 CD2 PHE A 59 0.297 -5.040 -4.608 1.00 0.00 C ATOM 889 CE1 PHE A 59 1.268 -7.569 -5.129 1.00 0.00 C ATOM 890 CE2 PHE A 59 1.028 -5.274 -5.756 1.00 0.00 C ATOM 891 CZ PHE A 59 1.515 -6.540 -6.017 1.00 0.00 C ATOM 0 H PHE A 59 -0.467 -7.549 -0.392 1.00 0.00 H new ATOM 0 HA PHE A 59 1.049 -5.229 -1.454 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -1.480 -6.610 -2.331 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -1.323 -4.884 -2.586 1.00 0.00 H new ATOM 0 HD1 PHE A 59 0.346 -8.136 -3.291 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -0.081 -4.048 -4.410 1.00 0.00 H new ATOM 0 HE1 PHE A 59 1.646 -8.560 -5.331 1.00 0.00 H new ATOM 0 HE2 PHE A 59 1.219 -4.468 -6.449 1.00 0.00 H new ATOM 0 HZ PHE A 59 2.088 -6.725 -6.914 1.00 0.00 H new ATOM 901 N ALA A 60 -0.775 -3.546 -0.460 1.00 0.00 N ATOM 902 CA ALA A 60 -1.434 -2.627 0.462 1.00 0.00 C ATOM 903 C ALA A 60 -1.959 -1.390 -0.256 1.00 0.00 C ATOM 904 O ALA A 60 -1.600 -1.120 -1.405 1.00 0.00 O ATOM 905 CB ALA A 60 -0.480 -2.224 1.576 1.00 0.00 C ATOM 0 H ALA A 60 -0.465 -3.120 -1.333 1.00 0.00 H new ATOM 0 HA ALA A 60 -2.289 -3.147 0.894 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -0.984 -1.538 2.257 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -0.164 -3.112 2.124 1.00 0.00 H new ATOM 0 HB3 ALA A 60 0.393 -1.733 1.147 1.00 0.00 H new ATOM 911 N PHE A 61 -2.816 -0.641 0.435 1.00 0.00 N ATOM 912 CA PHE A 61 -3.405 0.570 -0.122 1.00 0.00 C ATOM 913 C PHE A 61 -3.588 1.633 0.961 1.00 0.00 C ATOM 914 O PHE A 61 -4.403 1.471 1.870 1.00 0.00 O ATOM 915 CB PHE A 61 -4.750 0.242 -0.772 1.00 0.00 C ATOM 916 CG PHE A 61 -5.048 1.080 -1.983 1.00 0.00 C ATOM 917 CD1 PHE A 61 -4.566 0.713 -3.228 1.00 0.00 C ATOM 918 CD2 PHE A 61 -5.808 2.234 -1.874 1.00 0.00 C ATOM 919 CE1 PHE A 61 -4.835 1.484 -4.344 1.00 0.00 C ATOM 920 CE2 PHE A 61 -6.080 3.008 -2.985 1.00 0.00 C ATOM 921 CZ PHE A 61 -5.594 2.632 -4.223 1.00 0.00 C ATOM 0 H PHE A 61 -3.118 -0.855 1.386 1.00 0.00 H new ATOM 0 HA PHE A 61 -2.729 0.968 -0.879 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -4.761 -0.810 -1.056 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -5.544 0.382 -0.038 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -3.974 -0.185 -3.329 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -6.192 2.531 -0.909 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -4.452 1.189 -5.310 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -6.672 3.906 -2.887 1.00 0.00 H new ATOM 0 HZ PHE A 61 -5.807 3.234 -5.094 1.00 0.00 H new ATOM 931 N VAL A 62 -2.822 2.719 0.858 1.00 0.00 N ATOM 932 CA VAL A 62 -2.897 3.807 1.829 1.00 0.00 C ATOM 933 C VAL A 62 -3.142 5.145 1.132 1.00 0.00 C ATOM 934 O VAL A 62 -2.532 5.439 0.102 1.00 0.00 O ATOM 935 CB VAL A 62 -1.605 3.907 2.672 1.00 0.00 C ATOM 936 CG1 VAL A 62 -1.788 4.883 3.828 1.00 0.00 C ATOM 937 CG2 VAL A 62 -1.184 2.535 3.187 1.00 0.00 C ATOM 0 H VAL A 62 -2.143 2.867 0.111 1.00 0.00 H new ATOM 0 HA VAL A 62 -3.733 3.583 2.491 1.00 0.00 H new ATOM 0 HB VAL A 62 -0.811 4.286 2.028 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -0.866 4.937 4.408 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -2.029 5.871 3.435 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -2.600 4.540 4.469 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -0.273 2.632 3.777 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -1.977 2.121 3.810 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -1.001 1.870 2.343 1.00 0.00 H new ATOM 947 N ARG A 63 -4.033 5.955 1.703 1.00 0.00 N ATOM 948 CA ARG A 63 -4.353 7.264 1.142 1.00 0.00 C ATOM 949 C ARG A 63 -4.023 8.372 2.141 1.00 0.00 C ATOM 950 O ARG A 63 -4.493 8.352 3.280 1.00 0.00 O ATOM 951 CB ARG A 63 -5.831 7.334 0.742 1.00 0.00 C ATOM 952 CG ARG A 63 -6.791 6.889 1.838 1.00 0.00 C ATOM 953 CD ARG A 63 -8.235 7.218 1.491 1.00 0.00 C ATOM 954 NE ARG A 63 -8.441 8.652 1.278 1.00 0.00 N ATOM 955 CZ ARG A 63 -9.610 9.193 0.930 1.00 0.00 C ATOM 956 NH1 ARG A 63 -10.686 8.429 0.763 1.00 0.00 N ATOM 957 NH2 ARG A 63 -9.703 10.507 0.751 1.00 0.00 N ATOM 0 H ARG A 63 -4.546 5.726 2.555 1.00 0.00 H new ATOM 0 HA ARG A 63 -3.745 7.409 0.249 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -6.071 8.358 0.456 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -5.988 6.712 -0.139 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -6.690 5.815 1.995 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -6.523 7.375 2.776 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -8.524 6.674 0.592 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -8.887 6.875 2.294 1.00 0.00 H new ATOM 0 HE ARG A 63 -7.643 9.275 1.403 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -10.622 7.420 0.901 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -11.575 8.852 0.497 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -8.882 11.099 0.880 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -10.595 10.924 0.485 1.00 0.00 H new ATOM 971 N PHE A 64 -3.207 9.331 1.708 1.00 0.00 N ATOM 972 CA PHE A 64 -2.808 10.444 2.564 1.00 0.00 C ATOM 973 C PHE A 64 -3.402 11.760 2.073 1.00 0.00 C ATOM 974 O PHE A 64 -3.820 11.873 0.920 1.00 0.00 O ATOM 975 CB PHE A 64 -1.281 10.559 2.611 1.00 0.00 C ATOM 976 CG PHE A 64 -0.607 9.455 3.377 1.00 0.00 C ATOM 977 CD1 PHE A 64 -1.095 9.045 4.608 1.00 0.00 C ATOM 978 CD2 PHE A 64 0.518 8.831 2.865 1.00 0.00 C ATOM 979 CE1 PHE A 64 -0.471 8.034 5.313 1.00 0.00 C ATOM 980 CE2 PHE A 64 1.146 7.821 3.566 1.00 0.00 C ATOM 981 CZ PHE A 64 0.651 7.422 4.791 1.00 0.00 C ATOM 0 H PHE A 64 -2.810 9.359 0.769 1.00 0.00 H new ATOM 0 HA PHE A 64 -3.189 10.244 3.565 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -0.896 10.567 1.591 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -1.013 11.515 3.060 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -1.972 9.521 5.020 1.00 0.00 H new ATOM 0 HD2 PHE A 64 0.909 9.138 1.906 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -0.860 7.723 6.271 1.00 0.00 H new ATOM 0 HE2 PHE A 64 2.024 7.344 3.156 1.00 0.00 H new ATOM 0 HZ PHE A 64 1.141 6.632 5.341 1.00 0.00 H new ATOM 991 N THR A 65 -3.424 12.754 2.958 1.00 0.00 N ATOM 992 CA THR A 65 -3.949 14.073 2.623 1.00 0.00 C ATOM 993 C THR A 65 -3.070 15.163 3.226 1.00 0.00 C ATOM 994 O THR A 65 -2.983 15.297 4.449 1.00 0.00 O ATOM 995 CB THR A 65 -5.391 14.225 3.113 1.00 0.00 C ATOM 996 OG1 THR A 65 -6.183 13.130 2.686 1.00 0.00 O ATOM 997 CG2 THR A 65 -6.060 15.492 2.622 1.00 0.00 C ATOM 0 H THR A 65 -3.083 12.669 3.915 1.00 0.00 H new ATOM 0 HA THR A 65 -3.942 14.176 1.538 1.00 0.00 H new ATOM 0 HB THR A 65 -5.324 14.266 4.200 1.00 0.00 H new ATOM 0 HG1 THR A 65 -7.101 13.244 3.010 1.00 0.00 H new ATOM 0 HG21 THR A 65 -7.079 15.537 3.006 1.00 0.00 H new ATOM 0 HG22 THR A 65 -5.501 16.359 2.974 1.00 0.00 H new ATOM 0 HG23 THR A 65 -6.082 15.493 1.532 1.00 0.00 H new ATOM 1005 N THR A 66 -2.412 15.927 2.361 1.00 0.00 N ATOM 1006 CA THR A 66 -1.527 16.999 2.802 1.00 0.00 C ATOM 1007 C THR A 66 -1.967 18.345 2.229 1.00 0.00 C ATOM 1008 O THR A 66 -2.475 18.419 1.108 1.00 0.00 O ATOM 1009 CB THR A 66 -0.081 16.689 2.395 1.00 0.00 C ATOM 1010 OG1 THR A 66 0.782 17.756 2.744 1.00 0.00 O ATOM 1011 CG2 THR A 66 0.086 16.424 0.912 1.00 0.00 C ATOM 0 H THR A 66 -2.475 15.823 1.348 1.00 0.00 H new ATOM 0 HA THR A 66 -1.582 17.064 3.889 1.00 0.00 H new ATOM 0 HB THR A 66 0.179 15.780 2.938 1.00 0.00 H new ATOM 0 HG1 THR A 66 1.699 17.536 2.477 1.00 0.00 H new ATOM 0 HG21 THR A 66 1.133 16.212 0.696 1.00 0.00 H new ATOM 0 HG22 THR A 66 -0.524 15.568 0.624 1.00 0.00 H new ATOM 0 HG23 THR A 66 -0.231 17.301 0.348 1.00 0.00 H new ATOM 1019 N GLY A 67 -1.768 19.405 3.009 1.00 0.00 N ATOM 1020 CA GLY A 67 -2.146 20.738 2.575 1.00 0.00 C ATOM 1021 C GLY A 67 -1.235 21.812 3.136 1.00 0.00 C ATOM 1022 O GLY A 67 -0.424 21.541 4.024 1.00 0.00 O ATOM 0 H GLY A 67 -1.350 19.363 3.938 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -2.126 20.781 1.486 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -3.172 20.939 2.883 1.00 0.00 H new ATOM 1026 N ASP A 68 -1.369 23.034 2.623 1.00 0.00 N ATOM 1027 CA ASP A 68 -0.545 24.148 3.083 1.00 0.00 C ATOM 1028 C ASP A 68 -1.390 25.215 3.776 1.00 0.00 C ATOM 1029 O ASP A 68 -1.703 26.252 3.191 1.00 0.00 O ATOM 1030 CB ASP A 68 0.224 24.758 1.909 1.00 0.00 C ATOM 1031 CG ASP A 68 1.441 25.543 2.358 1.00 0.00 C ATOM 1032 OD1 ASP A 68 2.314 24.952 3.028 1.00 0.00 O ATOM 1033 OD2 ASP A 68 1.521 26.749 2.043 1.00 0.00 O ATOM 0 H ASP A 68 -2.038 23.276 1.892 1.00 0.00 H new ATOM 0 HA ASP A 68 0.168 23.761 3.811 1.00 0.00 H new ATOM 0 HB2 ASP A 68 0.538 23.963 1.232 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -0.440 25.414 1.345 1.00 0.00 H new ATOM 1038 N ALA A 69 -1.735 24.944 5.036 1.00 0.00 N ATOM 1039 CA ALA A 69 -2.529 25.857 5.868 1.00 0.00 C ATOM 1040 C ALA A 69 -3.508 26.712 5.064 1.00 0.00 C ATOM 1041 O ALA A 69 -3.588 27.928 5.250 1.00 0.00 O ATOM 1042 CB ALA A 69 -1.611 26.742 6.676 1.00 0.00 C ATOM 0 H ALA A 69 -1.471 24.082 5.513 1.00 0.00 H new ATOM 0 HA ALA A 69 -3.132 25.235 6.530 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -2.205 27.417 7.291 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -0.982 26.125 7.318 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -0.981 27.324 6.003 1.00 0.00 H new ATOM 1048 N MET A 70 -4.252 26.063 4.184 1.00 0.00 N ATOM 1049 CA MET A 70 -5.240 26.741 3.351 1.00 0.00 C ATOM 1050 C MET A 70 -5.979 25.761 2.441 1.00 0.00 C ATOM 1051 O MET A 70 -7.169 25.933 2.176 1.00 0.00 O ATOM 1052 CB MET A 70 -4.575 27.835 2.511 1.00 0.00 C ATOM 1053 CG MET A 70 -3.828 27.318 1.290 1.00 0.00 C ATOM 1054 SD MET A 70 -2.884 28.608 0.455 1.00 0.00 S ATOM 1055 CE MET A 70 -1.784 29.132 1.767 1.00 0.00 C ATOM 0 H MET A 70 -4.192 25.057 4.025 1.00 0.00 H new ATOM 0 HA MET A 70 -5.971 27.197 4.019 1.00 0.00 H new ATOM 0 HB2 MET A 70 -5.339 28.541 2.184 1.00 0.00 H new ATOM 0 HB3 MET A 70 -3.879 28.388 3.141 1.00 0.00 H new ATOM 0 HG2 MET A 70 -3.153 26.518 1.594 1.00 0.00 H new ATOM 0 HG3 MET A 70 -4.541 26.884 0.589 1.00 0.00 H new ATOM 0 HE1 MET A 70 -2.053 30.139 2.087 1.00 0.00 H new ATOM 0 HE2 MET A 70 -1.872 28.447 2.611 1.00 0.00 H new ATOM 0 HE3 MET A 70 -0.757 29.129 1.403 1.00 0.00 H new ATOM 1065 N SER A 71 -5.270 24.738 1.961 1.00 0.00 N ATOM 1066 CA SER A 71 -5.869 23.744 1.075 1.00 0.00 C ATOM 1067 C SER A 71 -5.230 22.375 1.272 1.00 0.00 C ATOM 1068 O SER A 71 -4.017 22.220 1.132 1.00 0.00 O ATOM 1069 CB SER A 71 -5.725 24.177 -0.386 1.00 0.00 C ATOM 1070 OG SER A 71 -6.803 25.005 -0.783 1.00 0.00 O ATOM 0 H SER A 71 -4.285 24.578 2.171 1.00 0.00 H new ATOM 0 HA SER A 71 -6.927 23.669 1.325 1.00 0.00 H new ATOM 0 HB2 SER A 71 -4.784 24.712 -0.519 1.00 0.00 H new ATOM 0 HB3 SER A 71 -5.684 23.296 -1.027 1.00 0.00 H new ATOM 0 HG SER A 71 -7.163 25.471 0.000 1.00 0.00 H new ATOM 1076 N LYS A 72 -6.062 21.385 1.583 1.00 0.00 N ATOM 1077 CA LYS A 72 -5.592 20.019 1.790 1.00 0.00 C ATOM 1078 C LYS A 72 -6.013 19.128 0.625 1.00 0.00 C ATOM 1079 O LYS A 72 -7.181 19.118 0.229 1.00 0.00 O ATOM 1080 CB LYS A 72 -6.140 19.456 3.106 1.00 0.00 C ATOM 1081 CG LYS A 72 -7.628 19.701 3.307 1.00 0.00 C ATOM 1082 CD LYS A 72 -7.879 20.928 4.171 1.00 0.00 C ATOM 1083 CE LYS A 72 -9.294 20.938 4.725 1.00 0.00 C ATOM 1084 NZ LYS A 72 -9.330 20.565 6.167 1.00 0.00 N ATOM 0 H LYS A 72 -7.069 21.504 1.697 1.00 0.00 H new ATOM 0 HA LYS A 72 -4.503 20.036 1.843 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -5.950 18.383 3.138 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -5.593 19.901 3.937 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -8.110 19.832 2.338 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -8.082 18.827 3.774 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -7.165 20.947 4.994 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -7.711 21.830 3.582 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -9.727 21.930 4.596 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -9.912 20.244 4.155 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -10.313 20.584 6.506 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -8.940 19.608 6.288 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -8.762 21.242 6.715 1.00 0.00 H new ATOM 1098 N ARG A 73 -5.055 18.389 0.077 1.00 0.00 N ATOM 1099 CA ARG A 73 -5.318 17.498 -1.050 1.00 0.00 C ATOM 1100 C ARG A 73 -5.021 16.051 -0.674 1.00 0.00 C ATOM 1101 O ARG A 73 -4.021 15.767 -0.013 1.00 0.00 O ATOM 1102 CB ARG A 73 -4.479 17.904 -2.269 1.00 0.00 C ATOM 1103 CG ARG A 73 -3.240 18.718 -1.925 1.00 0.00 C ATOM 1104 CD ARG A 73 -2.636 19.369 -3.157 1.00 0.00 C ATOM 1105 NE ARG A 73 -1.651 20.394 -2.807 1.00 0.00 N ATOM 1106 CZ ARG A 73 -1.224 21.341 -3.644 1.00 0.00 C ATOM 1107 NH1 ARG A 73 -1.698 21.409 -4.886 1.00 0.00 N ATOM 1108 NH2 ARG A 73 -0.321 22.225 -3.238 1.00 0.00 N ATOM 0 H ARG A 73 -4.086 18.389 0.395 1.00 0.00 H new ATOM 0 HA ARG A 73 -6.374 17.584 -1.307 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -4.173 17.004 -2.803 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -5.103 18.482 -2.950 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -3.500 19.487 -1.198 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -2.499 18.072 -1.455 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -2.162 18.606 -3.775 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -3.429 19.817 -3.756 1.00 0.00 H new ATOM 0 HE ARG A 73 -1.266 20.383 -1.862 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -2.393 20.734 -5.204 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -1.366 22.136 -5.519 1.00 0.00 H new ATOM 0 HH21 ARG A 73 0.046 22.180 -2.287 1.00 0.00 H new ATOM 0 HH22 ARG A 73 0.006 22.950 -3.877 1.00 0.00 H new ATOM 1122 N SER A 74 -5.894 15.144 -1.102 1.00 0.00 N ATOM 1123 CA SER A 74 -5.728 13.722 -0.816 1.00 0.00 C ATOM 1124 C SER A 74 -5.192 12.980 -2.037 1.00 0.00 C ATOM 1125 O SER A 74 -5.450 13.374 -3.176 1.00 0.00 O ATOM 1126 CB SER A 74 -7.059 13.109 -0.371 1.00 0.00 C ATOM 1127 OG SER A 74 -6.923 11.725 -0.088 1.00 0.00 O ATOM 0 H SER A 74 -6.725 15.369 -1.649 1.00 0.00 H new ATOM 0 HA SER A 74 -5.004 13.622 -0.007 1.00 0.00 H new ATOM 0 HB2 SER A 74 -7.423 13.629 0.515 1.00 0.00 H new ATOM 0 HB3 SER A 74 -7.806 13.250 -1.152 1.00 0.00 H new ATOM 0 HG SER A 74 -6.008 11.541 0.212 1.00 0.00 H new ATOM 1133 N LYS A 75 -4.446 11.905 -1.791 1.00 0.00 N ATOM 1134 CA LYS A 75 -3.873 11.103 -2.868 1.00 0.00 C ATOM 1135 C LYS A 75 -3.772 9.635 -2.461 1.00 0.00 C ATOM 1136 O LYS A 75 -3.396 9.319 -1.330 1.00 0.00 O ATOM 1137 CB LYS A 75 -2.489 11.636 -3.250 1.00 0.00 C ATOM 1138 CG LYS A 75 -2.521 12.681 -4.355 1.00 0.00 C ATOM 1139 CD LYS A 75 -1.170 12.808 -5.043 1.00 0.00 C ATOM 1140 CE LYS A 75 -0.409 14.034 -4.559 1.00 0.00 C ATOM 1141 NZ LYS A 75 0.677 14.428 -5.502 1.00 0.00 N ATOM 0 H LYS A 75 -4.224 11.569 -0.854 1.00 0.00 H new ATOM 0 HA LYS A 75 -4.534 11.176 -3.732 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -2.019 12.068 -2.367 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -1.863 10.802 -3.568 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -3.280 12.412 -5.089 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -2.809 13.645 -3.937 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -0.578 11.913 -4.852 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -1.315 12.871 -6.122 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -1.103 14.866 -4.437 1.00 0.00 H new ATOM 0 HE3 LYS A 75 0.020 13.830 -3.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 1.169 15.267 -5.134 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 1.354 13.644 -5.599 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 0.266 14.648 -6.432 1.00 0.00 H new ATOM 1155 N PHE A 76 -4.107 8.742 -3.392 1.00 0.00 N ATOM 1156 CA PHE A 76 -4.050 7.303 -3.136 1.00 0.00 C ATOM 1157 C PHE A 76 -2.713 6.730 -3.595 1.00 0.00 C ATOM 1158 O PHE A 76 -2.130 7.202 -4.572 1.00 0.00 O ATOM 1159 CB PHE A 76 -5.197 6.583 -3.850 1.00 0.00 C ATOM 1160 CG PHE A 76 -6.559 7.102 -3.487 1.00 0.00 C ATOM 1161 CD1 PHE A 76 -7.256 6.569 -2.415 1.00 0.00 C ATOM 1162 CD2 PHE A 76 -7.143 8.124 -4.219 1.00 0.00 C ATOM 1163 CE1 PHE A 76 -8.509 7.045 -2.079 1.00 0.00 C ATOM 1164 CE2 PHE A 76 -8.396 8.603 -3.888 1.00 0.00 C ATOM 1165 CZ PHE A 76 -9.080 8.063 -2.817 1.00 0.00 C ATOM 0 H PHE A 76 -4.421 8.990 -4.330 1.00 0.00 H new ATOM 0 HA PHE A 76 -4.151 7.146 -2.062 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -5.058 6.677 -4.927 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -5.149 5.520 -3.614 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -6.815 5.772 -1.835 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -6.613 8.551 -5.057 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -9.041 6.621 -1.240 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -8.840 9.399 -4.467 1.00 0.00 H new ATOM 0 HZ PHE A 76 -10.060 8.436 -2.557 1.00 0.00 H new ATOM 1175 N ALA A 77 -2.230 5.711 -2.887 1.00 0.00 N ATOM 1176 CA ALA A 77 -0.959 5.081 -3.228 1.00 0.00 C ATOM 1177 C ALA A 77 -0.997 3.574 -2.989 1.00 0.00 C ATOM 1178 O ALA A 77 -1.590 3.101 -2.017 1.00 0.00 O ATOM 1179 CB ALA A 77 0.175 5.715 -2.436 1.00 0.00 C ATOM 0 H ALA A 77 -2.699 5.306 -2.077 1.00 0.00 H new ATOM 0 HA ALA A 77 -0.783 5.243 -4.291 1.00 0.00 H new ATOM 0 HB1 ALA A 77 1.117 5.235 -2.701 1.00 0.00 H new ATOM 0 HB2 ALA A 77 0.232 6.778 -2.669 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -0.010 5.587 -1.369 1.00 0.00 H new ATOM 1185 N LEU A 78 -0.353 2.827 -3.885 1.00 0.00 N ATOM 1186 CA LEU A 78 -0.295 1.373 -3.783 1.00 0.00 C ATOM 1187 C LEU A 78 1.051 0.933 -3.211 1.00 0.00 C ATOM 1188 O LEU A 78 2.072 0.975 -3.902 1.00 0.00 O ATOM 1189 CB LEU A 78 -0.520 0.736 -5.158 1.00 0.00 C ATOM 1190 CG LEU A 78 -1.671 -0.270 -5.227 1.00 0.00 C ATOM 1191 CD1 LEU A 78 -2.421 -0.133 -6.544 1.00 0.00 C ATOM 1192 CD2 LEU A 78 -1.149 -1.688 -5.054 1.00 0.00 C ATOM 0 H LEU A 78 0.138 3.209 -4.693 1.00 0.00 H new ATOM 0 HA LEU A 78 -1.084 1.040 -3.109 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -0.707 1.529 -5.882 1.00 0.00 H new ATOM 0 HB3 LEU A 78 0.399 0.235 -5.464 1.00 0.00 H new ATOM 0 HG LEU A 78 -2.365 -0.057 -4.414 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -3.236 -0.856 -6.576 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -2.827 0.875 -6.628 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -1.738 -0.320 -7.373 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -1.981 -2.391 -5.106 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -0.435 -1.912 -5.846 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -0.657 -1.779 -4.086 1.00 0.00 H new ATOM 1204 N ILE A 79 1.048 0.522 -1.944 1.00 0.00 N ATOM 1205 CA ILE A 79 2.272 0.084 -1.281 1.00 0.00 C ATOM 1206 C ILE A 79 2.452 -1.426 -1.397 1.00 0.00 C ATOM 1207 O ILE A 79 1.680 -2.200 -0.828 1.00 0.00 O ATOM 1208 CB ILE A 79 2.289 0.485 0.213 1.00 0.00 C ATOM 1209 CG1 ILE A 79 1.892 1.955 0.383 1.00 0.00 C ATOM 1210 CG2 ILE A 79 3.666 0.230 0.817 1.00 0.00 C ATOM 1211 CD1 ILE A 79 2.761 2.918 -0.399 1.00 0.00 C ATOM 0 H ILE A 79 0.214 0.484 -1.359 1.00 0.00 H new ATOM 0 HA ILE A 79 3.097 0.585 -1.787 1.00 0.00 H new ATOM 0 HB ILE A 79 1.560 -0.129 0.742 1.00 0.00 H new ATOM 0 HG12 ILE A 79 0.855 2.080 0.070 1.00 0.00 H new ATOM 0 HG13 ILE A 79 1.939 2.214 1.441 1.00 0.00 H new ATOM 0 HG21 ILE A 79 3.661 0.517 1.868 1.00 0.00 H new ATOM 0 HG22 ILE A 79 3.910 -0.829 0.731 1.00 0.00 H new ATOM 0 HG23 ILE A 79 4.412 0.819 0.283 1.00 0.00 H new ATOM 0 HD11 ILE A 79 2.418 3.938 -0.228 1.00 0.00 H new ATOM 0 HD12 ILE A 79 3.796 2.823 -0.071 1.00 0.00 H new ATOM 0 HD13 ILE A 79 2.695 2.687 -1.462 1.00 0.00 H new ATOM 1223 N THR A 80 3.479 -1.837 -2.138 1.00 0.00 N ATOM 1224 CA THR A 80 3.769 -3.255 -2.330 1.00 0.00 C ATOM 1225 C THR A 80 4.877 -3.710 -1.383 1.00 0.00 C ATOM 1226 O THR A 80 6.023 -3.273 -1.501 1.00 0.00 O ATOM 1227 CB THR A 80 4.181 -3.526 -3.780 1.00 0.00 C ATOM 1228 OG1 THR A 80 3.275 -2.920 -4.687 1.00 0.00 O ATOM 1229 CG2 THR A 80 4.247 -5.001 -4.116 1.00 0.00 C ATOM 0 H THR A 80 4.124 -1.207 -2.615 1.00 0.00 H new ATOM 0 HA THR A 80 2.863 -3.820 -2.108 1.00 0.00 H new ATOM 0 HB THR A 80 5.179 -3.099 -3.878 1.00 0.00 H new ATOM 0 HG1 THR A 80 2.629 -3.588 -4.999 1.00 0.00 H new ATOM 0 HG21 THR A 80 4.544 -5.124 -5.157 1.00 0.00 H new ATOM 0 HG22 THR A 80 4.977 -5.489 -3.470 1.00 0.00 H new ATOM 0 HG23 THR A 80 3.267 -5.453 -3.963 1.00 0.00 H new ATOM 1237 N TRP A 81 4.531 -4.592 -0.448 1.00 0.00 N ATOM 1238 CA TRP A 81 5.502 -5.106 0.513 1.00 0.00 C ATOM 1239 C TRP A 81 5.992 -6.493 0.102 1.00 0.00 C ATOM 1240 O TRP A 81 5.205 -7.339 -0.323 1.00 0.00 O ATOM 1241 CB TRP A 81 4.897 -5.161 1.918 1.00 0.00 C ATOM 1242 CG TRP A 81 5.824 -5.756 2.934 1.00 0.00 C ATOM 1243 CD1 TRP A 81 5.694 -6.964 3.556 1.00 0.00 C ATOM 1244 CD2 TRP A 81 7.032 -5.173 3.436 1.00 0.00 C ATOM 1245 NE1 TRP A 81 6.745 -7.166 4.416 1.00 0.00 N ATOM 1246 CE2 TRP A 81 7.580 -6.080 4.360 1.00 0.00 C ATOM 1247 CE3 TRP A 81 7.701 -3.970 3.194 1.00 0.00 C ATOM 1248 CZ2 TRP A 81 8.768 -5.824 5.042 1.00 0.00 C ATOM 1249 CZ3 TRP A 81 8.879 -3.716 3.871 1.00 0.00 C ATOM 1250 CH2 TRP A 81 9.402 -4.639 4.785 1.00 0.00 C ATOM 0 H TRP A 81 3.588 -4.964 -0.336 1.00 0.00 H new ATOM 0 HA TRP A 81 6.353 -4.425 0.524 1.00 0.00 H new ATOM 0 HB2 TRP A 81 4.625 -4.153 2.230 1.00 0.00 H new ATOM 0 HB3 TRP A 81 3.977 -5.745 1.888 1.00 0.00 H new ATOM 0 HD1 TRP A 81 4.883 -7.659 3.395 1.00 0.00 H new ATOM 0 HE1 TRP A 81 6.882 -7.990 5.001 1.00 0.00 H new ATOM 0 HE3 TRP A 81 7.305 -3.252 2.491 1.00 0.00 H new ATOM 0 HZ2 TRP A 81 9.173 -6.535 5.747 1.00 0.00 H new ATOM 0 HZ3 TRP A 81 9.405 -2.790 3.692 1.00 0.00 H new ATOM 0 HH2 TRP A 81 10.325 -4.411 5.298 1.00 0.00 H new ATOM 1261 N ILE A 82 7.296 -6.718 0.235 1.00 0.00 N ATOM 1262 CA ILE A 82 7.888 -8.002 -0.120 1.00 0.00 C ATOM 1263 C ILE A 82 8.931 -8.426 0.914 1.00 0.00 C ATOM 1264 O ILE A 82 10.082 -7.990 0.864 1.00 0.00 O ATOM 1265 CB ILE A 82 8.536 -7.960 -1.522 1.00 0.00 C ATOM 1266 CG1 ILE A 82 7.549 -7.404 -2.554 1.00 0.00 C ATOM 1267 CG2 ILE A 82 9.004 -9.350 -1.929 1.00 0.00 C ATOM 1268 CD1 ILE A 82 8.124 -7.303 -3.951 1.00 0.00 C ATOM 0 H ILE A 82 7.961 -6.029 0.585 1.00 0.00 H new ATOM 0 HA ILE A 82 7.081 -8.734 -0.135 1.00 0.00 H new ATOM 0 HB ILE A 82 9.402 -7.299 -1.484 1.00 0.00 H new ATOM 0 HG12 ILE A 82 6.665 -8.042 -2.579 1.00 0.00 H new ATOM 0 HG13 ILE A 82 7.220 -6.416 -2.233 1.00 0.00 H new ATOM 0 HG21 ILE A 82 9.458 -9.306 -2.919 1.00 0.00 H new ATOM 0 HG22 ILE A 82 9.738 -9.712 -1.209 1.00 0.00 H new ATOM 0 HG23 ILE A 82 8.152 -10.029 -1.951 1.00 0.00 H new ATOM 0 HD11 ILE A 82 7.369 -6.902 -4.627 1.00 0.00 H new ATOM 0 HD12 ILE A 82 8.990 -6.642 -3.941 1.00 0.00 H new ATOM 0 HD13 ILE A 82 8.427 -8.293 -4.292 1.00 0.00 H new ATOM 1280 N GLY A 83 8.514 -9.278 1.852 1.00 0.00 N ATOM 1281 CA GLY A 83 9.416 -9.753 2.888 1.00 0.00 C ATOM 1282 C GLY A 83 10.519 -10.633 2.334 1.00 0.00 C ATOM 1283 O GLY A 83 10.254 -11.756 1.898 1.00 0.00 O ATOM 0 H GLY A 83 7.565 -9.647 1.911 1.00 0.00 H new ATOM 0 HA2 GLY A 83 9.859 -8.899 3.400 1.00 0.00 H new ATOM 0 HA3 GLY A 83 8.848 -10.312 3.632 1.00 0.00 H new ATOM 1287 N GLU A 84 11.745 -10.095 2.349 1.00 0.00 N ATOM 1288 CA GLU A 84 12.950 -10.770 1.840 1.00 0.00 C ATOM 1289 C GLU A 84 12.844 -12.289 1.778 1.00 0.00 C ATOM 1290 O GLU A 84 13.226 -12.890 0.773 1.00 0.00 O ATOM 1291 CB GLU A 84 14.154 -10.420 2.696 1.00 0.00 C ATOM 1292 CG GLU A 84 14.688 -9.016 2.463 1.00 0.00 C ATOM 1293 CD GLU A 84 15.756 -8.624 3.466 1.00 0.00 C ATOM 1294 OE1 GLU A 84 15.395 -8.144 4.561 1.00 0.00 O ATOM 1295 OE2 GLU A 84 16.953 -8.800 3.157 1.00 0.00 O ATOM 0 H GLU A 84 11.933 -9.164 2.721 1.00 0.00 H new ATOM 0 HA GLU A 84 13.062 -10.408 0.818 1.00 0.00 H new ATOM 0 HB2 GLU A 84 13.884 -10.526 3.747 1.00 0.00 H new ATOM 0 HB3 GLU A 84 14.950 -11.138 2.498 1.00 0.00 H new ATOM 0 HG2 GLU A 84 15.099 -8.950 1.456 1.00 0.00 H new ATOM 0 HG3 GLU A 84 13.864 -8.304 2.518 1.00 0.00 H new ATOM 1302 N ASN A 85 12.347 -12.916 2.846 1.00 0.00 N ATOM 1303 CA ASN A 85 12.220 -14.374 2.889 1.00 0.00 C ATOM 1304 C ASN A 85 11.120 -14.879 1.956 1.00 0.00 C ATOM 1305 O ASN A 85 10.340 -15.766 2.311 1.00 0.00 O ATOM 1306 CB ASN A 85 11.963 -14.838 4.320 1.00 0.00 C ATOM 1307 CG ASN A 85 13.244 -14.925 5.116 1.00 0.00 C ATOM 1308 OD1 ASN A 85 13.706 -16.014 5.456 1.00 0.00 O ATOM 1309 ND2 ASN A 85 13.824 -13.771 5.419 1.00 0.00 N ATOM 0 H ASN A 85 12.027 -12.439 3.689 1.00 0.00 H new ATOM 0 HA ASN A 85 13.161 -14.798 2.539 1.00 0.00 H new ATOM 0 HB2 ASN A 85 11.276 -14.147 4.809 1.00 0.00 H new ATOM 0 HB3 ASN A 85 11.477 -15.813 4.305 1.00 0.00 H new ATOM 0 HD21 ASN A 85 14.691 -13.762 5.956 1.00 0.00 H new ATOM 0 HD22 ASN A 85 13.403 -12.893 5.115 1.00 0.00 H new ATOM 1316 N VAL A 86 11.085 -14.323 0.753 1.00 0.00 N ATOM 1317 CA VAL A 86 10.110 -14.720 -0.252 1.00 0.00 C ATOM 1318 C VAL A 86 10.534 -16.025 -0.912 1.00 0.00 C ATOM 1319 O VAL A 86 11.724 -16.277 -1.107 1.00 0.00 O ATOM 1320 CB VAL A 86 9.931 -13.655 -1.356 1.00 0.00 C ATOM 1321 CG1 VAL A 86 8.660 -13.921 -2.151 1.00 0.00 C ATOM 1322 CG2 VAL A 86 9.908 -12.252 -0.772 1.00 0.00 C ATOM 0 H VAL A 86 11.726 -13.590 0.448 1.00 0.00 H new ATOM 0 HA VAL A 86 9.161 -14.840 0.270 1.00 0.00 H new ATOM 0 HB VAL A 86 10.786 -13.724 -2.028 1.00 0.00 H new ATOM 0 HG11 VAL A 86 8.549 -13.161 -2.925 1.00 0.00 H new ATOM 0 HG12 VAL A 86 8.720 -14.905 -2.615 1.00 0.00 H new ATOM 0 HG13 VAL A 86 7.799 -13.887 -1.483 1.00 0.00 H new ATOM 0 HG21 VAL A 86 9.781 -11.526 -1.575 1.00 0.00 H new ATOM 0 HG22 VAL A 86 9.080 -12.164 -0.069 1.00 0.00 H new ATOM 0 HG23 VAL A 86 10.847 -12.058 -0.253 1.00 0.00 H new ATOM 1332 N SER A 87 9.553 -16.843 -1.261 1.00 0.00 N ATOM 1333 CA SER A 87 9.814 -18.123 -1.912 1.00 0.00 C ATOM 1334 C SER A 87 9.991 -17.940 -3.420 1.00 0.00 C ATOM 1335 O SER A 87 9.752 -16.855 -3.954 1.00 0.00 O ATOM 1336 CB SER A 87 8.673 -19.105 -1.630 1.00 0.00 C ATOM 1337 OG SER A 87 8.835 -19.731 -0.368 1.00 0.00 O ATOM 0 H SER A 87 8.565 -16.645 -1.105 1.00 0.00 H new ATOM 0 HA SER A 87 10.739 -18.530 -1.504 1.00 0.00 H new ATOM 0 HB2 SER A 87 7.720 -18.577 -1.657 1.00 0.00 H new ATOM 0 HB3 SER A 87 8.640 -19.863 -2.413 1.00 0.00 H new ATOM 0 HG SER A 87 8.092 -20.351 -0.213 1.00 0.00 H new ATOM 1343 N GLY A 88 10.411 -19.005 -4.101 1.00 0.00 N ATOM 1344 CA GLY A 88 10.612 -18.940 -5.540 1.00 0.00 C ATOM 1345 C GLY A 88 9.329 -18.634 -6.290 1.00 0.00 C ATOM 1346 O GLY A 88 9.233 -17.615 -6.974 1.00 0.00 O ATOM 0 H GLY A 88 10.616 -19.912 -3.682 1.00 0.00 H new ATOM 0 HA2 GLY A 88 11.353 -18.174 -5.766 1.00 0.00 H new ATOM 0 HA3 GLY A 88 11.017 -19.889 -5.891 1.00 0.00 H new ATOM 1350 N LEU A 89 8.338 -19.516 -6.157 1.00 0.00 N ATOM 1351 CA LEU A 89 7.052 -19.335 -6.821 1.00 0.00 C ATOM 1352 C LEU A 89 6.395 -18.024 -6.392 1.00 0.00 C ATOM 1353 O LEU A 89 5.761 -17.344 -7.200 1.00 0.00 O ATOM 1354 CB LEU A 89 6.120 -20.504 -6.498 1.00 0.00 C ATOM 1355 CG LEU A 89 6.686 -21.895 -6.797 1.00 0.00 C ATOM 1356 CD1 LEU A 89 7.114 -22.583 -5.510 1.00 0.00 C ATOM 1357 CD2 LEU A 89 5.661 -22.738 -7.539 1.00 0.00 C ATOM 0 H LEU A 89 8.404 -20.364 -5.594 1.00 0.00 H new ATOM 0 HA LEU A 89 7.231 -19.301 -7.896 1.00 0.00 H new ATOM 0 HB2 LEU A 89 5.857 -20.456 -5.441 1.00 0.00 H new ATOM 0 HB3 LEU A 89 5.196 -20.377 -7.062 1.00 0.00 H new ATOM 0 HG LEU A 89 7.563 -21.782 -7.434 1.00 0.00 H new ATOM 0 HD11 LEU A 89 7.514 -23.570 -5.741 1.00 0.00 H new ATOM 0 HD12 LEU A 89 7.882 -21.987 -5.017 1.00 0.00 H new ATOM 0 HD13 LEU A 89 6.254 -22.686 -4.849 1.00 0.00 H new ATOM 0 HD21 LEU A 89 6.080 -23.723 -7.744 1.00 0.00 H new ATOM 0 HD22 LEU A 89 4.765 -22.844 -6.927 1.00 0.00 H new ATOM 0 HD23 LEU A 89 5.402 -22.252 -8.479 1.00 0.00 H new ATOM 1369 N GLN A 90 6.554 -17.678 -5.115 1.00 0.00 N ATOM 1370 CA GLN A 90 5.981 -16.450 -4.571 1.00 0.00 C ATOM 1371 C GLN A 90 6.657 -15.214 -5.164 1.00 0.00 C ATOM 1372 O GLN A 90 6.010 -14.187 -5.377 1.00 0.00 O ATOM 1373 CB GLN A 90 6.117 -16.436 -3.045 1.00 0.00 C ATOM 1374 CG GLN A 90 4.995 -17.165 -2.321 1.00 0.00 C ATOM 1375 CD GLN A 90 4.767 -18.572 -2.849 1.00 0.00 C ATOM 1376 OE1 GLN A 90 4.090 -18.763 -3.859 1.00 0.00 O ATOM 1377 NE2 GLN A 90 5.333 -19.565 -2.168 1.00 0.00 N ATOM 0 H GLN A 90 7.076 -18.233 -4.437 1.00 0.00 H new ATOM 0 HA GLN A 90 4.925 -16.423 -4.840 1.00 0.00 H new ATOM 0 HB2 GLN A 90 7.069 -16.890 -2.770 1.00 0.00 H new ATOM 0 HB3 GLN A 90 6.146 -15.402 -2.702 1.00 0.00 H new ATOM 0 HG2 GLN A 90 5.228 -17.215 -1.257 1.00 0.00 H new ATOM 0 HG3 GLN A 90 4.073 -16.592 -2.419 1.00 0.00 H new ATOM 0 HE21 GLN A 90 5.887 -19.362 -1.336 1.00 0.00 H new ATOM 0 HE22 GLN A 90 5.213 -20.529 -2.478 1.00 0.00 H new ATOM 1386 N ARG A 91 7.961 -15.324 -5.427 1.00 0.00 N ATOM 1387 CA ARG A 91 8.737 -14.222 -5.995 1.00 0.00 C ATOM 1388 C ARG A 91 8.243 -13.850 -7.395 1.00 0.00 C ATOM 1389 O ARG A 91 8.331 -12.691 -7.802 1.00 0.00 O ATOM 1390 CB ARG A 91 10.221 -14.596 -6.041 1.00 0.00 C ATOM 1391 CG ARG A 91 11.045 -13.938 -4.945 1.00 0.00 C ATOM 1392 CD ARG A 91 12.473 -13.673 -5.396 1.00 0.00 C ATOM 1393 NE ARG A 91 13.427 -14.587 -4.771 1.00 0.00 N ATOM 1394 CZ ARG A 91 14.747 -14.384 -4.745 1.00 0.00 C ATOM 1395 NH1 ARG A 91 15.274 -13.305 -5.318 1.00 0.00 N ATOM 1396 NH2 ARG A 91 15.541 -15.264 -4.146 1.00 0.00 N ATOM 0 H ARG A 91 8.503 -16.170 -5.254 1.00 0.00 H new ATOM 0 HA ARG A 91 8.603 -13.351 -5.353 1.00 0.00 H new ATOM 0 HB2 ARG A 91 10.318 -15.678 -5.958 1.00 0.00 H new ATOM 0 HB3 ARG A 91 10.629 -14.313 -7.011 1.00 0.00 H new ATOM 0 HG2 ARG A 91 10.576 -12.999 -4.652 1.00 0.00 H new ATOM 0 HG3 ARG A 91 11.055 -14.579 -4.063 1.00 0.00 H new ATOM 0 HD2 ARG A 91 12.534 -13.772 -6.480 1.00 0.00 H new ATOM 0 HD3 ARG A 91 12.744 -12.646 -5.154 1.00 0.00 H new ATOM 0 HE ARG A 91 13.063 -15.431 -4.328 1.00 0.00 H new ATOM 0 HH11 ARG A 91 14.669 -12.627 -5.781 1.00 0.00 H new ATOM 0 HH12 ARG A 91 16.283 -13.156 -5.294 1.00 0.00 H new ATOM 0 HH21 ARG A 91 15.143 -16.094 -3.706 1.00 0.00 H new ATOM 0 HH22 ARG A 91 16.549 -15.110 -4.126 1.00 0.00 H new ATOM 1410 N ALA A 92 7.719 -14.838 -8.123 1.00 0.00 N ATOM 1411 CA ALA A 92 7.204 -14.611 -9.472 1.00 0.00 C ATOM 1412 C ALA A 92 5.757 -14.123 -9.430 1.00 0.00 C ATOM 1413 O ALA A 92 5.360 -13.250 -10.208 1.00 0.00 O ATOM 1414 CB ALA A 92 7.311 -15.885 -10.300 1.00 0.00 C ATOM 0 H ALA A 92 7.641 -15.802 -7.800 1.00 0.00 H new ATOM 0 HA ALA A 92 7.809 -13.835 -9.941 1.00 0.00 H new ATOM 0 HB1 ALA A 92 6.924 -15.701 -11.302 1.00 0.00 H new ATOM 0 HB2 ALA A 92 8.355 -16.190 -10.365 1.00 0.00 H new ATOM 0 HB3 ALA A 92 6.730 -16.677 -9.826 1.00 0.00 H new ATOM 1420 N LYS A 93 4.974 -14.692 -8.510 1.00 0.00 N ATOM 1421 CA LYS A 93 3.570 -14.321 -8.352 1.00 0.00 C ATOM 1422 C LYS A 93 3.418 -12.823 -8.083 1.00 0.00 C ATOM 1423 O LYS A 93 2.448 -12.211 -8.519 1.00 0.00 O ATOM 1424 CB LYS A 93 2.926 -15.125 -7.219 1.00 0.00 C ATOM 1425 CG LYS A 93 1.620 -15.797 -7.617 1.00 0.00 C ATOM 1426 CD LYS A 93 1.581 -17.252 -7.175 1.00 0.00 C ATOM 1427 CE LYS A 93 0.762 -18.104 -8.134 1.00 0.00 C ATOM 1428 NZ LYS A 93 1.074 -19.557 -8.000 1.00 0.00 N ATOM 0 H LYS A 93 5.292 -15.413 -7.863 1.00 0.00 H new ATOM 0 HA LYS A 93 3.059 -14.553 -9.287 1.00 0.00 H new ATOM 0 HB2 LYS A 93 3.628 -15.886 -6.880 1.00 0.00 H new ATOM 0 HB3 LYS A 93 2.741 -14.462 -6.373 1.00 0.00 H new ATOM 0 HG2 LYS A 93 0.783 -15.259 -7.172 1.00 0.00 H new ATOM 0 HG3 LYS A 93 1.496 -15.741 -8.699 1.00 0.00 H new ATOM 0 HD2 LYS A 93 2.597 -17.643 -7.116 1.00 0.00 H new ATOM 0 HD3 LYS A 93 1.155 -17.318 -6.174 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -0.299 -17.943 -7.946 1.00 0.00 H new ATOM 0 HE3 LYS A 93 0.956 -17.785 -9.158 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 0.494 -20.100 -8.671 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 2.081 -19.716 -8.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 0.865 -19.869 -7.030 1.00 0.00 H new ATOM 1442 N THR A 94 4.385 -12.238 -7.372 1.00 0.00 N ATOM 1443 CA THR A 94 4.345 -10.807 -7.064 1.00 0.00 C ATOM 1444 C THR A 94 4.448 -9.976 -8.341 1.00 0.00 C ATOM 1445 O THR A 94 3.731 -8.986 -8.504 1.00 0.00 O ATOM 1446 CB THR A 94 5.472 -10.420 -6.099 1.00 0.00 C ATOM 1447 OG1 THR A 94 6.671 -11.100 -6.421 1.00 0.00 O ATOM 1448 CG2 THR A 94 5.152 -10.718 -4.652 1.00 0.00 C ATOM 0 H THR A 94 5.199 -12.729 -7.001 1.00 0.00 H new ATOM 0 HA THR A 94 3.389 -10.599 -6.583 1.00 0.00 H new ATOM 0 HB THR A 94 5.587 -9.342 -6.215 1.00 0.00 H new ATOM 0 HG1 THR A 94 6.646 -11.380 -7.360 1.00 0.00 H new ATOM 0 HG21 THR A 94 5.992 -10.420 -4.025 1.00 0.00 H new ATOM 0 HG22 THR A 94 4.262 -10.164 -4.355 1.00 0.00 H new ATOM 0 HG23 THR A 94 4.971 -11.786 -4.532 1.00 0.00 H new ATOM 1456 N GLY A 95 5.335 -10.388 -9.251 1.00 0.00 N ATOM 1457 CA GLY A 95 5.502 -9.673 -10.504 1.00 0.00 C ATOM 1458 C GLY A 95 4.212 -9.602 -11.297 1.00 0.00 C ATOM 1459 O GLY A 95 3.811 -8.527 -11.743 1.00 0.00 O ATOM 0 H GLY A 95 5.938 -11.203 -9.140 1.00 0.00 H new ATOM 0 HA2 GLY A 95 5.857 -8.663 -10.300 1.00 0.00 H new ATOM 0 HA3 GLY A 95 6.268 -10.166 -11.103 1.00 0.00 H new ATOM 1463 N THR A 96 3.556 -10.751 -11.464 1.00 0.00 N ATOM 1464 CA THR A 96 2.297 -10.811 -12.203 1.00 0.00 C ATOM 1465 C THR A 96 1.139 -10.211 -11.392 1.00 0.00 C ATOM 1466 O THR A 96 0.194 -9.666 -11.965 1.00 0.00 O ATOM 1467 CB THR A 96 1.977 -12.256 -12.611 1.00 0.00 C ATOM 1468 OG1 THR A 96 0.767 -12.316 -13.345 1.00 0.00 O ATOM 1469 CG2 THR A 96 1.846 -13.207 -11.441 1.00 0.00 C ATOM 0 H THR A 96 3.875 -11.648 -11.099 1.00 0.00 H new ATOM 0 HA THR A 96 2.415 -10.212 -13.106 1.00 0.00 H new ATOM 0 HB THR A 96 2.828 -12.570 -13.216 1.00 0.00 H new ATOM 0 HG1 THR A 96 0.583 -13.245 -13.596 1.00 0.00 H new ATOM 0 HG21 THR A 96 1.620 -14.208 -11.809 1.00 0.00 H new ATOM 0 HG22 THR A 96 2.782 -13.229 -10.883 1.00 0.00 H new ATOM 0 HG23 THR A 96 1.042 -12.870 -10.787 1.00 0.00 H new ATOM 1477 N ASP A 97 1.218 -10.310 -10.059 1.00 0.00 N ATOM 1478 CA ASP A 97 0.174 -9.770 -9.178 1.00 0.00 C ATOM 1479 C ASP A 97 -0.006 -8.269 -9.397 1.00 0.00 C ATOM 1480 O ASP A 97 -1.133 -7.771 -9.449 1.00 0.00 O ATOM 1481 CB ASP A 97 0.520 -10.042 -7.708 1.00 0.00 C ATOM 1482 CG ASP A 97 -0.618 -9.700 -6.759 1.00 0.00 C ATOM 1483 OD1 ASP A 97 -1.044 -8.525 -6.733 1.00 0.00 O ATOM 1484 OD2 ASP A 97 -1.075 -10.605 -6.033 1.00 0.00 O ATOM 0 H ASP A 97 1.992 -10.758 -9.568 1.00 0.00 H new ATOM 0 HA ASP A 97 -0.762 -10.271 -9.424 1.00 0.00 H new ATOM 0 HB2 ASP A 97 0.781 -11.094 -7.590 1.00 0.00 H new ATOM 0 HB3 ASP A 97 1.401 -9.462 -7.434 1.00 0.00 H new ATOM 1489 N LYS A 98 1.113 -7.554 -9.525 1.00 0.00 N ATOM 1490 CA LYS A 98 1.087 -6.107 -9.740 1.00 0.00 C ATOM 1491 C LYS A 98 0.213 -5.744 -10.940 1.00 0.00 C ATOM 1492 O LYS A 98 -0.423 -4.691 -10.954 1.00 0.00 O ATOM 1493 CB LYS A 98 2.507 -5.573 -9.943 1.00 0.00 C ATOM 1494 CG LYS A 98 2.616 -4.065 -9.774 1.00 0.00 C ATOM 1495 CD LYS A 98 3.953 -3.536 -10.274 1.00 0.00 C ATOM 1496 CE LYS A 98 4.858 -3.125 -9.122 1.00 0.00 C ATOM 1497 NZ LYS A 98 5.449 -4.304 -8.424 1.00 0.00 N ATOM 0 H LYS A 98 2.050 -7.955 -9.483 1.00 0.00 H new ATOM 0 HA LYS A 98 0.657 -5.643 -8.852 1.00 0.00 H new ATOM 0 HB2 LYS A 98 3.175 -6.060 -9.233 1.00 0.00 H new ATOM 0 HB3 LYS A 98 2.850 -5.845 -10.941 1.00 0.00 H new ATOM 0 HG2 LYS A 98 1.806 -3.579 -10.318 1.00 0.00 H new ATOM 0 HG3 LYS A 98 2.493 -3.807 -8.722 1.00 0.00 H new ATOM 0 HD2 LYS A 98 4.448 -4.302 -10.871 1.00 0.00 H new ATOM 0 HD3 LYS A 98 3.785 -2.681 -10.929 1.00 0.00 H new ATOM 0 HE2 LYS A 98 5.659 -2.489 -9.500 1.00 0.00 H new ATOM 0 HE3 LYS A 98 4.288 -2.530 -8.408 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 5.158 -4.298 -7.425 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 5.115 -5.179 -8.877 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 6.486 -4.258 -8.483 1.00 0.00 H new ATOM 1511 N THR A 99 0.185 -6.625 -11.940 1.00 0.00 N ATOM 1512 CA THR A 99 -0.615 -6.401 -13.141 1.00 0.00 C ATOM 1513 C THR A 99 -2.102 -6.633 -12.861 1.00 0.00 C ATOM 1514 O THR A 99 -2.953 -5.875 -13.328 1.00 0.00 O ATOM 1515 CB THR A 99 -0.143 -7.326 -14.269 1.00 0.00 C ATOM 1516 OG1 THR A 99 1.235 -7.129 -14.538 1.00 0.00 O ATOM 1517 CG2 THR A 99 -0.897 -7.129 -15.569 1.00 0.00 C ATOM 0 H THR A 99 0.708 -7.501 -11.941 1.00 0.00 H new ATOM 0 HA THR A 99 -0.483 -5.364 -13.449 1.00 0.00 H new ATOM 0 HB THR A 99 -0.336 -8.336 -13.908 1.00 0.00 H new ATOM 0 HG1 THR A 99 1.517 -7.730 -15.259 1.00 0.00 H new ATOM 0 HG21 THR A 99 -0.510 -7.816 -16.322 1.00 0.00 H new ATOM 0 HG22 THR A 99 -1.957 -7.326 -15.408 1.00 0.00 H new ATOM 0 HG23 THR A 99 -0.767 -6.103 -15.913 1.00 0.00 H new ATOM 1525 N LEU A 100 -2.402 -7.685 -12.098 1.00 0.00 N ATOM 1526 CA LEU A 100 -3.779 -8.027 -11.754 1.00 0.00 C ATOM 1527 C LEU A 100 -4.448 -6.908 -10.957 1.00 0.00 C ATOM 1528 O LEU A 100 -5.557 -6.480 -11.284 1.00 0.00 O ATOM 1529 CB LEU A 100 -3.805 -9.332 -10.956 1.00 0.00 C ATOM 1530 CG LEU A 100 -3.102 -10.516 -11.629 1.00 0.00 C ATOM 1531 CD1 LEU A 100 -2.770 -11.596 -10.612 1.00 0.00 C ATOM 1532 CD2 LEU A 100 -3.966 -11.080 -12.746 1.00 0.00 C ATOM 0 H LEU A 100 -1.704 -8.317 -11.706 1.00 0.00 H new ATOM 0 HA LEU A 100 -4.339 -8.157 -12.680 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -3.340 -9.156 -9.986 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -4.843 -9.605 -10.767 1.00 0.00 H new ATOM 0 HG LEU A 100 -2.167 -10.159 -12.061 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -2.272 -12.426 -11.112 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -2.111 -11.185 -9.847 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -3.689 -11.952 -10.146 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -3.453 -11.920 -13.214 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -4.917 -11.419 -12.335 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -4.149 -10.306 -13.491 1.00 0.00 H new ATOM 1544 N VAL A 101 -3.764 -6.432 -9.915 1.00 0.00 N ATOM 1545 CA VAL A 101 -4.289 -5.356 -9.076 1.00 0.00 C ATOM 1546 C VAL A 101 -4.428 -4.059 -9.875 1.00 0.00 C ATOM 1547 O VAL A 101 -5.387 -3.305 -9.692 1.00 0.00 O ATOM 1548 CB VAL A 101 -3.387 -5.109 -7.845 1.00 0.00 C ATOM 1549 CG1 VAL A 101 -3.949 -3.994 -6.976 1.00 0.00 C ATOM 1550 CG2 VAL A 101 -3.223 -6.388 -7.037 1.00 0.00 C ATOM 0 H VAL A 101 -2.846 -6.775 -9.633 1.00 0.00 H new ATOM 0 HA VAL A 101 -5.274 -5.670 -8.729 1.00 0.00 H new ATOM 0 HB VAL A 101 -2.405 -4.798 -8.201 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -3.297 -3.839 -6.116 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -4.008 -3.074 -7.558 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -4.946 -4.269 -6.631 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -2.585 -6.194 -6.175 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -4.200 -6.731 -6.696 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -2.766 -7.156 -7.661 1.00 0.00 H new ATOM 1560 N LYS A 102 -3.469 -3.811 -10.768 1.00 0.00 N ATOM 1561 CA LYS A 102 -3.483 -2.615 -11.607 1.00 0.00 C ATOM 1562 C LYS A 102 -4.719 -2.591 -12.509 1.00 0.00 C ATOM 1563 O LYS A 102 -5.269 -1.525 -12.791 1.00 0.00 O ATOM 1564 CB LYS A 102 -2.216 -2.559 -12.464 1.00 0.00 C ATOM 1565 CG LYS A 102 -1.866 -1.161 -12.947 1.00 0.00 C ATOM 1566 CD LYS A 102 -0.361 -0.952 -13.003 1.00 0.00 C ATOM 1567 CE LYS A 102 0.033 -0.024 -14.143 1.00 0.00 C ATOM 1568 NZ LYS A 102 0.461 1.315 -13.650 1.00 0.00 N ATOM 0 H LYS A 102 -2.671 -4.426 -10.928 1.00 0.00 H new ATOM 0 HA LYS A 102 -3.517 -1.744 -10.953 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -1.380 -2.954 -11.887 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -2.343 -3.211 -13.328 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -2.294 -0.999 -13.936 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -2.313 -0.422 -12.281 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -0.015 -0.535 -12.057 1.00 0.00 H new ATOM 0 HD3 LYS A 102 0.136 -1.914 -13.128 1.00 0.00 H new ATOM 0 HE2 LYS A 102 0.844 -0.476 -14.715 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -0.810 0.093 -14.823 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -0.229 2.033 -13.952 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 0.515 1.302 -12.611 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 1.396 1.547 -14.042 1.00 0.00 H new ATOM 1582 N GLU A 103 -5.142 -3.771 -12.961 1.00 0.00 N ATOM 1583 CA GLU A 103 -6.306 -3.893 -13.837 1.00 0.00 C ATOM 1584 C GLU A 103 -7.612 -3.708 -13.061 1.00 0.00 C ATOM 1585 O GLU A 103 -8.493 -2.963 -13.492 1.00 0.00 O ATOM 1586 CB GLU A 103 -6.295 -5.256 -14.533 1.00 0.00 C ATOM 1587 CG GLU A 103 -7.014 -5.267 -15.873 1.00 0.00 C ATOM 1588 CD GLU A 103 -7.167 -6.666 -16.438 1.00 0.00 C ATOM 1589 OE1 GLU A 103 -8.065 -7.400 -15.971 1.00 0.00 O ATOM 1590 OE2 GLU A 103 -6.389 -7.030 -17.344 1.00 0.00 O ATOM 0 H GLU A 103 -4.694 -4.659 -12.734 1.00 0.00 H new ATOM 0 HA GLU A 103 -6.249 -3.104 -14.586 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -5.262 -5.568 -14.683 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -6.758 -5.992 -13.877 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -7.999 -4.816 -15.757 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -6.463 -4.650 -16.583 1.00 0.00 H new ATOM 1597 N VAL A 104 -7.733 -4.390 -11.919 1.00 0.00 N ATOM 1598 CA VAL A 104 -8.939 -4.295 -11.095 1.00 0.00 C ATOM 1599 C VAL A 104 -9.102 -2.894 -10.498 1.00 0.00 C ATOM 1600 O VAL A 104 -10.218 -2.379 -10.412 1.00 0.00 O ATOM 1601 CB VAL A 104 -8.942 -5.349 -9.960 1.00 0.00 C ATOM 1602 CG1 VAL A 104 -7.815 -5.094 -8.971 1.00 0.00 C ATOM 1603 CG2 VAL A 104 -10.285 -5.371 -9.245 1.00 0.00 C ATOM 0 H VAL A 104 -7.014 -5.011 -11.546 1.00 0.00 H new ATOM 0 HA VAL A 104 -9.783 -4.495 -11.755 1.00 0.00 H new ATOM 0 HB VAL A 104 -8.778 -6.326 -10.414 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -7.842 -5.849 -8.186 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -6.858 -5.144 -9.490 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -7.936 -4.106 -8.528 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -10.263 -6.119 -8.452 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -10.483 -4.390 -8.813 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -11.072 -5.620 -9.957 1.00 0.00 H new ATOM 1613 N VAL A 105 -7.989 -2.278 -10.092 1.00 0.00 N ATOM 1614 CA VAL A 105 -8.023 -0.938 -9.510 1.00 0.00 C ATOM 1615 C VAL A 105 -7.041 -0.008 -10.221 1.00 0.00 C ATOM 1616 O VAL A 105 -5.839 -0.277 -10.268 1.00 0.00 O ATOM 1617 CB VAL A 105 -7.700 -0.963 -8.000 1.00 0.00 C ATOM 1618 CG1 VAL A 105 -7.838 0.429 -7.396 1.00 0.00 C ATOM 1619 CG2 VAL A 105 -8.599 -1.954 -7.273 1.00 0.00 C ATOM 0 H VAL A 105 -7.056 -2.686 -10.156 1.00 0.00 H new ATOM 0 HA VAL A 105 -9.037 -0.562 -9.642 1.00 0.00 H new ATOM 0 HB VAL A 105 -6.666 -1.287 -7.879 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -7.606 0.388 -6.332 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -7.148 1.111 -7.892 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -8.859 0.785 -7.531 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -8.355 -1.956 -6.211 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -9.641 -1.664 -7.405 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -8.445 -2.953 -7.682 1.00 0.00 H new ATOM 1629 N GLN A 106 -7.566 1.085 -10.775 1.00 0.00 N ATOM 1630 CA GLN A 106 -6.744 2.062 -11.491 1.00 0.00 C ATOM 1631 C GLN A 106 -6.825 3.456 -10.855 1.00 0.00 C ATOM 1632 O GLN A 106 -6.241 4.410 -11.372 1.00 0.00 O ATOM 1633 CB GLN A 106 -7.184 2.137 -12.955 1.00 0.00 C ATOM 1634 CG GLN A 106 -6.278 1.374 -13.909 1.00 0.00 C ATOM 1635 CD GLN A 106 -7.055 0.607 -14.962 1.00 0.00 C ATOM 1636 OE1 GLN A 106 -7.515 1.181 -15.950 1.00 0.00 O ATOM 1637 NE2 GLN A 106 -7.208 -0.696 -14.759 1.00 0.00 N ATOM 0 H GLN A 106 -8.559 1.317 -10.742 1.00 0.00 H new ATOM 0 HA GLN A 106 -5.708 1.729 -11.430 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -8.198 1.745 -13.040 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -7.219 3.183 -13.261 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -5.601 2.074 -14.400 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -5.660 0.679 -13.340 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -6.811 -1.133 -13.927 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -7.723 -1.260 -15.435 1.00 0.00 H new ATOM 1646 N ASN A 107 -7.548 3.575 -9.738 1.00 0.00 N ATOM 1647 CA ASN A 107 -7.695 4.857 -9.054 1.00 0.00 C ATOM 1648 C ASN A 107 -6.583 5.062 -8.026 1.00 0.00 C ATOM 1649 O ASN A 107 -6.808 4.951 -6.819 1.00 0.00 O ATOM 1650 CB ASN A 107 -9.065 4.943 -8.374 1.00 0.00 C ATOM 1651 CG ASN A 107 -10.202 5.075 -9.368 1.00 0.00 C ATOM 1652 OD1 ASN A 107 -10.578 6.182 -9.755 1.00 0.00 O ATOM 1653 ND2 ASN A 107 -10.763 3.945 -9.788 1.00 0.00 N ATOM 0 H ASN A 107 -8.038 2.800 -9.291 1.00 0.00 H new ATOM 0 HA ASN A 107 -7.619 5.648 -9.800 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -9.221 4.052 -7.765 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -9.078 5.798 -7.697 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -11.534 3.976 -10.455 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -10.422 3.048 -9.443 1.00 0.00 H new ATOM 1660 N PHE A 108 -5.381 5.362 -8.513 1.00 0.00 N ATOM 1661 CA PHE A 108 -4.233 5.586 -7.640 1.00 0.00 C ATOM 1662 C PHE A 108 -3.301 6.651 -8.217 1.00 0.00 C ATOM 1663 O PHE A 108 -3.174 6.784 -9.435 1.00 0.00 O ATOM 1664 CB PHE A 108 -3.467 4.275 -7.413 1.00 0.00 C ATOM 1665 CG PHE A 108 -3.081 3.563 -8.680 1.00 0.00 C ATOM 1666 CD1 PHE A 108 -2.010 4.005 -9.440 1.00 0.00 C ATOM 1667 CD2 PHE A 108 -3.784 2.449 -9.108 1.00 0.00 C ATOM 1668 CE1 PHE A 108 -1.649 3.352 -10.601 1.00 0.00 C ATOM 1669 CE2 PHE A 108 -3.427 1.790 -10.269 1.00 0.00 C ATOM 1670 CZ PHE A 108 -2.359 2.243 -11.016 1.00 0.00 C ATOM 0 H PHE A 108 -5.177 5.455 -9.508 1.00 0.00 H new ATOM 0 HA PHE A 108 -4.606 5.946 -6.681 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -2.565 4.488 -6.839 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -4.080 3.609 -6.807 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -1.451 4.872 -9.120 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -4.621 2.091 -8.527 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -0.812 3.708 -11.184 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -3.983 0.922 -10.591 1.00 0.00 H new ATOM 0 HZ PHE A 108 -2.079 1.731 -11.924 1.00 0.00 H new ATOM 1680 N ALA A 109 -2.654 7.408 -7.330 1.00 0.00 N ATOM 1681 CA ALA A 109 -1.735 8.465 -7.747 1.00 0.00 C ATOM 1682 C ALA A 109 -0.337 7.912 -8.019 1.00 0.00 C ATOM 1683 O ALA A 109 0.313 8.304 -8.991 1.00 0.00 O ATOM 1684 CB ALA A 109 -1.669 9.561 -6.693 1.00 0.00 C ATOM 0 H ALA A 109 -2.750 7.308 -6.319 1.00 0.00 H new ATOM 0 HA ALA A 109 -2.118 8.889 -8.675 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -0.980 10.340 -7.020 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -2.661 9.990 -6.552 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -1.319 9.139 -5.751 1.00 0.00 H new ATOM 1690 N LYS A 110 0.125 7.008 -7.155 1.00 0.00 N ATOM 1691 CA LYS A 110 1.450 6.409 -7.305 1.00 0.00 C ATOM 1692 C LYS A 110 1.497 5.011 -6.689 1.00 0.00 C ATOM 1693 O LYS A 110 0.653 4.656 -5.863 1.00 0.00 O ATOM 1694 CB LYS A 110 2.516 7.299 -6.660 1.00 0.00 C ATOM 1695 CG LYS A 110 2.199 7.697 -5.226 1.00 0.00 C ATOM 1696 CD LYS A 110 2.671 9.110 -4.919 1.00 0.00 C ATOM 1697 CE LYS A 110 1.662 10.153 -5.380 1.00 0.00 C ATOM 1698 NZ LYS A 110 1.861 10.534 -6.808 1.00 0.00 N ATOM 0 H LYS A 110 -0.398 6.675 -6.345 1.00 0.00 H new ATOM 0 HA LYS A 110 1.657 6.321 -8.372 1.00 0.00 H new ATOM 0 HB2 LYS A 110 3.472 6.776 -6.679 1.00 0.00 H new ATOM 0 HB3 LYS A 110 2.634 8.201 -7.260 1.00 0.00 H new ATOM 0 HG2 LYS A 110 1.124 7.627 -5.058 1.00 0.00 H new ATOM 0 HG3 LYS A 110 2.675 6.997 -4.540 1.00 0.00 H new ATOM 0 HD2 LYS A 110 2.837 9.213 -3.847 1.00 0.00 H new ATOM 0 HD3 LYS A 110 3.628 9.288 -5.409 1.00 0.00 H new ATOM 0 HE2 LYS A 110 0.653 9.764 -5.246 1.00 0.00 H new ATOM 0 HE3 LYS A 110 1.747 11.041 -4.753 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 1.351 11.419 -7.006 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 2.875 10.670 -6.993 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 1.496 9.779 -7.423 1.00 0.00 H new ATOM 1712 N GLU A 111 2.486 4.224 -7.104 1.00 0.00 N ATOM 1713 CA GLU A 111 2.647 2.862 -6.601 1.00 0.00 C ATOM 1714 C GLU A 111 4.115 2.446 -6.617 1.00 0.00 C ATOM 1715 O GLU A 111 4.762 2.457 -7.666 1.00 0.00 O ATOM 1716 CB GLU A 111 1.822 1.884 -7.443 1.00 0.00 C ATOM 1717 CG GLU A 111 2.008 2.063 -8.944 1.00 0.00 C ATOM 1718 CD GLU A 111 1.227 1.051 -9.764 1.00 0.00 C ATOM 1719 OE1 GLU A 111 1.204 -0.139 -9.383 1.00 0.00 O ATOM 1720 OE2 GLU A 111 0.645 1.449 -10.794 1.00 0.00 O ATOM 0 H GLU A 111 3.189 4.506 -7.788 1.00 0.00 H new ATOM 0 HA GLU A 111 2.290 2.838 -5.571 1.00 0.00 H new ATOM 0 HB2 GLU A 111 2.094 0.864 -7.171 1.00 0.00 H new ATOM 0 HB3 GLU A 111 0.767 2.008 -7.199 1.00 0.00 H new ATOM 0 HG2 GLU A 111 1.696 3.069 -9.226 1.00 0.00 H new ATOM 0 HG3 GLU A 111 3.067 1.978 -9.186 1.00 0.00 H new ATOM 1727 N PHE A 112 4.633 2.068 -5.453 1.00 0.00 N ATOM 1728 CA PHE A 112 6.023 1.636 -5.344 1.00 0.00 C ATOM 1729 C PHE A 112 6.148 0.406 -4.450 1.00 0.00 C ATOM 1730 O PHE A 112 5.214 0.049 -3.728 1.00 0.00 O ATOM 1731 CB PHE A 112 6.916 2.767 -4.816 1.00 0.00 C ATOM 1732 CG PHE A 112 6.318 3.564 -3.689 1.00 0.00 C ATOM 1733 CD1 PHE A 112 6.447 3.139 -2.375 1.00 0.00 C ATOM 1734 CD2 PHE A 112 5.640 4.745 -3.943 1.00 0.00 C ATOM 1735 CE1 PHE A 112 5.907 3.878 -1.338 1.00 0.00 C ATOM 1736 CE2 PHE A 112 5.101 5.488 -2.910 1.00 0.00 C ATOM 1737 CZ PHE A 112 5.235 5.053 -1.606 1.00 0.00 C ATOM 0 H PHE A 112 4.114 2.052 -4.575 1.00 0.00 H new ATOM 0 HA PHE A 112 6.361 1.370 -6.346 1.00 0.00 H new ATOM 0 HB2 PHE A 112 7.860 2.339 -4.480 1.00 0.00 H new ATOM 0 HB3 PHE A 112 7.147 3.443 -5.639 1.00 0.00 H new ATOM 0 HD1 PHE A 112 6.975 2.222 -2.159 1.00 0.00 H new ATOM 0 HD2 PHE A 112 5.531 5.089 -4.961 1.00 0.00 H new ATOM 0 HE1 PHE A 112 6.011 3.536 -0.319 1.00 0.00 H new ATOM 0 HE2 PHE A 112 4.576 6.408 -3.122 1.00 0.00 H new ATOM 0 HZ PHE A 112 4.814 5.632 -0.797 1.00 0.00 H new ATOM 1747 N VAL A 113 7.311 -0.235 -4.509 1.00 0.00 N ATOM 1748 CA VAL A 113 7.577 -1.426 -3.714 1.00 0.00 C ATOM 1749 C VAL A 113 8.603 -1.128 -2.627 1.00 0.00 C ATOM 1750 O VAL A 113 9.577 -0.410 -2.861 1.00 0.00 O ATOM 1751 CB VAL A 113 8.087 -2.589 -4.593 1.00 0.00 C ATOM 1752 CG1 VAL A 113 8.204 -3.872 -3.781 1.00 0.00 C ATOM 1753 CG2 VAL A 113 7.174 -2.795 -5.794 1.00 0.00 C ATOM 0 H VAL A 113 8.088 0.054 -5.103 1.00 0.00 H new ATOM 0 HA VAL A 113 6.635 -1.725 -3.253 1.00 0.00 H new ATOM 0 HB VAL A 113 9.080 -2.327 -4.958 1.00 0.00 H new ATOM 0 HG11 VAL A 113 8.565 -4.676 -4.422 1.00 0.00 H new ATOM 0 HG12 VAL A 113 8.904 -3.720 -2.960 1.00 0.00 H new ATOM 0 HG13 VAL A 113 7.226 -4.139 -3.379 1.00 0.00 H new ATOM 0 HG21 VAL A 113 7.551 -3.619 -6.400 1.00 0.00 H new ATOM 0 HG22 VAL A 113 6.167 -3.029 -5.449 1.00 0.00 H new ATOM 0 HG23 VAL A 113 7.150 -1.885 -6.393 1.00 0.00 H new ATOM 1763 N ILE A 114 8.374 -1.678 -1.438 1.00 0.00 N ATOM 1764 CA ILE A 114 9.274 -1.467 -0.312 1.00 0.00 C ATOM 1765 C ILE A 114 9.625 -2.787 0.365 1.00 0.00 C ATOM 1766 O ILE A 114 8.839 -3.738 0.348 1.00 0.00 O ATOM 1767 CB ILE A 114 8.658 -0.503 0.727 1.00 0.00 C ATOM 1768 CG1 ILE A 114 8.203 0.791 0.048 1.00 0.00 C ATOM 1769 CG2 ILE A 114 9.651 -0.195 1.841 1.00 0.00 C ATOM 1770 CD1 ILE A 114 9.335 1.608 -0.543 1.00 0.00 C ATOM 0 H ILE A 114 7.572 -2.273 -1.231 1.00 0.00 H new ATOM 0 HA ILE A 114 10.184 -1.019 -0.710 1.00 0.00 H new ATOM 0 HB ILE A 114 7.790 -0.991 1.171 1.00 0.00 H new ATOM 0 HG12 ILE A 114 7.495 0.545 -0.743 1.00 0.00 H new ATOM 0 HG13 ILE A 114 7.668 1.402 0.775 1.00 0.00 H new ATOM 0 HG21 ILE A 114 9.193 0.485 2.559 1.00 0.00 H new ATOM 0 HG22 ILE A 114 9.931 -1.120 2.345 1.00 0.00 H new ATOM 0 HG23 ILE A 114 10.541 0.270 1.417 1.00 0.00 H new ATOM 0 HD11 ILE A 114 8.931 2.508 -1.006 1.00 0.00 H new ATOM 0 HD12 ILE A 114 10.033 1.887 0.246 1.00 0.00 H new ATOM 0 HD13 ILE A 114 9.856 1.016 -1.295 1.00 0.00 H new ATOM 1782 N SER A 115 10.812 -2.834 0.957 1.00 0.00 N ATOM 1783 CA SER A 115 11.284 -4.032 1.647 1.00 0.00 C ATOM 1784 C SER A 115 12.165 -3.665 2.844 1.00 0.00 C ATOM 1785 O SER A 115 13.067 -4.416 3.220 1.00 0.00 O ATOM 1786 CB SER A 115 12.047 -4.934 0.674 1.00 0.00 C ATOM 1787 OG SER A 115 12.128 -6.263 1.159 1.00 0.00 O ATOM 0 H SER A 115 11.469 -2.054 0.974 1.00 0.00 H new ATOM 0 HA SER A 115 10.417 -4.575 2.024 1.00 0.00 H new ATOM 0 HB2 SER A 115 11.550 -4.928 -0.296 1.00 0.00 H new ATOM 0 HB3 SER A 115 13.051 -4.539 0.520 1.00 0.00 H new ATOM 0 HG SER A 115 11.234 -6.664 1.166 1.00 0.00 H new ATOM 1793 N ASP A 116 11.891 -2.503 3.439 1.00 0.00 N ATOM 1794 CA ASP A 116 12.644 -2.025 4.593 1.00 0.00 C ATOM 1795 C ASP A 116 11.703 -1.429 5.639 1.00 0.00 C ATOM 1796 O ASP A 116 10.783 -0.681 5.300 1.00 0.00 O ATOM 1797 CB ASP A 116 13.673 -0.979 4.156 1.00 0.00 C ATOM 1798 CG ASP A 116 14.610 -0.584 5.278 1.00 0.00 C ATOM 1799 OD1 ASP A 116 15.396 -1.442 5.730 1.00 0.00 O ATOM 1800 OD2 ASP A 116 14.553 0.587 5.708 1.00 0.00 O ATOM 0 H ASP A 116 11.147 -1.874 3.136 1.00 0.00 H new ATOM 0 HA ASP A 116 13.166 -2.872 5.038 1.00 0.00 H new ATOM 0 HB2 ASP A 116 14.255 -1.372 3.322 1.00 0.00 H new ATOM 0 HB3 ASP A 116 13.153 -0.093 3.792 1.00 0.00 H new ATOM 1805 N ARG A 117 11.936 -1.766 6.908 1.00 0.00 N ATOM 1806 CA ARG A 117 11.105 -1.261 8.002 1.00 0.00 C ATOM 1807 C ARG A 117 11.219 0.259 8.130 1.00 0.00 C ATOM 1808 O ARG A 117 10.237 0.936 8.443 1.00 0.00 O ATOM 1809 CB ARG A 117 11.493 -1.927 9.324 1.00 0.00 C ATOM 1810 CG ARG A 117 10.299 -2.363 10.159 1.00 0.00 C ATOM 1811 CD ARG A 117 10.675 -3.458 11.148 1.00 0.00 C ATOM 1812 NE ARG A 117 9.644 -4.493 11.239 1.00 0.00 N ATOM 1813 CZ ARG A 117 9.567 -5.387 12.229 1.00 0.00 C ATOM 1814 NH1 ARG A 117 10.464 -5.386 13.212 1.00 0.00 N ATOM 1815 NH2 ARG A 117 8.590 -6.285 12.235 1.00 0.00 N ATOM 0 H ARG A 117 12.691 -2.385 7.203 1.00 0.00 H new ATOM 0 HA ARG A 117 10.069 -1.508 7.771 1.00 0.00 H new ATOM 0 HB2 ARG A 117 12.116 -2.796 9.114 1.00 0.00 H new ATOM 0 HB3 ARG A 117 12.099 -1.233 9.907 1.00 0.00 H new ATOM 0 HG2 ARG A 117 9.900 -1.505 10.700 1.00 0.00 H new ATOM 0 HG3 ARG A 117 9.507 -2.722 9.502 1.00 0.00 H new ATOM 0 HD2 ARG A 117 11.618 -3.912 10.845 1.00 0.00 H new ATOM 0 HD3 ARG A 117 10.835 -3.018 12.132 1.00 0.00 H new ATOM 0 HE ARG A 117 8.941 -4.534 10.501 1.00 0.00 H new ATOM 0 HH11 ARG A 117 11.218 -4.699 13.214 1.00 0.00 H new ATOM 0 HH12 ARG A 117 10.398 -6.072 13.964 1.00 0.00 H new ATOM 0 HH21 ARG A 117 7.899 -6.292 11.485 1.00 0.00 H new ATOM 0 HH22 ARG A 117 8.530 -6.968 12.990 1.00 0.00 H new ATOM 1829 N LYS A 118 12.417 0.789 7.879 1.00 0.00 N ATOM 1830 CA LYS A 118 12.650 2.229 7.959 1.00 0.00 C ATOM 1831 C LYS A 118 11.858 2.959 6.876 1.00 0.00 C ATOM 1832 O LYS A 118 11.260 4.005 7.132 1.00 0.00 O ATOM 1833 CB LYS A 118 14.144 2.540 7.820 1.00 0.00 C ATOM 1834 CG LYS A 118 14.591 3.763 8.607 1.00 0.00 C ATOM 1835 CD LYS A 118 15.745 4.476 7.921 1.00 0.00 C ATOM 1836 CE LYS A 118 16.686 5.115 8.931 1.00 0.00 C ATOM 1837 NZ LYS A 118 15.997 6.138 9.767 1.00 0.00 N ATOM 0 H LYS A 118 13.238 0.243 7.619 1.00 0.00 H new ATOM 0 HA LYS A 118 12.311 2.577 8.935 1.00 0.00 H new ATOM 0 HB2 LYS A 118 14.718 1.675 8.153 1.00 0.00 H new ATOM 0 HB3 LYS A 118 14.378 2.692 6.766 1.00 0.00 H new ATOM 0 HG2 LYS A 118 13.753 4.451 8.720 1.00 0.00 H new ATOM 0 HG3 LYS A 118 14.893 3.461 9.610 1.00 0.00 H new ATOM 0 HD2 LYS A 118 16.298 3.766 7.305 1.00 0.00 H new ATOM 0 HD3 LYS A 118 15.354 5.242 7.251 1.00 0.00 H new ATOM 0 HE2 LYS A 118 17.105 4.342 9.576 1.00 0.00 H new ATOM 0 HE3 LYS A 118 17.521 5.579 8.406 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 16.691 6.608 10.383 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 15.547 6.844 9.150 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 15.272 5.677 10.352 1.00 0.00 H new ATOM 1851 N GLU A 119 11.847 2.389 5.670 1.00 0.00 N ATOM 1852 CA GLU A 119 11.111 2.973 4.552 1.00 0.00 C ATOM 1853 C GLU A 119 9.606 2.768 4.733 1.00 0.00 C ATOM 1854 O GLU A 119 8.803 3.609 4.328 1.00 0.00 O ATOM 1855 CB GLU A 119 11.564 2.348 3.231 1.00 0.00 C ATOM 1856 CG GLU A 119 12.708 3.092 2.560 1.00 0.00 C ATOM 1857 CD GLU A 119 13.622 2.166 1.779 1.00 0.00 C ATOM 1858 OE1 GLU A 119 13.104 1.344 0.991 1.00 0.00 O ATOM 1859 OE2 GLU A 119 14.854 2.261 1.956 1.00 0.00 O ATOM 0 H GLU A 119 12.339 1.525 5.444 1.00 0.00 H new ATOM 0 HA GLU A 119 11.320 4.043 4.529 1.00 0.00 H new ATOM 0 HB2 GLU A 119 11.870 1.318 3.413 1.00 0.00 H new ATOM 0 HB3 GLU A 119 10.716 2.312 2.547 1.00 0.00 H new ATOM 0 HG2 GLU A 119 12.301 3.848 1.888 1.00 0.00 H new ATOM 0 HG3 GLU A 119 13.289 3.618 3.317 1.00 0.00 H new ATOM 1866 N LEU A 120 9.235 1.639 5.347 1.00 0.00 N ATOM 1867 CA LEU A 120 7.832 1.307 5.594 1.00 0.00 C ATOM 1868 C LEU A 120 7.160 2.350 6.488 1.00 0.00 C ATOM 1869 O LEU A 120 5.972 2.635 6.334 1.00 0.00 O ATOM 1870 CB LEU A 120 7.720 -0.075 6.249 1.00 0.00 C ATOM 1871 CG LEU A 120 7.257 -1.206 5.326 1.00 0.00 C ATOM 1872 CD1 LEU A 120 6.997 -2.473 6.130 1.00 0.00 C ATOM 1873 CD2 LEU A 120 6.010 -0.797 4.550 1.00 0.00 C ATOM 0 H LEU A 120 9.894 0.937 5.683 1.00 0.00 H new ATOM 0 HA LEU A 120 7.322 1.298 4.631 1.00 0.00 H new ATOM 0 HB2 LEU A 120 8.693 -0.342 6.662 1.00 0.00 H new ATOM 0 HB3 LEU A 120 7.026 -0.006 7.087 1.00 0.00 H new ATOM 0 HG LEU A 120 8.051 -1.408 4.607 1.00 0.00 H new ATOM 0 HD11 LEU A 120 6.669 -3.268 5.460 1.00 0.00 H new ATOM 0 HD12 LEU A 120 7.914 -2.779 6.634 1.00 0.00 H new ATOM 0 HD13 LEU A 120 6.222 -2.280 6.872 1.00 0.00 H new ATOM 0 HD21 LEU A 120 5.700 -1.616 3.901 1.00 0.00 H new ATOM 0 HD22 LEU A 120 5.207 -0.564 5.249 1.00 0.00 H new ATOM 0 HD23 LEU A 120 6.230 0.082 3.944 1.00 0.00 H new ATOM 1885 N GLU A 121 7.933 2.907 7.425 1.00 0.00 N ATOM 1886 CA GLU A 121 7.436 3.916 8.359 1.00 0.00 C ATOM 1887 C GLU A 121 6.564 4.952 7.647 1.00 0.00 C ATOM 1888 O GLU A 121 6.948 5.502 6.613 1.00 0.00 O ATOM 1889 CB GLU A 121 8.617 4.598 9.052 1.00 0.00 C ATOM 1890 CG GLU A 121 8.220 5.510 10.203 1.00 0.00 C ATOM 1891 CD GLU A 121 9.293 6.531 10.536 1.00 0.00 C ATOM 1892 OE1 GLU A 121 9.871 7.119 9.596 1.00 0.00 O ATOM 1893 OE2 GLU A 121 9.555 6.745 11.738 1.00 0.00 O ATOM 0 H GLU A 121 8.917 2.671 7.555 1.00 0.00 H new ATOM 0 HA GLU A 121 6.815 3.420 9.105 1.00 0.00 H new ATOM 0 HB2 GLU A 121 9.296 3.832 9.427 1.00 0.00 H new ATOM 0 HB3 GLU A 121 9.170 5.181 8.315 1.00 0.00 H new ATOM 0 HG2 GLU A 121 7.296 6.029 9.948 1.00 0.00 H new ATOM 0 HG3 GLU A 121 8.013 4.905 11.086 1.00 0.00 H new ATOM 1900 N GLU A 122 5.382 5.201 8.212 1.00 0.00 N ATOM 1901 CA GLU A 122 4.424 6.158 7.650 1.00 0.00 C ATOM 1902 C GLU A 122 5.080 7.502 7.331 1.00 0.00 C ATOM 1903 O GLU A 122 4.743 8.140 6.331 1.00 0.00 O ATOM 1904 CB GLU A 122 3.258 6.370 8.620 1.00 0.00 C ATOM 1905 CG GLU A 122 2.061 7.065 7.992 1.00 0.00 C ATOM 1906 CD GLU A 122 1.195 7.777 9.014 1.00 0.00 C ATOM 1907 OE1 GLU A 122 0.462 7.087 9.755 1.00 0.00 O ATOM 1908 OE2 GLU A 122 1.250 9.022 9.074 1.00 0.00 O ATOM 0 H GLU A 122 5.061 4.748 9.068 1.00 0.00 H new ATOM 0 HA GLU A 122 4.053 5.737 6.716 1.00 0.00 H new ATOM 0 HB2 GLU A 122 2.942 5.403 9.011 1.00 0.00 H new ATOM 0 HB3 GLU A 122 3.605 6.959 9.469 1.00 0.00 H new ATOM 0 HG2 GLU A 122 2.411 7.786 7.253 1.00 0.00 H new ATOM 0 HG3 GLU A 122 1.458 6.330 7.459 1.00 0.00 H new ATOM 1915 N ASN A 123 6.017 7.924 8.179 1.00 0.00 N ATOM 1916 CA ASN A 123 6.718 9.187 7.980 1.00 0.00 C ATOM 1917 C ASN A 123 7.470 9.169 6.654 1.00 0.00 C ATOM 1918 O ASN A 123 7.455 10.147 5.905 1.00 0.00 O ATOM 1919 CB ASN A 123 7.694 9.443 9.132 1.00 0.00 C ATOM 1920 CG ASN A 123 7.029 10.082 10.337 1.00 0.00 C ATOM 1921 OD1 ASN A 123 6.763 9.417 11.337 1.00 0.00 O ATOM 1922 ND2 ASN A 123 6.759 11.381 10.251 1.00 0.00 N ATOM 0 H ASN A 123 6.307 7.408 9.010 1.00 0.00 H new ATOM 0 HA ASN A 123 5.983 9.991 7.959 1.00 0.00 H new ATOM 0 HB2 ASN A 123 8.150 8.499 9.432 1.00 0.00 H new ATOM 0 HB3 ASN A 123 8.500 10.089 8.783 1.00 0.00 H new ATOM 0 HD21 ASN A 123 6.315 11.862 11.033 1.00 0.00 H new ATOM 0 HD22 ASN A 123 6.996 11.896 9.403 1.00 0.00 H new ATOM 1929 N PHE A 124 8.117 8.040 6.370 1.00 0.00 N ATOM 1930 CA PHE A 124 8.873 7.873 5.135 1.00 0.00 C ATOM 1931 C PHE A 124 7.937 7.793 3.927 1.00 0.00 C ATOM 1932 O PHE A 124 8.136 8.494 2.934 1.00 0.00 O ATOM 1933 CB PHE A 124 9.737 6.614 5.217 1.00 0.00 C ATOM 1934 CG PHE A 124 10.807 6.553 4.163 1.00 0.00 C ATOM 1935 CD1 PHE A 124 10.475 6.365 2.830 1.00 0.00 C ATOM 1936 CD2 PHE A 124 12.143 6.690 4.503 1.00 0.00 C ATOM 1937 CE1 PHE A 124 11.454 6.315 1.858 1.00 0.00 C ATOM 1938 CE2 PHE A 124 13.127 6.640 3.535 1.00 0.00 C ATOM 1939 CZ PHE A 124 12.783 6.453 2.211 1.00 0.00 C ATOM 0 H PHE A 124 8.131 7.225 6.983 1.00 0.00 H new ATOM 0 HA PHE A 124 9.519 8.742 5.008 1.00 0.00 H new ATOM 0 HB2 PHE A 124 10.204 6.566 6.201 1.00 0.00 H new ATOM 0 HB3 PHE A 124 9.097 5.737 5.125 1.00 0.00 H new ATOM 0 HD1 PHE A 124 9.438 6.256 2.549 1.00 0.00 H new ATOM 0 HD2 PHE A 124 12.418 6.838 5.537 1.00 0.00 H new ATOM 0 HE1 PHE A 124 11.182 6.168 0.823 1.00 0.00 H new ATOM 0 HE2 PHE A 124 14.165 6.747 3.814 1.00 0.00 H new ATOM 0 HZ PHE A 124 13.551 6.415 1.453 1.00 0.00 H new ATOM 1949 N ILE A 125 6.919 6.935 4.023 1.00 0.00 N ATOM 1950 CA ILE A 125 5.948 6.759 2.944 1.00 0.00 C ATOM 1951 C ILE A 125 5.295 8.091 2.569 1.00 0.00 C ATOM 1952 O ILE A 125 5.185 8.426 1.388 1.00 0.00 O ATOM 1953 CB ILE A 125 4.848 5.743 3.333 1.00 0.00 C ATOM 1954 CG1 ILE A 125 5.470 4.415 3.786 1.00 0.00 C ATOM 1955 CG2 ILE A 125 3.893 5.514 2.169 1.00 0.00 C ATOM 1956 CD1 ILE A 125 6.282 3.722 2.713 1.00 0.00 C ATOM 0 H ILE A 125 6.747 6.350 4.841 1.00 0.00 H new ATOM 0 HA ILE A 125 6.495 6.373 2.084 1.00 0.00 H new ATOM 0 HB ILE A 125 4.282 6.158 4.167 1.00 0.00 H new ATOM 0 HG12 ILE A 125 6.109 4.600 4.649 1.00 0.00 H new ATOM 0 HG13 ILE A 125 4.675 3.746 4.115 1.00 0.00 H new ATOM 0 HG21 ILE A 125 3.127 4.796 2.463 1.00 0.00 H new ATOM 0 HG22 ILE A 125 3.421 6.457 1.895 1.00 0.00 H new ATOM 0 HG23 ILE A 125 4.447 5.124 1.315 1.00 0.00 H new ATOM 0 HD11 ILE A 125 6.689 2.791 3.109 1.00 0.00 H new ATOM 0 HD12 ILE A 125 5.643 3.504 1.857 1.00 0.00 H new ATOM 0 HD13 ILE A 125 7.100 4.371 2.399 1.00 0.00 H new ATOM 1968 N LYS A 126 4.868 8.847 3.582 1.00 0.00 N ATOM 1969 CA LYS A 126 4.231 10.145 3.363 1.00 0.00 C ATOM 1970 C LYS A 126 5.222 11.156 2.783 1.00 0.00 C ATOM 1971 O LYS A 126 4.847 12.003 1.969 1.00 0.00 O ATOM 1972 CB LYS A 126 3.646 10.674 4.676 1.00 0.00 C ATOM 1973 CG LYS A 126 2.363 11.468 4.499 1.00 0.00 C ATOM 1974 CD LYS A 126 1.927 12.111 5.808 1.00 0.00 C ATOM 1975 CE LYS A 126 0.872 11.274 6.520 1.00 0.00 C ATOM 1976 NZ LYS A 126 0.704 11.681 7.943 1.00 0.00 N ATOM 0 H LYS A 126 4.952 8.581 4.563 1.00 0.00 H new ATOM 0 HA LYS A 126 3.425 10.009 2.642 1.00 0.00 H new ATOM 0 HB2 LYS A 126 3.453 9.833 5.342 1.00 0.00 H new ATOM 0 HB3 LYS A 126 4.388 11.305 5.166 1.00 0.00 H new ATOM 0 HG2 LYS A 126 2.511 12.240 3.744 1.00 0.00 H new ATOM 0 HG3 LYS A 126 1.574 10.811 4.133 1.00 0.00 H new ATOM 0 HD2 LYS A 126 2.793 12.236 6.458 1.00 0.00 H new ATOM 0 HD3 LYS A 126 1.530 13.107 5.610 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -0.081 11.373 6.000 1.00 0.00 H new ATOM 0 HE3 LYS A 126 1.153 10.222 6.475 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 0.869 10.861 8.561 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 1.387 12.430 8.173 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -0.262 12.037 8.091 1.00 0.00 H new ATOM 1990 N SER A 127 6.489 11.058 3.200 1.00 0.00 N ATOM 1991 CA SER A 127 7.530 11.959 2.712 1.00 0.00 C ATOM 1992 C SER A 127 7.703 11.799 1.204 1.00 0.00 C ATOM 1993 O SER A 127 7.716 12.784 0.461 1.00 0.00 O ATOM 1994 CB SER A 127 8.856 11.683 3.426 1.00 0.00 C ATOM 1995 OG SER A 127 9.710 12.814 3.381 1.00 0.00 O ATOM 0 H SER A 127 6.814 10.364 3.873 1.00 0.00 H new ATOM 0 HA SER A 127 7.227 12.984 2.925 1.00 0.00 H new ATOM 0 HB2 SER A 127 8.663 11.411 4.464 1.00 0.00 H new ATOM 0 HB3 SER A 127 9.352 10.831 2.960 1.00 0.00 H new ATOM 0 HG SER A 127 10.548 12.610 3.846 1.00 0.00 H new ATOM 2001 N GLU A 128 7.822 10.547 0.762 1.00 0.00 N ATOM 2002 CA GLU A 128 7.978 10.239 -0.656 1.00 0.00 C ATOM 2003 C GLU A 128 6.687 10.536 -1.419 1.00 0.00 C ATOM 2004 O GLU A 128 6.725 10.916 -2.588 1.00 0.00 O ATOM 2005 CB GLU A 128 8.364 8.769 -0.835 1.00 0.00 C ATOM 2006 CG GLU A 128 8.823 8.420 -2.245 1.00 0.00 C ATOM 2007 CD GLU A 128 9.909 7.362 -2.259 1.00 0.00 C ATOM 2008 OE1 GLU A 128 9.640 6.229 -1.807 1.00 0.00 O ATOM 2009 OE2 GLU A 128 11.029 7.668 -2.720 1.00 0.00 O ATOM 0 H GLU A 128 7.813 9.728 1.370 1.00 0.00 H new ATOM 0 HA GLU A 128 8.771 10.869 -1.059 1.00 0.00 H new ATOM 0 HB2 GLU A 128 9.161 8.524 -0.133 1.00 0.00 H new ATOM 0 HB3 GLU A 128 7.509 8.145 -0.577 1.00 0.00 H new ATOM 0 HG2 GLU A 128 7.970 8.067 -2.824 1.00 0.00 H new ATOM 0 HG3 GLU A 128 9.192 9.320 -2.737 1.00 0.00 H new ATOM 2016 N LEU A 129 5.548 10.358 -0.747 1.00 0.00 N ATOM 2017 CA LEU A 129 4.238 10.603 -1.352 1.00 0.00 C ATOM 2018 C LEU A 129 4.149 12.005 -1.956 1.00 0.00 C ATOM 2019 O LEU A 129 3.692 12.173 -3.088 1.00 0.00 O ATOM 2020 CB LEU A 129 3.134 10.425 -0.303 1.00 0.00 C ATOM 2021 CG LEU A 129 1.851 9.760 -0.809 1.00 0.00 C ATOM 2022 CD1 LEU A 129 1.160 10.641 -1.840 1.00 0.00 C ATOM 2023 CD2 LEU A 129 2.155 8.385 -1.389 1.00 0.00 C ATOM 0 H LEU A 129 5.507 10.043 0.222 1.00 0.00 H new ATOM 0 HA LEU A 129 4.104 9.879 -2.155 1.00 0.00 H new ATOM 0 HB2 LEU A 129 3.531 9.831 0.521 1.00 0.00 H new ATOM 0 HB3 LEU A 129 2.880 11.404 0.103 1.00 0.00 H new ATOM 0 HG LEU A 129 1.174 9.632 0.035 1.00 0.00 H new ATOM 0 HD11 LEU A 129 0.251 10.150 -2.187 1.00 0.00 H new ATOM 0 HD12 LEU A 129 0.905 11.599 -1.387 1.00 0.00 H new ATOM 0 HD13 LEU A 129 1.829 10.805 -2.685 1.00 0.00 H new ATOM 0 HD21 LEU A 129 1.231 7.927 -1.744 1.00 0.00 H new ATOM 0 HD22 LEU A 129 2.852 8.487 -2.221 1.00 0.00 H new ATOM 0 HD23 LEU A 129 2.599 7.755 -0.618 1.00 0.00 H new ATOM 2035 N LYS A 130 4.578 13.007 -1.187 1.00 0.00 N ATOM 2036 CA LYS A 130 4.540 14.397 -1.632 1.00 0.00 C ATOM 2037 C LYS A 130 5.554 14.659 -2.747 1.00 0.00 C ATOM 2038 O LYS A 130 5.237 15.321 -3.738 1.00 0.00 O ATOM 2039 CB LYS A 130 4.810 15.326 -0.444 1.00 0.00 C ATOM 2040 CG LYS A 130 4.545 16.793 -0.737 1.00 0.00 C ATOM 2041 CD LYS A 130 5.836 17.542 -1.028 1.00 0.00 C ATOM 2042 CE LYS A 130 5.590 19.031 -1.227 1.00 0.00 C ATOM 2043 NZ LYS A 130 5.976 19.826 -0.027 1.00 0.00 N ATOM 0 H LYS A 130 4.957 12.879 -0.249 1.00 0.00 H new ATOM 0 HA LYS A 130 3.547 14.597 -2.035 1.00 0.00 H new ATOM 0 HB2 LYS A 130 4.189 15.015 0.396 1.00 0.00 H new ATOM 0 HB3 LYS A 130 5.848 15.210 -0.133 1.00 0.00 H new ATOM 0 HG2 LYS A 130 3.872 16.880 -1.590 1.00 0.00 H new ATOM 0 HG3 LYS A 130 4.041 17.250 0.114 1.00 0.00 H new ATOM 0 HD2 LYS A 130 6.535 17.395 -0.205 1.00 0.00 H new ATOM 0 HD3 LYS A 130 6.304 17.128 -1.921 1.00 0.00 H new ATOM 0 HE2 LYS A 130 6.156 19.380 -2.090 1.00 0.00 H new ATOM 0 HE3 LYS A 130 4.536 19.198 -1.449 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 5.792 20.834 -0.205 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 5.418 19.512 0.792 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 6.988 19.688 0.170 1.00 0.00 H new ATOM 2057 N LYS A 131 6.773 14.148 -2.577 1.00 0.00 N ATOM 2058 CA LYS A 131 7.832 14.338 -3.568 1.00 0.00 C ATOM 2059 C LYS A 131 7.537 13.582 -4.864 1.00 0.00 C ATOM 2060 O LYS A 131 7.734 14.116 -5.957 1.00 0.00 O ATOM 2061 CB LYS A 131 9.179 13.889 -2.998 1.00 0.00 C ATOM 2062 CG LYS A 131 10.021 15.036 -2.464 1.00 0.00 C ATOM 2063 CD LYS A 131 11.509 14.743 -2.579 1.00 0.00 C ATOM 2064 CE LYS A 131 12.010 14.934 -4.002 1.00 0.00 C ATOM 2065 NZ LYS A 131 12.059 13.648 -4.753 1.00 0.00 N ATOM 0 H LYS A 131 7.052 13.600 -1.763 1.00 0.00 H new ATOM 0 HA LYS A 131 7.874 15.402 -3.803 1.00 0.00 H new ATOM 0 HB2 LYS A 131 9.005 13.172 -2.196 1.00 0.00 H new ATOM 0 HB3 LYS A 131 9.739 13.368 -3.775 1.00 0.00 H new ATOM 0 HG2 LYS A 131 9.786 15.947 -3.014 1.00 0.00 H new ATOM 0 HG3 LYS A 131 9.766 15.219 -1.420 1.00 0.00 H new ATOM 0 HD2 LYS A 131 12.062 15.399 -1.907 1.00 0.00 H new ATOM 0 HD3 LYS A 131 11.705 13.720 -2.258 1.00 0.00 H new ATOM 0 HE2 LYS A 131 11.359 15.635 -4.525 1.00 0.00 H new ATOM 0 HE3 LYS A 131 13.005 15.379 -3.980 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 12.787 13.706 -5.493 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 12.291 12.873 -4.099 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 11.133 13.466 -5.191 1.00 0.00 H new ATOM 2079 N ALA A 132 7.071 12.339 -4.738 1.00 0.00 N ATOM 2080 CA ALA A 132 6.756 11.512 -5.900 1.00 0.00 C ATOM 2081 C ALA A 132 5.472 11.981 -6.579 1.00 0.00 C ATOM 2082 O ALA A 132 4.376 11.518 -6.253 1.00 0.00 O ATOM 2083 CB ALA A 132 6.646 10.044 -5.498 1.00 0.00 C ATOM 0 H ALA A 132 6.904 11.884 -3.841 1.00 0.00 H new ATOM 0 HA ALA A 132 7.570 11.615 -6.617 1.00 0.00 H new ATOM 0 HB1 ALA A 132 6.411 9.443 -6.376 1.00 0.00 H new ATOM 0 HB2 ALA A 132 7.593 9.711 -5.073 1.00 0.00 H new ATOM 0 HB3 ALA A 132 5.855 9.928 -4.757 1.00 0.00 H new ATOM 2089 N GLY A 133 5.618 12.907 -7.527 1.00 0.00 N ATOM 2090 CA GLY A 133 4.470 13.434 -8.245 1.00 0.00 C ATOM 2091 C GLY A 133 3.977 14.750 -7.669 1.00 0.00 C ATOM 2092 O GLY A 133 2.769 14.981 -7.589 1.00 0.00 O ATOM 0 H GLY A 133 6.515 13.302 -7.810 1.00 0.00 H new ATOM 0 HA2 GLY A 133 4.735 13.576 -9.293 1.00 0.00 H new ATOM 0 HA3 GLY A 133 3.662 12.703 -8.217 1.00 0.00 H new ATOM 2096 N GLY A 134 4.913 15.612 -7.268 1.00 0.00 N ATOM 2097 CA GLY A 134 4.550 16.900 -6.703 1.00 0.00 C ATOM 2098 C GLY A 134 4.957 18.059 -7.593 1.00 0.00 C ATOM 2099 O GLY A 134 4.162 18.523 -8.413 1.00 0.00 O ATOM 0 H GLY A 134 5.917 15.439 -7.325 1.00 0.00 H new ATOM 0 HA2 GLY A 134 3.473 16.931 -6.541 1.00 0.00 H new ATOM 0 HA3 GLY A 134 5.023 17.012 -5.727 1.00 0.00 H new ATOM 2103 N ALA A 135 6.198 18.528 -7.431 1.00 0.00 N ATOM 2104 CA ALA A 135 6.717 19.646 -8.226 1.00 0.00 C ATOM 2105 C ALA A 135 8.126 20.049 -7.779 1.00 0.00 C ATOM 2106 O ALA A 135 8.496 21.223 -7.851 1.00 0.00 O ATOM 2107 CB ALA A 135 5.779 20.846 -8.135 1.00 0.00 C ATOM 0 H ALA A 135 6.863 18.150 -6.756 1.00 0.00 H new ATOM 0 HA ALA A 135 6.774 19.313 -9.262 1.00 0.00 H new ATOM 0 HB1 ALA A 135 6.179 21.667 -8.731 1.00 0.00 H new ATOM 0 HB2 ALA A 135 4.795 20.569 -8.514 1.00 0.00 H new ATOM 0 HB3 ALA A 135 5.691 21.161 -7.095 1.00 0.00 H new ATOM 2113 N ASN A 136 8.904 19.074 -7.314 1.00 0.00 N ATOM 2114 CA ASN A 136 10.269 19.326 -6.849 1.00 0.00 C ATOM 2115 C ASN A 136 11.029 18.013 -6.656 1.00 0.00 C ATOM 2116 O ASN A 136 11.904 17.912 -5.793 1.00 0.00 O ATOM 2117 CB ASN A 136 10.244 20.113 -5.534 1.00 0.00 C ATOM 2118 CG ASN A 136 9.193 19.599 -4.565 1.00 0.00 C ATOM 2119 OD1 ASN A 136 8.177 20.252 -4.332 1.00 0.00 O ATOM 2120 ND2 ASN A 136 9.432 18.421 -3.995 1.00 0.00 N ATOM 0 H ASN A 136 8.613 18.099 -7.249 1.00 0.00 H new ATOM 0 HA ASN A 136 10.784 19.915 -7.608 1.00 0.00 H new ATOM 0 HB2 ASN A 136 11.225 20.057 -5.063 1.00 0.00 H new ATOM 0 HB3 ASN A 136 10.052 21.164 -5.748 1.00 0.00 H new ATOM 0 HD21 ASN A 136 8.760 18.027 -3.337 1.00 0.00 H new ATOM 0 HD22 ASN A 136 10.288 17.912 -4.216 1.00 0.00 H new ATOM 2127 N TYR A 137 10.677 17.005 -7.456 1.00 0.00 N ATOM 2128 CA TYR A 137 11.313 15.691 -7.371 1.00 0.00 C ATOM 2129 C TYR A 137 12.840 15.798 -7.348 1.00 0.00 C ATOM 2130 O TYR A 137 13.504 15.063 -6.615 1.00 0.00 O ATOM 2131 CB TYR A 137 10.863 14.809 -8.537 1.00 0.00 C ATOM 2132 CG TYR A 137 10.907 13.330 -8.226 1.00 0.00 C ATOM 2133 CD1 TYR A 137 12.119 12.659 -8.133 1.00 0.00 C ATOM 2134 CD2 TYR A 137 9.739 12.607 -8.022 1.00 0.00 C ATOM 2135 CE1 TYR A 137 12.166 11.310 -7.846 1.00 0.00 C ATOM 2136 CE2 TYR A 137 9.778 11.256 -7.734 1.00 0.00 C ATOM 2137 CZ TYR A 137 10.994 10.613 -7.647 1.00 0.00 C ATOM 2138 OH TYR A 137 11.037 9.270 -7.359 1.00 0.00 O ATOM 0 H TYR A 137 9.953 17.075 -8.171 1.00 0.00 H new ATOM 0 HA TYR A 137 11.000 15.234 -6.432 1.00 0.00 H new ATOM 0 HB2 TYR A 137 9.846 15.083 -8.818 1.00 0.00 H new ATOM 0 HB3 TYR A 137 11.498 15.010 -9.400 1.00 0.00 H new ATOM 0 HD1 TYR A 137 13.040 13.202 -8.288 1.00 0.00 H new ATOM 0 HD2 TYR A 137 8.785 13.109 -8.090 1.00 0.00 H new ATOM 0 HE1 TYR A 137 13.117 10.803 -7.778 1.00 0.00 H new ATOM 0 HE2 TYR A 137 8.861 10.707 -7.578 1.00 0.00 H new ATOM 0 HH TYR A 137 10.125 8.930 -7.247 1.00 0.00 H new ATOM 2148 N ASP A 138 13.393 16.714 -8.145 1.00 0.00 N ATOM 2149 CA ASP A 138 14.842 16.909 -8.197 1.00 0.00 C ATOM 2150 C ASP A 138 15.348 17.577 -6.917 1.00 0.00 C ATOM 2151 O ASP A 138 14.596 18.267 -6.225 1.00 0.00 O ATOM 2152 CB ASP A 138 15.231 17.757 -9.416 1.00 0.00 C ATOM 2153 CG ASP A 138 16.718 17.694 -9.720 1.00 0.00 C ATOM 2154 OD1 ASP A 138 17.481 18.485 -9.123 1.00 0.00 O ATOM 2155 OD2 ASP A 138 17.120 16.853 -10.550 1.00 0.00 O ATOM 0 H ASP A 138 12.862 17.330 -8.761 1.00 0.00 H new ATOM 0 HA ASP A 138 15.308 15.928 -8.287 1.00 0.00 H new ATOM 0 HB2 ASP A 138 14.671 17.414 -10.286 1.00 0.00 H new ATOM 0 HB3 ASP A 138 14.943 18.794 -9.240 1.00 0.00 H new ATOM 2160 N ALA A 139 16.628 17.370 -6.613 1.00 0.00 N ATOM 2161 CA ALA A 139 17.245 17.948 -5.423 1.00 0.00 C ATOM 2162 C ALA A 139 18.770 17.945 -5.544 1.00 0.00 C ATOM 2163 O ALA A 139 19.482 17.862 -4.542 1.00 0.00 O ATOM 2164 CB ALA A 139 16.810 17.188 -4.177 1.00 0.00 C ATOM 0 H ALA A 139 17.260 16.803 -7.178 1.00 0.00 H new ATOM 0 HA ALA A 139 16.912 18.982 -5.335 1.00 0.00 H new ATOM 0 HB1 ALA A 139 17.279 17.631 -3.298 1.00 0.00 H new ATOM 0 HB2 ALA A 139 15.726 17.243 -4.077 1.00 0.00 H new ATOM 0 HB3 ALA A 139 17.114 16.145 -4.263 1.00 0.00 H new ATOM 2170 N GLN A 140 19.266 18.037 -6.779 1.00 0.00 N ATOM 2171 CA GLN A 140 20.704 18.045 -7.034 1.00 0.00 C ATOM 2172 C GLN A 140 21.174 19.411 -7.531 1.00 0.00 C ATOM 2173 O GLN A 140 22.305 19.561 -7.996 1.00 0.00 O ATOM 2174 CB GLN A 140 21.059 16.965 -8.052 1.00 0.00 C ATOM 2175 CG GLN A 140 22.380 16.267 -7.768 1.00 0.00 C ATOM 2176 CD GLN A 140 22.953 15.575 -8.991 1.00 0.00 C ATOM 2177 OE1 GLN A 140 23.247 14.380 -8.960 1.00 0.00 O ATOM 2178 NE2 GLN A 140 23.118 16.323 -10.078 1.00 0.00 N ATOM 0 H GLN A 140 18.691 18.107 -7.618 1.00 0.00 H new ATOM 0 HA GLN A 140 21.215 17.837 -6.094 1.00 0.00 H new ATOM 0 HB2 GLN A 140 20.262 16.221 -8.072 1.00 0.00 H new ATOM 0 HB3 GLN A 140 21.101 17.414 -9.044 1.00 0.00 H new ATOM 0 HG2 GLN A 140 23.100 16.997 -7.399 1.00 0.00 H new ATOM 0 HG3 GLN A 140 22.235 15.533 -6.975 1.00 0.00 H new ATOM 0 HE21 GLN A 140 22.861 17.310 -10.062 1.00 0.00 H new ATOM 0 HE22 GLN A 140 23.501 15.910 -10.928 1.00 0.00 H new ATOM 2187 N THR A 141 20.296 20.399 -7.419 1.00 0.00 N ATOM 2188 CA THR A 141 20.600 21.764 -7.844 1.00 0.00 C ATOM 2189 C THR A 141 19.900 22.781 -6.937 1.00 0.00 C ATOM 2190 O THR A 141 19.419 23.818 -7.399 1.00 0.00 O ATOM 2191 CB THR A 141 20.184 21.978 -9.307 1.00 0.00 C ATOM 2192 OG1 THR A 141 19.004 21.254 -9.611 1.00 0.00 O ATOM 2193 CG2 THR A 141 21.246 21.553 -10.300 1.00 0.00 C ATOM 0 H THR A 141 19.359 20.281 -7.034 1.00 0.00 H new ATOM 0 HA THR A 141 21.677 21.914 -7.764 1.00 0.00 H new ATOM 0 HB THR A 141 20.023 23.052 -9.402 1.00 0.00 H new ATOM 0 HG1 THR A 141 18.758 21.407 -10.547 1.00 0.00 H new ATOM 0 HG21 THR A 141 20.888 21.731 -11.314 1.00 0.00 H new ATOM 0 HG22 THR A 141 22.155 22.130 -10.130 1.00 0.00 H new ATOM 0 HG23 THR A 141 21.460 20.492 -10.172 1.00 0.00 H new ATOM 2201 N GLU A 142 19.852 22.471 -5.642 1.00 0.00 N ATOM 2202 CA GLU A 142 19.218 23.346 -4.661 1.00 0.00 C ATOM 2203 C GLU A 142 20.256 24.233 -3.975 1.00 0.00 C ATOM 2204 O GLU A 142 20.120 25.471 -4.056 1.00 0.00 O ATOM 2205 CB GLU A 142 18.468 22.514 -3.616 1.00 0.00 C ATOM 2206 CG GLU A 142 17.004 22.278 -3.950 1.00 0.00 C ATOM 2207 CD GLU A 142 16.286 21.489 -2.873 1.00 0.00 C ATOM 2208 OE1 GLU A 142 16.422 20.247 -2.858 1.00 0.00 O ATOM 2209 OE2 GLU A 142 15.589 22.110 -2.045 1.00 0.00 O ATOM 0 H GLU A 142 20.247 21.617 -5.248 1.00 0.00 H new ATOM 0 HA GLU A 142 18.507 23.986 -5.184 1.00 0.00 H new ATOM 0 HB2 GLU A 142 18.966 21.550 -3.508 1.00 0.00 H new ATOM 0 HB3 GLU A 142 18.534 23.016 -2.651 1.00 0.00 H new ATOM 0 HG2 GLU A 142 16.506 23.238 -4.087 1.00 0.00 H new ATOM 0 HG3 GLU A 142 16.932 21.744 -4.897 1.00 0.00 H new TER 2216 GLU A 142