USER MOD reduce.3.24.130724 H: found=0, std=0, add=1064, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1050 hydrogens (25 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 62 SER OG : rot 46:sc= 1.1 USER MOD Set 1.2: A 138 FOP N4 :NH3+ 142:sc= -0.117 (180deg=-0.15) USER MOD Set 1.3: A 139 DBI O5' : rot 46:sc= 1.06 USER MOD Set 2.1: A 64 TYR OH : rot 30:sc= -0.0826 USER MOD Set 2.2: A 71 CYS SG : rot -122:sc= 2.71 USER MOD Set 2.3: A 93 ASN : amide:sc= -0.0961 K(o=2.5,f=1.4) USER MOD Set 3.1: A 25 HIS : no HD1:sc= -0.289 X(o=0.4,f=-0.092) USER MOD Set 3.2: A 29 ASN : amide:sc= 0.688 X(o=0.4,f=-0.092) USER MOD Set 4.1: A 21 LYS NZ :NH3+ -106:sc= -1.75 (180deg=-4.75!) USER MOD Set 4.2: A 126 THR OG1 : rot -52:sc= 0.337 USER MOD Set 5.1: A 3 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0114) USER MOD Set 5.2: A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 173:sc= -0.0187 (180deg=-0.0977) USER MOD Single : A 5 THR OG1 : rot 170:sc= 0.948 USER MOD Single : A 13 SER OG : rot -33:sc= 0.754 USER MOD Single : A 15 CYS SG : rot 180:sc= 0 USER MOD Single : A 16 HIS : no HE2:sc= -0.0677 K(o=-0.068,f=-3.1!) USER MOD Single : A 20 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 SER OG : rot 83:sc= 1.11 USER MOD Single : A 28 THR OG1 : rot 180:sc= -0.0278 USER MOD Single : A 33 ASN : amide:sc= -0.223 K(o=-0.22,f=-0.84) USER MOD Single : A 36 ASN : amide:sc= 0.126 K(o=0.13,f=-1.9) USER MOD Single : A 41 SER OG : rot 51:sc= 0 USER MOD Single : A 42 SER OG : rot 180:sc= 0.0746 USER MOD Single : A 43 GLN :FLIP amide:sc= -2.41 F(o=-3,f=-2.4) USER MOD Single : A 48 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 53 THR OG1 : rot 26:sc= 0.461 USER MOD Single : A 54 LYS NZ :NH3+ 170:sc=-0.000972 (180deg=-0.092) USER MOD Single : A 59 CYS SG : rot 177:sc= -3.89! USER MOD Single : A 61 SER OG : rot 120:sc= -0.104 USER MOD Single : A 66 GLN : amide:sc= -0.423 K(o=-0.42,f=-4!) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 LYS NZ :NH3+ 157:sc= 0 (180deg=-0.229) USER MOD Single : A 78 CYS SG : rot 50:sc= -2.74! USER MOD Single : A 84 LYS NZ :NH3+ -166:sc= -0.0364 (180deg=-0.475) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 GLN : amide:sc= -0.791 X(o=-0.79,f=-0.79) USER MOD Single : A 100 ASN : amide:sc= -0.147 X(o=-0.15,f=-0.54) USER MOD Single : A 106 GLN : amide:sc= 0 K(o=0,f=-2.6!) USER MOD Single : A 109 LYS NZ :NH3+ 163:sc= -0.0453 (180deg=-0.357) USER MOD Single : A 111 MET CE :methyl 167:sc=-0.00486 (180deg=-0.217) USER MOD Single : A 117 TYR OH : rot -47:sc= 0.0345 USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 SER OG : rot -80:sc= 0 USER MOD Single : A 125 THR OG1 : rot -140:sc= 0 USER MOD Single : A 130 MET CE :methyl -177:sc= -0.487 (180deg=-0.509) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 DBI O2' : rot -106:sc= 0.168 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -2.869 10.739 12.061 1.00 0.00 N ATOM 2 CA MET A 1 -1.751 9.834 11.934 1.00 0.00 C ATOM 3 C MET A 1 -2.268 8.679 11.070 1.00 0.00 C ATOM 4 O MET A 1 -1.944 8.567 9.894 1.00 0.00 O ATOM 5 CB MET A 1 -1.246 9.406 13.327 1.00 0.00 C ATOM 6 CG MET A 1 -0.054 8.443 13.274 1.00 0.00 C ATOM 7 SD MET A 1 0.435 7.942 14.935 1.00 0.00 S ATOM 8 CE MET A 1 1.013 6.276 14.564 1.00 0.00 C ATOM 0 H1 MET A 1 -2.630 11.494 12.735 1.00 0.00 H new ATOM 0 H2 MET A 1 -3.083 11.158 11.134 1.00 0.00 H new ATOM 0 H3 MET A 1 -3.700 10.218 12.406 1.00 0.00 H new ATOM 0 HA MET A 1 -0.879 10.284 11.459 1.00 0.00 H new ATOM 0 HB2 MET A 1 -0.961 10.294 13.891 1.00 0.00 H new ATOM 0 HB3 MET A 1 -2.063 8.932 13.871 1.00 0.00 H new ATOM 0 HG2 MET A 1 -0.317 7.564 12.686 1.00 0.00 H new ATOM 0 HG3 MET A 1 0.786 8.923 12.772 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.360 5.799 15.480 1.00 0.00 H new ATOM 0 HE2 MET A 1 0.196 5.694 14.139 1.00 0.00 H new ATOM 0 HE3 MET A 1 1.833 6.326 13.848 1.00 0.00 H new ATOM 20 N GLU A 2 -3.090 7.836 11.735 1.00 0.00 N ATOM 21 CA GLU A 2 -3.695 6.669 11.111 1.00 0.00 C ATOM 22 C GLU A 2 -5.070 7.147 10.638 1.00 0.00 C ATOM 23 O GLU A 2 -6.096 6.868 11.248 1.00 0.00 O ATOM 24 CB GLU A 2 -3.790 5.531 12.147 1.00 0.00 C ATOM 25 CG GLU A 2 -2.404 5.059 12.620 1.00 0.00 C ATOM 26 CD GLU A 2 -2.504 3.956 13.691 1.00 0.00 C ATOM 27 OE1 GLU A 2 -3.112 4.199 14.733 1.00 0.00 O ATOM 28 OE2 GLU A 2 -1.969 2.868 13.477 1.00 0.00 O ATOM 0 H GLU A 2 -3.343 7.957 12.716 1.00 0.00 H new ATOM 0 HA GLU A 2 -3.120 6.272 10.275 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -4.369 5.871 13.006 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -4.330 4.690 11.712 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -1.838 4.686 11.767 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -1.851 5.907 13.023 1.00 0.00 H new ATOM 35 N LYS A 3 -5.012 7.874 9.498 1.00 0.00 N ATOM 36 CA LYS A 3 -6.181 8.452 8.889 1.00 0.00 C ATOM 37 C LYS A 3 -6.700 7.484 7.826 1.00 0.00 C ATOM 38 O LYS A 3 -6.017 6.631 7.274 1.00 0.00 O ATOM 39 CB LYS A 3 -5.897 9.875 8.384 1.00 0.00 C ATOM 40 CG LYS A 3 -5.695 10.839 9.551 1.00 0.00 C ATOM 41 CD LYS A 3 -5.351 12.249 9.065 1.00 0.00 C ATOM 42 CE LYS A 3 -5.120 13.238 10.210 1.00 0.00 C ATOM 43 NZ LYS A 3 -6.331 13.497 10.979 1.00 0.00 N ATOM 0 H LYS A 3 -4.145 8.063 8.994 1.00 0.00 H new ATOM 0 HA LYS A 3 -6.980 8.584 9.619 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -5.008 9.870 7.753 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -6.726 10.217 7.764 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -6.601 10.873 10.156 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -4.896 10.470 10.194 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -4.456 12.205 8.445 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -6.159 12.616 8.433 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -4.349 12.846 10.874 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -4.744 14.177 9.804 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -6.137 14.223 11.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -7.082 13.833 10.342 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -6.640 12.621 11.446 1.00 0.00 H new ATOM 56 N LYS A 4 -8.005 7.739 7.634 1.00 0.00 N ATOM 57 CA LYS A 4 -8.960 7.087 6.761 1.00 0.00 C ATOM 58 C LYS A 4 -8.498 7.260 5.307 1.00 0.00 C ATOM 59 O LYS A 4 -8.813 8.254 4.666 1.00 0.00 O ATOM 60 CB LYS A 4 -10.328 7.768 7.012 1.00 0.00 C ATOM 61 CG LYS A 4 -10.278 9.313 7.050 1.00 0.00 C ATOM 62 CD LYS A 4 -10.239 9.896 8.472 1.00 0.00 C ATOM 63 CE LYS A 4 -9.798 11.363 8.481 1.00 0.00 C ATOM 64 NZ LYS A 4 -9.721 11.915 9.827 1.00 0.00 N ATOM 0 H LYS A 4 -8.453 8.495 8.152 1.00 0.00 H new ATOM 0 HA LYS A 4 -9.042 6.018 6.956 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -11.022 7.459 6.231 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -10.731 7.407 7.958 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -9.398 9.653 6.504 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -11.150 9.709 6.529 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -11.227 9.812 8.925 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -9.556 9.309 9.086 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -8.823 11.449 8.000 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -10.498 11.953 7.889 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -9.419 12.909 9.778 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -10.656 11.860 10.279 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -9.033 11.371 10.386 1.00 0.00 H new ATOM 77 N THR A 5 -7.756 6.234 4.813 1.00 0.00 N ATOM 78 CA THR A 5 -7.257 6.284 3.441 1.00 0.00 C ATOM 79 C THR A 5 -6.412 5.009 3.250 1.00 0.00 C ATOM 80 O THR A 5 -5.301 4.908 3.755 1.00 0.00 O ATOM 81 CB THR A 5 -6.381 7.569 3.248 1.00 0.00 C ATOM 82 OG1 THR A 5 -5.873 8.172 4.479 1.00 0.00 O ATOM 83 CG2 THR A 5 -7.030 8.580 2.254 1.00 0.00 C ATOM 0 H THR A 5 -7.504 5.395 5.335 1.00 0.00 H new ATOM 0 HA THR A 5 -8.065 6.328 2.711 1.00 0.00 H new ATOM 0 HB THR A 5 -5.466 7.218 2.770 1.00 0.00 H new ATOM 0 HG1 THR A 5 -5.215 8.864 4.257 1.00 0.00 H new ATOM 0 HG21 THR A 5 -6.387 9.454 2.152 1.00 0.00 H new ATOM 0 HG22 THR A 5 -7.153 8.105 1.281 1.00 0.00 H new ATOM 0 HG23 THR A 5 -8.004 8.888 2.633 1.00 0.00 H new ATOM 91 N ILE A 6 -6.994 4.059 2.480 1.00 0.00 N ATOM 92 CA ILE A 6 -6.358 2.799 2.155 1.00 0.00 C ATOM 93 C ILE A 6 -6.836 2.490 0.739 1.00 0.00 C ATOM 94 O ILE A 6 -7.995 2.157 0.527 1.00 0.00 O ATOM 95 CB ILE A 6 -6.694 1.616 3.111 1.00 0.00 C ATOM 96 CG1 ILE A 6 -8.035 1.771 3.948 1.00 0.00 C ATOM 97 CG2 ILE A 6 -5.928 0.351 2.563 1.00 0.00 C ATOM 98 CD1 ILE A 6 -7.759 2.506 5.260 1.00 0.00 C ATOM 0 H ILE A 6 -7.924 4.164 2.074 1.00 0.00 H new ATOM 0 HA ILE A 6 -5.277 2.902 2.255 1.00 0.00 H new ATOM 0 HB ILE A 6 -6.356 1.486 4.139 1.00 0.00 H new ATOM 0 HG12 ILE A 6 -8.775 2.319 3.365 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -8.458 0.788 4.156 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -6.135 -0.506 3.204 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -6.263 0.134 1.549 1.00 0.00 H new ATOM 0 HG23 ILE A 6 -4.856 0.549 2.557 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -8.687 2.605 5.824 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -7.036 1.941 5.848 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -7.358 3.496 5.045 1.00 0.00 H new ATOM 110 N VAL A 7 -5.876 2.563 -0.211 1.00 0.00 N ATOM 111 CA VAL A 7 -6.217 2.316 -1.603 1.00 0.00 C ATOM 112 C VAL A 7 -6.059 0.829 -1.907 1.00 0.00 C ATOM 113 O VAL A 7 -5.220 0.120 -1.367 1.00 0.00 O ATOM 114 CB VAL A 7 -5.342 3.134 -2.647 1.00 0.00 C ATOM 115 CG1 VAL A 7 -5.267 4.634 -3.112 1.00 0.00 C ATOM 116 CG2 VAL A 7 -3.865 2.848 -2.306 1.00 0.00 C ATOM 0 H VAL A 7 -4.896 2.784 -0.035 1.00 0.00 H new ATOM 0 HA VAL A 7 -7.247 2.652 -1.720 1.00 0.00 H new ATOM 0 HB VAL A 7 -5.976 2.780 -3.460 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -4.494 4.741 -3.873 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -6.229 4.935 -3.527 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -5.026 5.268 -2.259 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -3.220 3.390 -2.998 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -3.657 3.173 -1.287 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -3.672 1.779 -2.392 1.00 0.00 H new ATOM 126 N LEU A 8 -6.986 0.439 -2.806 1.00 0.00 N ATOM 127 CA LEU A 8 -7.062 -0.918 -3.315 1.00 0.00 C ATOM 128 C LEU A 8 -7.003 -0.748 -4.836 1.00 0.00 C ATOM 129 O LEU A 8 -7.915 -0.216 -5.459 1.00 0.00 O ATOM 130 CB LEU A 8 -8.315 -1.640 -2.789 1.00 0.00 C ATOM 131 CG LEU A 8 -9.675 -0.952 -3.142 1.00 0.00 C ATOM 132 CD1 LEU A 8 -10.426 -1.804 -4.207 1.00 0.00 C ATOM 133 CD2 LEU A 8 -10.385 0.044 -2.194 1.00 0.00 C ATOM 0 H LEU A 8 -7.694 1.065 -3.190 1.00 0.00 H new ATOM 0 HA LEU A 8 -6.251 -1.564 -2.978 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -8.325 -2.655 -3.187 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -8.239 -1.724 -1.705 1.00 0.00 H new ATOM 0 HG LEU A 8 -9.471 0.025 -3.581 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -11.374 -1.325 -4.454 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -9.815 -1.884 -5.106 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -10.616 -2.800 -3.808 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -11.311 0.388 -2.655 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -10.612 -0.451 -1.250 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -9.733 0.898 -2.008 1.00 0.00 H new ATOM 145 N GLY A 9 -5.861 -1.215 -5.386 1.00 0.00 N ATOM 146 CA GLY A 9 -5.660 -1.122 -6.827 1.00 0.00 C ATOM 147 C GLY A 9 -4.580 -2.097 -7.261 1.00 0.00 C ATOM 148 O GLY A 9 -3.612 -2.320 -6.546 1.00 0.00 O ATOM 0 H GLY A 9 -5.095 -1.644 -4.866 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -6.592 -1.342 -7.348 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -5.375 -0.106 -7.099 1.00 0.00 H new ATOM 152 N VAL A 10 -4.834 -2.702 -8.452 1.00 0.00 N ATOM 153 CA VAL A 10 -3.874 -3.664 -8.980 1.00 0.00 C ATOM 154 C VAL A 10 -4.344 -4.452 -10.225 1.00 0.00 C ATOM 155 O VAL A 10 -4.627 -3.879 -11.266 1.00 0.00 O ATOM 156 CB VAL A 10 -3.648 -4.696 -7.878 1.00 0.00 C ATOM 157 CG1 VAL A 10 -5.109 -5.158 -7.410 1.00 0.00 C ATOM 158 CG2 VAL A 10 -2.244 -5.375 -7.841 1.00 0.00 C ATOM 0 H VAL A 10 -5.659 -2.541 -9.029 1.00 0.00 H new ATOM 0 HA VAL A 10 -2.994 -3.096 -9.282 1.00 0.00 H new ATOM 0 HB VAL A 10 -3.251 -4.578 -6.870 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -5.019 -5.901 -6.618 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -5.661 -4.295 -7.038 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -5.642 -5.592 -8.256 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -2.206 -6.087 -7.016 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -2.068 -5.898 -8.781 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -1.476 -4.615 -7.700 1.00 0.00 H new ATOM 168 N ILE A 11 -4.356 -5.812 -10.024 1.00 0.00 N ATOM 169 CA ILE A 11 -4.726 -6.835 -11.003 1.00 0.00 C ATOM 170 C ILE A 11 -3.479 -7.706 -11.191 1.00 0.00 C ATOM 171 O ILE A 11 -2.393 -7.383 -10.726 1.00 0.00 O ATOM 172 CB ILE A 11 -5.272 -6.317 -12.385 1.00 0.00 C ATOM 173 CG1 ILE A 11 -6.629 -6.904 -12.825 1.00 0.00 C ATOM 174 CG2 ILE A 11 -4.108 -5.804 -13.302 1.00 0.00 C ATOM 175 CD1 ILE A 11 -7.115 -6.495 -14.232 1.00 0.00 C ATOM 0 H ILE A 11 -4.092 -6.219 -9.127 1.00 0.00 H new ATOM 0 HA ILE A 11 -5.582 -7.382 -10.608 1.00 0.00 H new ATOM 0 HB ILE A 11 -5.796 -5.361 -12.405 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -6.563 -7.991 -12.786 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -7.385 -6.605 -12.099 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -4.518 -5.453 -14.249 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -3.588 -4.984 -12.806 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -3.407 -6.617 -13.490 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -8.077 -6.965 -14.435 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -7.223 -5.411 -14.279 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -6.388 -6.819 -14.977 1.00 0.00 H new ATOM 187 N GLY A 12 -3.707 -8.821 -11.923 1.00 0.00 N ATOM 188 CA GLY A 12 -2.619 -9.746 -12.193 1.00 0.00 C ATOM 189 C GLY A 12 -2.959 -10.642 -13.391 1.00 0.00 C ATOM 190 O GLY A 12 -2.903 -10.230 -14.543 1.00 0.00 O ATOM 0 H GLY A 12 -4.609 -9.083 -12.319 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -1.703 -9.190 -12.395 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -2.430 -10.361 -11.313 1.00 0.00 H new ATOM 194 N SER A 13 -3.307 -11.891 -13.023 1.00 0.00 N ATOM 195 CA SER A 13 -3.656 -12.930 -13.965 1.00 0.00 C ATOM 196 C SER A 13 -4.700 -13.772 -13.234 1.00 0.00 C ATOM 197 O SER A 13 -4.397 -14.757 -12.574 1.00 0.00 O ATOM 198 CB SER A 13 -2.394 -13.776 -14.331 1.00 0.00 C ATOM 199 OG SER A 13 -2.479 -15.258 -14.346 1.00 0.00 O ATOM 0 H SER A 13 -3.349 -12.192 -12.049 1.00 0.00 H new ATOM 0 HA SER A 13 -4.040 -12.537 -14.907 1.00 0.00 H new ATOM 0 HB2 SER A 13 -2.066 -13.459 -15.321 1.00 0.00 H new ATOM 0 HB3 SER A 13 -1.605 -13.503 -13.631 1.00 0.00 H new ATOM 0 HG SER A 13 -3.111 -15.556 -13.659 1.00 0.00 H new ATOM 205 N ASP A 14 -5.949 -13.300 -13.405 1.00 0.00 N ATOM 206 CA ASP A 14 -7.127 -13.930 -12.835 1.00 0.00 C ATOM 207 C ASP A 14 -8.254 -12.954 -13.202 1.00 0.00 C ATOM 208 O ASP A 14 -8.114 -11.743 -13.076 1.00 0.00 O ATOM 209 CB ASP A 14 -6.964 -14.227 -11.321 1.00 0.00 C ATOM 210 CG ASP A 14 -8.283 -14.524 -10.575 1.00 0.00 C ATOM 211 OD1 ASP A 14 -9.103 -15.279 -11.097 1.00 0.00 O ATOM 212 OD2 ASP A 14 -8.473 -14.002 -9.477 1.00 0.00 O ATOM 0 H ASP A 14 -6.157 -12.463 -13.949 1.00 0.00 H new ATOM 0 HA ASP A 14 -7.334 -14.926 -13.226 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -6.295 -15.080 -11.202 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -6.479 -13.373 -10.847 1.00 0.00 H new ATOM 217 N CYS A 15 -9.363 -13.563 -13.685 1.00 0.00 N ATOM 218 CA CYS A 15 -10.536 -12.813 -14.111 1.00 0.00 C ATOM 219 C CYS A 15 -11.371 -12.552 -12.853 1.00 0.00 C ATOM 220 O CYS A 15 -12.319 -13.268 -12.558 1.00 0.00 O ATOM 221 CB CYS A 15 -11.314 -13.632 -15.155 1.00 0.00 C ATOM 222 SG CYS A 15 -12.816 -12.812 -15.749 1.00 0.00 S ATOM 0 H CYS A 15 -9.455 -14.574 -13.784 1.00 0.00 H new ATOM 0 HA CYS A 15 -10.271 -11.866 -14.581 1.00 0.00 H new ATOM 0 HB2 CYS A 15 -10.662 -13.836 -16.004 1.00 0.00 H new ATOM 0 HB3 CYS A 15 -11.583 -14.595 -14.722 1.00 0.00 H new ATOM 0 HG CYS A 15 -13.407 -13.570 -16.625 1.00 0.00 H new ATOM 228 N HIS A 16 -10.938 -11.463 -12.173 1.00 0.00 N ATOM 229 CA HIS A 16 -11.473 -10.909 -10.937 1.00 0.00 C ATOM 230 C HIS A 16 -10.236 -10.239 -10.347 1.00 0.00 C ATOM 231 O HIS A 16 -10.232 -9.084 -9.939 1.00 0.00 O ATOM 232 CB HIS A 16 -12.067 -11.936 -9.937 1.00 0.00 C ATOM 233 CG HIS A 16 -12.928 -11.239 -8.910 1.00 0.00 C ATOM 234 ND1 HIS A 16 -14.278 -11.272 -8.935 1.00 0.00 N ATOM 235 CD2 HIS A 16 -12.527 -10.475 -7.802 1.00 0.00 C ATOM 236 CE1 HIS A 16 -14.684 -10.553 -7.875 1.00 0.00 C ATOM 237 NE2 HIS A 16 -13.649 -10.061 -7.174 1.00 0.00 N ATOM 0 H HIS A 16 -10.145 -10.919 -12.512 1.00 0.00 H new ATOM 0 HA HIS A 16 -12.327 -10.261 -11.133 1.00 0.00 H new ATOM 0 HB2 HIS A 16 -12.660 -12.675 -10.475 1.00 0.00 H new ATOM 0 HB3 HIS A 16 -11.261 -12.475 -9.439 1.00 0.00 H new ATOM 0 HD1 HIS A 16 -14.868 -11.746 -9.619 1.00 0.00 H new ATOM 0 HD2 HIS A 16 -11.511 -10.259 -7.507 1.00 0.00 H new ATOM 0 HE1 HIS A 16 -15.720 -10.390 -7.617 1.00 0.00 H new ATOM 245 N ALA A 17 -9.186 -11.098 -10.359 1.00 0.00 N ATOM 246 CA ALA A 17 -7.852 -10.796 -9.899 1.00 0.00 C ATOM 247 C ALA A 17 -7.920 -10.562 -8.398 1.00 0.00 C ATOM 248 O ALA A 17 -7.065 -9.861 -7.870 1.00 0.00 O ATOM 249 CB ALA A 17 -7.252 -9.610 -10.675 1.00 0.00 C ATOM 0 H ALA A 17 -9.273 -12.052 -10.708 1.00 0.00 H new ATOM 0 HA ALA A 17 -7.177 -11.630 -10.090 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -6.247 -9.405 -10.307 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -7.207 -9.855 -11.736 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -7.877 -8.728 -10.532 1.00 0.00 H new ATOM 255 N VAL A 18 -8.963 -11.157 -7.733 1.00 0.00 N ATOM 256 CA VAL A 18 -9.083 -10.929 -6.282 1.00 0.00 C ATOM 257 C VAL A 18 -9.090 -9.393 -5.988 1.00 0.00 C ATOM 258 O VAL A 18 -9.517 -8.604 -6.823 1.00 0.00 O ATOM 259 CB VAL A 18 -7.961 -11.736 -5.531 1.00 0.00 C ATOM 260 CG1 VAL A 18 -8.430 -13.215 -5.387 1.00 0.00 C ATOM 261 CG2 VAL A 18 -6.479 -11.284 -5.461 1.00 0.00 C ATOM 0 H VAL A 18 -9.676 -11.753 -8.154 1.00 0.00 H new ATOM 0 HA VAL A 18 -10.031 -11.306 -5.899 1.00 0.00 H new ATOM 0 HB VAL A 18 -7.790 -11.314 -4.541 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -7.664 -13.791 -4.868 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -9.358 -13.248 -4.816 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -8.597 -13.642 -6.376 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -5.904 -12.010 -4.886 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -6.072 -11.215 -6.470 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -6.418 -10.309 -4.978 1.00 0.00 H new ATOM 271 N GLY A 19 -8.598 -9.017 -4.781 1.00 0.00 N ATOM 272 CA GLY A 19 -8.504 -7.614 -4.374 1.00 0.00 C ATOM 273 C GLY A 19 -9.783 -7.089 -3.715 1.00 0.00 C ATOM 274 O GLY A 19 -9.746 -6.361 -2.724 1.00 0.00 O ATOM 0 H GLY A 19 -8.262 -9.677 -4.079 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -7.672 -7.499 -3.679 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -8.277 -7.004 -5.248 1.00 0.00 H new ATOM 278 N ASN A 20 -10.916 -7.532 -4.320 1.00 0.00 N ATOM 279 CA ASN A 20 -12.267 -7.195 -3.889 1.00 0.00 C ATOM 280 C ASN A 20 -12.280 -7.385 -2.373 1.00 0.00 C ATOM 281 O ASN A 20 -12.632 -6.468 -1.644 1.00 0.00 O ATOM 282 CB ASN A 20 -13.285 -8.076 -4.637 1.00 0.00 C ATOM 283 CG ASN A 20 -14.732 -7.777 -4.216 1.00 0.00 C ATOM 284 OD1 ASN A 20 -15.381 -6.880 -4.740 1.00 0.00 O ATOM 285 ND2 ASN A 20 -15.185 -8.589 -3.243 1.00 0.00 N ATOM 0 H ASN A 20 -10.898 -8.144 -5.135 1.00 0.00 H new ATOM 0 HA ASN A 20 -12.552 -6.169 -4.122 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -13.181 -7.917 -5.710 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -13.063 -9.126 -4.447 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -16.135 -8.480 -2.889 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -14.578 -9.313 -2.860 1.00 0.00 H new ATOM 292 N LYS A 21 -11.806 -8.629 -2.053 1.00 0.00 N ATOM 293 CA LYS A 21 -11.501 -9.448 -0.877 1.00 0.00 C ATOM 294 C LYS A 21 -11.456 -8.567 0.348 1.00 0.00 C ATOM 295 O LYS A 21 -10.520 -8.478 1.128 1.00 0.00 O ATOM 296 CB LYS A 21 -10.202 -10.253 -1.091 1.00 0.00 C ATOM 297 CG LYS A 21 -9.811 -11.212 0.056 1.00 0.00 C ATOM 298 CD LYS A 21 -10.889 -12.229 0.470 1.00 0.00 C ATOM 299 CE LYS A 21 -11.856 -11.737 1.564 1.00 0.00 C ATOM 300 NZ LYS A 21 -11.184 -11.309 2.781 1.00 0.00 N ATOM 0 H LYS A 21 -11.577 -9.212 -2.858 1.00 0.00 H new ATOM 0 HA LYS A 21 -12.289 -10.185 -0.723 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -10.304 -10.834 -2.007 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -9.383 -9.551 -1.248 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -8.916 -11.759 -0.241 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -9.545 -10.616 0.929 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -11.469 -12.502 -0.412 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -10.397 -13.136 0.821 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -12.444 -10.907 1.172 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -12.555 -12.537 1.806 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -11.322 -12.024 3.524 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -10.167 -11.196 2.595 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -11.581 -10.401 3.096 1.00 0.00 H new ATOM 313 N ILE A 22 -12.611 -7.935 0.422 1.00 0.00 N ATOM 314 CA ILE A 22 -13.053 -7.030 1.403 1.00 0.00 C ATOM 315 C ILE A 22 -11.934 -6.005 1.729 1.00 0.00 C ATOM 316 O ILE A 22 -11.740 -5.612 2.873 1.00 0.00 O ATOM 317 CB ILE A 22 -13.648 -8.029 2.410 1.00 0.00 C ATOM 318 CG1 ILE A 22 -12.857 -8.198 3.747 1.00 0.00 C ATOM 319 CG2 ILE A 22 -15.142 -8.311 2.000 1.00 0.00 C ATOM 320 CD1 ILE A 22 -13.372 -9.317 4.674 1.00 0.00 C ATOM 0 H ILE A 22 -13.323 -8.076 -0.295 1.00 0.00 H new ATOM 0 HA ILE A 22 -13.820 -6.281 1.205 1.00 0.00 H new ATOM 0 HB ILE A 22 -13.484 -9.092 2.584 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -11.812 -8.396 3.510 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -12.887 -7.254 4.291 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -15.585 -9.018 2.702 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -15.707 -7.379 2.019 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -15.170 -8.731 0.995 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -12.759 -9.355 5.574 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -14.407 -9.114 4.948 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -13.315 -10.274 4.156 1.00 0.00 H new ATOM 332 N LEU A 23 -11.213 -5.567 0.650 1.00 0.00 N ATOM 333 CA LEU A 23 -10.213 -4.512 0.865 1.00 0.00 C ATOM 334 C LEU A 23 -11.064 -3.224 1.049 1.00 0.00 C ATOM 335 O LEU A 23 -10.798 -2.336 1.859 1.00 0.00 O ATOM 336 CB LEU A 23 -9.226 -4.296 -0.310 1.00 0.00 C ATOM 337 CG LEU A 23 -7.943 -5.173 -0.382 1.00 0.00 C ATOM 338 CD1 LEU A 23 -6.709 -4.185 -0.369 1.00 0.00 C ATOM 339 CD2 LEU A 23 -8.232 -6.558 0.303 1.00 0.00 C ATOM 0 H LEU A 23 -11.305 -5.909 -0.307 1.00 0.00 H new ATOM 0 HA LEU A 23 -9.578 -4.780 1.709 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -9.779 -4.444 -1.237 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -8.912 -3.252 -0.289 1.00 0.00 H new ATOM 0 HG LEU A 23 -7.544 -5.712 -1.241 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -5.783 -4.758 -0.418 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -6.768 -3.517 -1.228 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -6.723 -3.597 0.549 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -7.338 -7.180 0.257 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -8.510 -6.398 1.345 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -9.049 -7.058 -0.218 1.00 0.00 H new ATOM 351 N ASP A 24 -12.151 -3.213 0.239 1.00 0.00 N ATOM 352 CA ASP A 24 -13.106 -2.121 0.302 1.00 0.00 C ATOM 353 C ASP A 24 -13.873 -2.257 1.643 1.00 0.00 C ATOM 354 O ASP A 24 -14.609 -1.365 2.049 1.00 0.00 O ATOM 355 CB ASP A 24 -14.025 -2.164 -0.934 1.00 0.00 C ATOM 356 CG ASP A 24 -14.880 -0.889 -1.058 1.00 0.00 C ATOM 357 OD1 ASP A 24 -14.412 0.078 -1.659 1.00 0.00 O ATOM 358 OD2 ASP A 24 -16.004 -0.878 -0.556 1.00 0.00 O ATOM 0 H ASP A 24 -12.370 -3.938 -0.445 1.00 0.00 H new ATOM 0 HA ASP A 24 -12.619 -1.146 0.280 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -13.420 -2.284 -1.833 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -14.678 -3.034 -0.871 1.00 0.00 H new ATOM 363 N HIS A 25 -13.656 -3.410 2.320 1.00 0.00 N ATOM 364 CA HIS A 25 -14.298 -3.643 3.597 1.00 0.00 C ATOM 365 C HIS A 25 -13.395 -3.034 4.681 1.00 0.00 C ATOM 366 O HIS A 25 -13.800 -2.971 5.828 1.00 0.00 O ATOM 367 CB HIS A 25 -14.626 -5.119 3.810 1.00 0.00 C ATOM 368 CG HIS A 25 -15.705 -5.310 4.850 1.00 0.00 C ATOM 369 ND1 HIS A 25 -15.468 -5.716 6.115 1.00 0.00 N ATOM 370 CD2 HIS A 25 -17.088 -5.119 4.697 1.00 0.00 C ATOM 371 CE1 HIS A 25 -16.669 -5.769 6.714 1.00 0.00 C ATOM 372 NE2 HIS A 25 -17.666 -5.415 5.883 1.00 0.00 N ATOM 0 H HIS A 25 -13.052 -4.166 1.997 1.00 0.00 H new ATOM 0 HA HIS A 25 -15.271 -3.155 3.641 1.00 0.00 H new ATOM 0 HB2 HIS A 25 -14.949 -5.559 2.867 1.00 0.00 H new ATOM 0 HB3 HIS A 25 -13.726 -5.650 4.119 1.00 0.00 H new ATOM 0 HD2 HIS A 25 -17.595 -4.796 3.800 1.00 0.00 H new ATOM 0 HE1 HIS A 25 -16.817 -6.062 7.743 1.00 0.00 H new ATOM 0 HE2 HIS A 25 -18.661 -5.377 6.104 1.00 0.00 H new ATOM 380 N SER A 26 -12.174 -2.579 4.283 1.00 0.00 N ATOM 381 CA SER A 26 -11.239 -1.891 5.188 1.00 0.00 C ATOM 382 C SER A 26 -12.008 -0.647 5.679 1.00 0.00 C ATOM 383 O SER A 26 -11.977 -0.240 6.835 1.00 0.00 O ATOM 384 CB SER A 26 -9.952 -1.322 4.519 1.00 0.00 C ATOM 385 OG SER A 26 -9.150 -2.461 3.949 1.00 0.00 O ATOM 0 H SER A 26 -11.822 -2.683 3.331 1.00 0.00 H new ATOM 0 HA SER A 26 -10.922 -2.617 5.937 1.00 0.00 H new ATOM 0 HB2 SER A 26 -10.218 -0.617 3.731 1.00 0.00 H new ATOM 0 HB3 SER A 26 -9.359 -0.773 5.251 1.00 0.00 H new ATOM 0 HG SER A 26 -9.506 -2.703 3.069 1.00 0.00 H new ATOM 391 N PHE A 27 -12.689 -0.091 4.655 1.00 0.00 N ATOM 392 CA PHE A 27 -13.502 1.107 4.833 1.00 0.00 C ATOM 393 C PHE A 27 -14.608 0.816 5.848 1.00 0.00 C ATOM 394 O PHE A 27 -14.888 1.615 6.728 1.00 0.00 O ATOM 395 CB PHE A 27 -14.023 1.622 3.475 1.00 0.00 C ATOM 396 CG PHE A 27 -15.132 2.644 3.566 1.00 0.00 C ATOM 397 CD1 PHE A 27 -15.120 3.659 4.521 1.00 0.00 C ATOM 398 CD2 PHE A 27 -16.205 2.575 2.682 1.00 0.00 C ATOM 399 CE1 PHE A 27 -16.160 4.574 4.600 1.00 0.00 C ATOM 400 CE2 PHE A 27 -17.248 3.488 2.758 1.00 0.00 C ATOM 401 CZ PHE A 27 -17.227 4.489 3.718 1.00 0.00 C ATOM 0 H PHE A 27 -12.685 -0.459 3.704 1.00 0.00 H new ATOM 0 HA PHE A 27 -12.899 1.919 5.238 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -13.190 2.059 2.925 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -14.379 0.772 2.893 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -14.290 3.734 5.208 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -16.226 1.802 1.928 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -16.139 5.352 5.348 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -18.077 3.419 2.069 1.00 0.00 H new ATOM 0 HZ PHE A 27 -18.038 5.199 3.778 1.00 0.00 H new ATOM 411 N THR A 28 -15.194 -0.368 5.689 1.00 0.00 N ATOM 412 CA THR A 28 -16.304 -0.777 6.537 1.00 0.00 C ATOM 413 C THR A 28 -15.842 -1.353 7.890 1.00 0.00 C ATOM 414 O THR A 28 -16.644 -1.565 8.791 1.00 0.00 O ATOM 415 CB THR A 28 -17.103 -1.797 5.680 1.00 0.00 C ATOM 416 OG1 THR A 28 -17.149 -1.584 4.227 1.00 0.00 O ATOM 417 CG2 THR A 28 -18.464 -2.162 6.331 1.00 0.00 C ATOM 0 H THR A 28 -14.920 -1.054 4.986 1.00 0.00 H new ATOM 0 HA THR A 28 -16.924 0.071 6.827 1.00 0.00 H new ATOM 0 HB THR A 28 -16.481 -2.692 5.708 1.00 0.00 H new ATOM 0 HG1 THR A 28 -17.680 -2.294 3.809 1.00 0.00 H new ATOM 0 HG21 THR A 28 -18.990 -2.878 5.699 1.00 0.00 H new ATOM 0 HG22 THR A 28 -18.291 -2.604 7.312 1.00 0.00 H new ATOM 0 HG23 THR A 28 -19.068 -1.261 6.440 1.00 0.00 H new ATOM 425 N ASN A 29 -14.537 -1.569 7.989 1.00 0.00 N ATOM 426 CA ASN A 29 -13.885 -2.153 9.146 1.00 0.00 C ATOM 427 C ASN A 29 -13.978 -1.168 10.308 1.00 0.00 C ATOM 428 O ASN A 29 -14.239 -1.574 11.435 1.00 0.00 O ATOM 429 CB ASN A 29 -12.441 -2.665 8.891 1.00 0.00 C ATOM 430 CG ASN A 29 -12.302 -4.198 8.883 1.00 0.00 C ATOM 431 OD1 ASN A 29 -11.601 -4.780 9.703 1.00 0.00 O ATOM 432 ND2 ASN A 29 -12.995 -4.807 7.909 1.00 0.00 N ATOM 0 H ASN A 29 -13.885 -1.334 7.240 1.00 0.00 H new ATOM 0 HA ASN A 29 -14.419 -3.068 9.401 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -12.094 -2.276 7.934 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -11.783 -2.257 9.658 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -12.959 -5.822 7.815 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -13.558 -4.255 7.262 1.00 0.00 H new ATOM 439 N ALA A 30 -13.755 0.125 9.996 1.00 0.00 N ATOM 440 CA ALA A 30 -13.844 1.104 11.063 1.00 0.00 C ATOM 441 C ALA A 30 -13.912 2.504 10.450 1.00 0.00 C ATOM 442 O ALA A 30 -13.323 3.445 10.971 1.00 0.00 O ATOM 443 CB ALA A 30 -12.693 1.002 12.084 1.00 0.00 C ATOM 0 H ALA A 30 -13.527 0.487 9.070 1.00 0.00 H new ATOM 0 HA ALA A 30 -14.753 0.897 11.627 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -12.821 1.763 12.854 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -12.702 0.014 12.545 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -11.741 1.157 11.576 1.00 0.00 H new ATOM 449 N GLY A 31 -14.664 2.605 9.336 1.00 0.00 N ATOM 450 CA GLY A 31 -14.852 3.889 8.664 1.00 0.00 C ATOM 451 C GLY A 31 -13.553 4.552 8.177 1.00 0.00 C ATOM 452 O GLY A 31 -13.482 5.771 8.073 1.00 0.00 O ATOM 0 H GLY A 31 -15.142 1.820 8.894 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -15.513 3.744 7.810 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -15.359 4.571 9.347 1.00 0.00 H new ATOM 456 N PHE A 32 -12.545 3.695 7.885 1.00 0.00 N ATOM 457 CA PHE A 32 -11.267 4.223 7.416 1.00 0.00 C ATOM 458 C PHE A 32 -11.307 4.043 5.900 1.00 0.00 C ATOM 459 O PHE A 32 -10.922 3.023 5.343 1.00 0.00 O ATOM 460 CB PHE A 32 -10.072 3.522 8.094 1.00 0.00 C ATOM 461 CG PHE A 32 -9.959 3.764 9.586 1.00 0.00 C ATOM 462 CD1 PHE A 32 -10.464 4.907 10.210 1.00 0.00 C ATOM 463 CD2 PHE A 32 -9.311 2.820 10.377 1.00 0.00 C ATOM 464 CE1 PHE A 32 -10.332 5.089 11.580 1.00 0.00 C ATOM 465 CE2 PHE A 32 -9.178 2.996 11.747 1.00 0.00 C ATOM 466 CZ PHE A 32 -9.689 4.133 12.352 1.00 0.00 C ATOM 0 H PHE A 32 -12.597 2.679 7.965 1.00 0.00 H new ATOM 0 HA PHE A 32 -11.125 5.272 7.676 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -10.150 2.449 7.919 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -9.152 3.857 7.615 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -10.964 5.660 9.619 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -8.904 1.933 9.915 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -10.731 5.978 12.046 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -8.676 2.247 12.342 1.00 0.00 H new ATOM 0 HZ PHE A 32 -9.587 4.274 13.418 1.00 0.00 H new ATOM 476 N ASN A 33 -11.800 5.158 5.306 1.00 0.00 N ATOM 477 CA ASN A 33 -12.051 5.430 3.895 1.00 0.00 C ATOM 478 C ASN A 33 -10.976 4.755 3.056 1.00 0.00 C ATOM 479 O ASN A 33 -9.806 4.708 3.409 1.00 0.00 O ATOM 480 CB ASN A 33 -12.064 6.949 3.625 1.00 0.00 C ATOM 481 CG ASN A 33 -13.140 7.677 4.449 1.00 0.00 C ATOM 482 OD1 ASN A 33 -14.050 7.079 5.010 1.00 0.00 O ATOM 483 ND2 ASN A 33 -12.964 9.010 4.481 1.00 0.00 N ATOM 0 H ASN A 33 -12.053 5.965 5.876 1.00 0.00 H new ATOM 0 HA ASN A 33 -13.029 5.032 3.624 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -11.085 7.366 3.860 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -12.240 7.126 2.564 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -13.616 9.598 5.000 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -12.179 9.433 3.986 1.00 0.00 H new ATOM 490 N VAL A 34 -11.480 4.231 1.919 1.00 0.00 N ATOM 491 CA VAL A 34 -10.623 3.549 0.953 1.00 0.00 C ATOM 492 C VAL A 34 -10.773 4.299 -0.372 1.00 0.00 C ATOM 493 O VAL A 34 -11.863 4.674 -0.789 1.00 0.00 O ATOM 494 CB VAL A 34 -10.960 2.017 0.737 1.00 0.00 C ATOM 495 CG1 VAL A 34 -10.660 0.682 1.519 1.00 0.00 C ATOM 496 CG2 VAL A 34 -12.418 1.911 0.223 1.00 0.00 C ATOM 0 H VAL A 34 -12.465 4.271 1.658 1.00 0.00 H new ATOM 0 HA VAL A 34 -9.604 3.561 1.340 1.00 0.00 H new ATOM 0 HB VAL A 34 -10.012 1.925 0.207 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -11.100 -0.160 0.984 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -9.582 0.540 1.596 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -11.090 0.741 2.519 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -12.673 0.863 0.067 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -13.096 2.344 0.959 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -12.512 2.452 -0.719 1.00 0.00 H new ATOM 506 N VAL A 35 -9.590 4.491 -0.987 1.00 0.00 N ATOM 507 CA VAL A 35 -9.478 5.176 -2.263 1.00 0.00 C ATOM 508 C VAL A 35 -9.286 4.095 -3.338 1.00 0.00 C ATOM 509 O VAL A 35 -8.213 3.530 -3.504 1.00 0.00 O ATOM 510 CB VAL A 35 -8.286 6.184 -2.175 1.00 0.00 C ATOM 511 CG1 VAL A 35 -8.221 7.051 -3.468 1.00 0.00 C ATOM 512 CG2 VAL A 35 -7.654 6.643 -0.837 1.00 0.00 C ATOM 0 H VAL A 35 -8.699 4.173 -0.606 1.00 0.00 H new ATOM 0 HA VAL A 35 -10.364 5.756 -2.520 1.00 0.00 H new ATOM 0 HB VAL A 35 -7.380 5.581 -2.110 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -7.387 7.750 -3.396 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -8.078 6.404 -4.333 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -9.152 7.607 -3.580 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -6.844 7.344 -1.039 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -8.412 7.132 -0.225 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -7.261 5.777 -0.304 1.00 0.00 H new ATOM 522 N ASN A 36 -10.401 3.832 -4.055 1.00 0.00 N ATOM 523 CA ASN A 36 -10.339 2.817 -5.098 1.00 0.00 C ATOM 524 C ASN A 36 -9.639 3.493 -6.283 1.00 0.00 C ATOM 525 O ASN A 36 -10.139 4.437 -6.882 1.00 0.00 O ATOM 526 CB ASN A 36 -11.750 2.301 -5.438 1.00 0.00 C ATOM 527 CG ASN A 36 -11.703 1.116 -6.419 1.00 0.00 C ATOM 528 OD1 ASN A 36 -10.700 0.427 -6.558 1.00 0.00 O ATOM 529 ND2 ASN A 36 -12.858 0.933 -7.084 1.00 0.00 N ATOM 0 H ASN A 36 -11.305 4.288 -3.932 1.00 0.00 H new ATOM 0 HA ASN A 36 -9.784 1.930 -4.791 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -12.256 1.995 -4.522 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -12.338 3.110 -5.872 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -12.942 0.175 -7.761 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -13.650 1.552 -6.911 1.00 0.00 H new ATOM 536 N ILE A 37 -8.442 2.930 -6.554 1.00 0.00 N ATOM 537 CA ILE A 37 -7.570 3.408 -7.618 1.00 0.00 C ATOM 538 C ILE A 37 -7.769 2.502 -8.844 1.00 0.00 C ATOM 539 O ILE A 37 -7.182 2.748 -9.892 1.00 0.00 O ATOM 540 CB ILE A 37 -6.081 3.473 -7.168 1.00 0.00 C ATOM 541 CG1 ILE A 37 -5.416 4.848 -7.569 1.00 0.00 C ATOM 542 CG2 ILE A 37 -5.856 2.521 -5.934 1.00 0.00 C ATOM 543 CD1 ILE A 37 -3.955 5.044 -7.115 1.00 0.00 C ATOM 0 H ILE A 37 -8.065 2.136 -6.037 1.00 0.00 H new ATOM 0 HA ILE A 37 -7.837 4.432 -7.878 1.00 0.00 H new ATOM 0 HB ILE A 37 -5.246 2.995 -7.680 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -5.456 4.947 -8.654 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -6.018 5.656 -7.153 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -4.813 2.570 -5.622 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -6.496 2.836 -5.110 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -6.104 1.497 -6.214 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -3.600 6.021 -7.444 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -3.901 4.985 -6.028 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -3.331 4.265 -7.552 1.00 0.00 H new ATOM 555 N GLY A 38 -8.613 1.456 -8.678 1.00 0.00 N ATOM 556 CA GLY A 38 -8.916 0.553 -9.779 1.00 0.00 C ATOM 557 C GLY A 38 -7.868 -0.548 -9.981 1.00 0.00 C ATOM 558 O GLY A 38 -7.855 -1.561 -9.288 1.00 0.00 O ATOM 0 H GLY A 38 -9.082 1.231 -7.801 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -9.886 0.090 -9.601 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -9.003 1.132 -10.698 1.00 0.00 H new ATOM 562 N VAL A 39 -7.008 -0.287 -10.993 1.00 0.00 N ATOM 563 CA VAL A 39 -5.977 -1.252 -11.350 1.00 0.00 C ATOM 564 C VAL A 39 -4.579 -0.613 -11.377 1.00 0.00 C ATOM 565 O VAL A 39 -3.592 -1.271 -11.072 1.00 0.00 O ATOM 566 CB VAL A 39 -6.357 -1.919 -12.716 1.00 0.00 C ATOM 567 CG1 VAL A 39 -7.604 -2.830 -12.488 1.00 0.00 C ATOM 568 CG2 VAL A 39 -5.977 -1.350 -14.105 1.00 0.00 C ATOM 0 H VAL A 39 -7.016 0.564 -11.555 1.00 0.00 H new ATOM 0 HA VAL A 39 -5.928 -2.027 -10.585 1.00 0.00 H new ATOM 0 HB VAL A 39 -5.497 -2.499 -13.050 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -7.885 -3.304 -13.428 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -7.364 -3.597 -11.752 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -8.435 -2.225 -12.124 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -6.363 -2.006 -14.885 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -6.408 -0.356 -14.221 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -4.892 -1.287 -14.188 1.00 0.00 H new ATOM 578 N LEU A 40 -4.537 0.688 -11.742 1.00 0.00 N ATOM 579 CA LEU A 40 -3.253 1.371 -11.813 1.00 0.00 C ATOM 580 C LEU A 40 -3.016 2.016 -10.448 1.00 0.00 C ATOM 581 O LEU A 40 -3.688 2.957 -10.043 1.00 0.00 O ATOM 582 CB LEU A 40 -3.242 2.422 -12.937 1.00 0.00 C ATOM 583 CG LEU A 40 -3.414 1.818 -14.365 1.00 0.00 C ATOM 584 CD1 LEU A 40 -3.747 2.981 -15.347 1.00 0.00 C ATOM 585 CD2 LEU A 40 -2.745 0.501 -14.814 1.00 0.00 C ATOM 0 H LEU A 40 -5.350 1.256 -11.981 1.00 0.00 H new ATOM 0 HA LEU A 40 -2.455 0.666 -12.047 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -4.042 3.141 -12.758 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -2.303 2.974 -12.897 1.00 0.00 H new ATOM 0 HG LEU A 40 -4.244 1.112 -14.351 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -3.872 2.583 -16.354 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -4.669 3.469 -15.033 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -2.933 3.706 -15.342 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -3.015 0.290 -15.849 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -1.662 0.597 -14.734 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -3.085 -0.315 -14.177 1.00 0.00 H new ATOM 597 N SER A 41 -1.994 1.428 -9.786 1.00 0.00 N ATOM 598 CA SER A 41 -1.533 1.883 -8.487 1.00 0.00 C ATOM 599 C SER A 41 -0.270 2.685 -8.831 1.00 0.00 C ATOM 600 O SER A 41 0.860 2.225 -8.719 1.00 0.00 O ATOM 601 CB SER A 41 -1.295 0.673 -7.537 1.00 0.00 C ATOM 602 OG SER A 41 -0.716 -0.587 -8.064 1.00 0.00 O ATOM 0 H SER A 41 -1.477 0.628 -10.150 1.00 0.00 H new ATOM 0 HA SER A 41 -2.245 2.498 -7.937 1.00 0.00 H new ATOM 0 HB2 SER A 41 -0.644 1.016 -6.733 1.00 0.00 H new ATOM 0 HB3 SER A 41 -2.255 0.423 -7.085 1.00 0.00 H new ATOM 0 HG SER A 41 0.103 -0.387 -8.564 1.00 0.00 H new ATOM 608 N SER A 42 -0.590 3.926 -9.264 1.00 0.00 N ATOM 609 CA SER A 42 0.348 4.939 -9.718 1.00 0.00 C ATOM 610 C SER A 42 1.213 5.349 -8.524 1.00 0.00 C ATOM 611 O SER A 42 0.740 5.467 -7.404 1.00 0.00 O ATOM 612 CB SER A 42 -0.482 6.134 -10.281 1.00 0.00 C ATOM 613 OG SER A 42 -1.888 5.902 -10.699 1.00 0.00 O ATOM 0 H SER A 42 -1.557 4.248 -9.302 1.00 0.00 H new ATOM 0 HA SER A 42 1.008 4.576 -10.506 1.00 0.00 H new ATOM 0 HB2 SER A 42 -0.490 6.916 -9.522 1.00 0.00 H new ATOM 0 HB3 SER A 42 0.056 6.531 -11.142 1.00 0.00 H new ATOM 0 HG SER A 42 -2.275 6.741 -11.026 1.00 0.00 H new ATOM 619 N GLN A 43 2.509 5.555 -8.841 1.00 0.00 N ATOM 620 CA GLN A 43 3.464 5.937 -7.816 1.00 0.00 C ATOM 621 C GLN A 43 3.500 7.466 -7.736 1.00 0.00 C ATOM 622 O GLN A 43 2.856 8.070 -6.893 1.00 0.00 O ATOM 623 CB GLN A 43 4.840 5.302 -8.093 1.00 0.00 C ATOM 624 CG GLN A 43 5.934 5.694 -7.084 1.00 0.00 C ATOM 625 CD GLN A 43 5.496 5.437 -5.635 1.00 0.00 C ATOM 626 OE1 GLN A 43 5.131 4.164 -5.401 1.00 0.00 O flip ATOM 627 NE2 GLN A 43 5.491 6.331 -4.798 1.00 0.00 N flip ATOM 0 H GLN A 43 2.898 5.462 -9.780 1.00 0.00 H new ATOM 0 HA GLN A 43 3.161 5.559 -6.840 1.00 0.00 H new ATOM 0 HB2 GLN A 43 4.733 4.217 -8.092 1.00 0.00 H new ATOM 0 HB3 GLN A 43 5.165 5.589 -9.093 1.00 0.00 H new ATOM 0 HG2 GLN A 43 6.842 5.128 -7.295 1.00 0.00 H new ATOM 0 HG3 GLN A 43 6.180 6.749 -7.207 1.00 0.00 H new ATOM 0 HE21 GLN A 43 5.783 7.273 -5.057 1.00 0.00 H new ATOM 0 HE22 GLN A 43 5.194 6.133 -3.842 1.00 0.00 H new ATOM 636 N GLU A 44 4.294 8.049 -8.660 1.00 0.00 N ATOM 637 CA GLU A 44 4.541 9.482 -8.732 1.00 0.00 C ATOM 638 C GLU A 44 3.237 10.270 -8.950 1.00 0.00 C ATOM 639 O GLU A 44 3.184 11.457 -8.645 1.00 0.00 O ATOM 640 CB GLU A 44 5.580 9.781 -9.830 1.00 0.00 C ATOM 641 CG GLU A 44 5.118 9.380 -11.242 1.00 0.00 C ATOM 642 CD GLU A 44 6.222 9.670 -12.273 1.00 0.00 C ATOM 643 OE1 GLU A 44 7.059 8.796 -12.503 1.00 0.00 O ATOM 644 OE2 GLU A 44 6.233 10.764 -12.835 1.00 0.00 O ATOM 0 H GLU A 44 4.782 7.519 -9.381 1.00 0.00 H new ATOM 0 HA GLU A 44 4.948 9.812 -7.776 1.00 0.00 H new ATOM 0 HB2 GLU A 44 5.809 10.847 -9.821 1.00 0.00 H new ATOM 0 HB3 GLU A 44 6.505 9.254 -9.596 1.00 0.00 H new ATOM 0 HG2 GLU A 44 4.864 8.320 -11.261 1.00 0.00 H new ATOM 0 HG3 GLU A 44 4.214 9.929 -11.505 1.00 0.00 H new ATOM 651 N ASP A 45 2.193 9.591 -9.470 1.00 0.00 N ATOM 652 CA ASP A 45 0.954 10.307 -9.724 1.00 0.00 C ATOM 653 C ASP A 45 0.061 10.180 -8.496 1.00 0.00 C ATOM 654 O ASP A 45 -0.651 11.126 -8.179 1.00 0.00 O ATOM 655 CB ASP A 45 0.269 9.789 -11.004 1.00 0.00 C ATOM 656 CG ASP A 45 1.238 9.818 -12.201 1.00 0.00 C ATOM 657 OD1 ASP A 45 1.457 10.893 -12.757 1.00 0.00 O ATOM 658 OD2 ASP A 45 1.765 8.765 -12.561 1.00 0.00 O ATOM 0 H ASP A 45 2.190 8.599 -9.708 1.00 0.00 H new ATOM 0 HA ASP A 45 1.160 11.363 -9.898 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -0.086 8.771 -10.844 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -0.606 10.400 -11.225 1.00 0.00 H new ATOM 663 N PHE A 46 0.114 9.011 -7.803 1.00 0.00 N ATOM 664 CA PHE A 46 -0.759 8.893 -6.645 1.00 0.00 C ATOM 665 C PHE A 46 -0.076 9.510 -5.418 1.00 0.00 C ATOM 666 O PHE A 46 -0.711 9.651 -4.383 1.00 0.00 O ATOM 667 CB PHE A 46 -1.233 7.456 -6.380 1.00 0.00 C ATOM 668 CG PHE A 46 -2.343 7.465 -5.362 1.00 0.00 C ATOM 669 CD1 PHE A 46 -3.606 7.946 -5.697 1.00 0.00 C ATOM 670 CD2 PHE A 46 -2.104 7.040 -4.061 1.00 0.00 C ATOM 671 CE1 PHE A 46 -4.610 8.022 -4.744 1.00 0.00 C ATOM 672 CE2 PHE A 46 -3.104 7.118 -3.108 1.00 0.00 C ATOM 673 CZ PHE A 46 -4.355 7.614 -3.445 1.00 0.00 C ATOM 0 H PHE A 46 0.706 8.208 -8.015 1.00 0.00 H new ATOM 0 HA PHE A 46 -1.669 9.452 -6.863 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -1.581 7.001 -7.307 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -0.402 6.850 -6.020 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -3.806 8.263 -6.710 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -1.134 6.647 -3.793 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -5.586 8.397 -5.013 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -2.910 6.791 -2.097 1.00 0.00 H new ATOM 0 HZ PHE A 46 -5.129 7.682 -2.695 1.00 0.00 H new ATOM 683 N ILE A 47 1.217 9.875 -5.544 1.00 0.00 N ATOM 684 CA ILE A 47 1.893 10.492 -4.406 1.00 0.00 C ATOM 685 C ILE A 47 1.505 11.979 -4.456 1.00 0.00 C ATOM 686 O ILE A 47 1.458 12.650 -3.431 1.00 0.00 O ATOM 687 CB ILE A 47 3.415 10.188 -4.357 1.00 0.00 C ATOM 688 CG1 ILE A 47 3.776 8.874 -3.562 1.00 0.00 C ATOM 689 CG2 ILE A 47 4.171 11.018 -5.443 1.00 0.00 C ATOM 690 CD1 ILE A 47 2.888 7.622 -3.772 1.00 0.00 C ATOM 0 H ILE A 47 1.784 9.757 -6.384 1.00 0.00 H new ATOM 0 HA ILE A 47 1.570 10.067 -3.456 1.00 0.00 H new ATOM 0 HB ILE A 47 4.216 10.505 -3.689 1.00 0.00 H new ATOM 0 HG12 ILE A 47 4.800 8.602 -3.817 1.00 0.00 H new ATOM 0 HG13 ILE A 47 3.765 9.115 -2.499 1.00 0.00 H new ATOM 0 HG21 ILE A 47 5.237 10.794 -5.396 1.00 0.00 H new ATOM 0 HG22 ILE A 47 3.789 10.759 -6.430 1.00 0.00 H new ATOM 0 HG23 ILE A 47 4.016 12.082 -5.262 1.00 0.00 H new ATOM 0 HD11 ILE A 47 3.263 6.803 -3.159 1.00 0.00 H new ATOM 0 HD12 ILE A 47 1.862 7.851 -3.484 1.00 0.00 H new ATOM 0 HD13 ILE A 47 2.913 7.330 -4.822 1.00 0.00 H new ATOM 702 N ASN A 48 1.199 12.446 -5.698 1.00 0.00 N ATOM 703 CA ASN A 48 0.752 13.819 -5.867 1.00 0.00 C ATOM 704 C ASN A 48 -0.721 13.844 -5.400 1.00 0.00 C ATOM 705 O ASN A 48 -1.208 14.850 -4.897 1.00 0.00 O ATOM 706 CB ASN A 48 0.920 14.237 -7.340 1.00 0.00 C ATOM 707 CG ASN A 48 0.495 15.695 -7.570 1.00 0.00 C ATOM 708 OD1 ASN A 48 -0.544 15.979 -8.152 1.00 0.00 O ATOM 709 ND2 ASN A 48 1.369 16.590 -7.073 1.00 0.00 N ATOM 0 H ASN A 48 1.257 11.899 -6.557 1.00 0.00 H new ATOM 0 HA ASN A 48 1.334 14.532 -5.283 1.00 0.00 H new ATOM 0 HB2 ASN A 48 1.961 14.110 -7.638 1.00 0.00 H new ATOM 0 HB3 ASN A 48 0.325 13.580 -7.975 1.00 0.00 H new ATOM 0 HD21 ASN A 48 1.186 17.589 -7.169 1.00 0.00 H new ATOM 0 HD22 ASN A 48 2.214 16.269 -6.600 1.00 0.00 H new ATOM 716 N ALA A 49 -1.392 12.678 -5.577 1.00 0.00 N ATOM 717 CA ALA A 49 -2.780 12.559 -5.169 1.00 0.00 C ATOM 718 C ALA A 49 -2.810 12.059 -3.714 1.00 0.00 C ATOM 719 O ALA A 49 -3.885 11.846 -3.181 1.00 0.00 O ATOM 720 CB ALA A 49 -3.550 11.612 -6.097 1.00 0.00 C ATOM 0 H ALA A 49 -0.991 11.836 -5.991 1.00 0.00 H new ATOM 0 HA ALA A 49 -3.270 13.530 -5.236 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -4.587 11.542 -5.767 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -3.519 11.996 -7.116 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -3.093 10.623 -6.068 1.00 0.00 H new ATOM 726 N ALA A 50 -1.623 11.870 -3.086 1.00 0.00 N ATOM 727 CA ALA A 50 -1.573 11.426 -1.695 1.00 0.00 C ATOM 728 C ALA A 50 -1.633 12.696 -0.849 1.00 0.00 C ATOM 729 O ALA A 50 -1.977 12.646 0.321 1.00 0.00 O ATOM 730 CB ALA A 50 -0.306 10.615 -1.388 1.00 0.00 C ATOM 0 H ALA A 50 -0.712 12.018 -3.521 1.00 0.00 H new ATOM 0 HA ALA A 50 -2.404 10.755 -1.476 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -0.315 10.308 -0.342 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -0.276 9.731 -2.026 1.00 0.00 H new ATOM 0 HB3 ALA A 50 0.574 11.229 -1.578 1.00 0.00 H new ATOM 736 N ILE A 51 -1.286 13.835 -1.489 1.00 0.00 N ATOM 737 CA ILE A 51 -1.361 15.123 -0.816 1.00 0.00 C ATOM 738 C ILE A 51 -2.869 15.442 -0.755 1.00 0.00 C ATOM 739 O ILE A 51 -3.389 15.932 0.240 1.00 0.00 O ATOM 740 CB ILE A 51 -0.577 16.206 -1.631 1.00 0.00 C ATOM 741 CG1 ILE A 51 0.670 15.720 -2.398 1.00 0.00 C ATOM 742 CG2 ILE A 51 -0.844 17.615 -1.009 1.00 0.00 C ATOM 743 CD1 ILE A 51 1.474 16.794 -3.162 1.00 0.00 C ATOM 0 H ILE A 51 -0.958 13.876 -2.454 1.00 0.00 H new ATOM 0 HA ILE A 51 -0.913 15.109 0.178 1.00 0.00 H new ATOM 0 HB ILE A 51 -0.905 16.458 -2.639 1.00 0.00 H new ATOM 0 HG12 ILE A 51 1.339 15.235 -1.688 1.00 0.00 H new ATOM 0 HG13 ILE A 51 0.356 14.958 -3.111 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -0.299 18.371 -1.574 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -1.911 17.833 -1.046 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -0.508 17.625 0.028 1.00 0.00 H new ATOM 0 HD11 ILE A 51 2.324 16.327 -3.659 1.00 0.00 H new ATOM 0 HD12 ILE A 51 0.834 17.267 -3.907 1.00 0.00 H new ATOM 0 HD13 ILE A 51 1.832 17.548 -2.461 1.00 0.00 H new ATOM 755 N GLU A 52 -3.518 15.096 -1.893 1.00 0.00 N ATOM 756 CA GLU A 52 -4.936 15.291 -2.118 1.00 0.00 C ATOM 757 C GLU A 52 -5.754 14.481 -1.089 1.00 0.00 C ATOM 758 O GLU A 52 -6.415 15.064 -0.238 1.00 0.00 O ATOM 759 CB GLU A 52 -5.273 14.936 -3.580 1.00 0.00 C ATOM 760 CG GLU A 52 -6.777 14.887 -3.895 1.00 0.00 C ATOM 761 CD GLU A 52 -7.004 14.596 -5.388 1.00 0.00 C ATOM 762 OE1 GLU A 52 -6.915 13.433 -5.781 1.00 0.00 O ATOM 763 OE2 GLU A 52 -7.266 15.533 -6.142 1.00 0.00 O ATOM 0 H GLU A 52 -3.043 14.665 -2.686 1.00 0.00 H new ATOM 0 HA GLU A 52 -5.207 16.336 -1.969 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -4.801 15.668 -4.236 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -4.834 13.967 -3.815 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -7.256 14.117 -3.291 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -7.242 15.836 -3.628 1.00 0.00 H new ATOM 770 N THR A 53 -5.696 13.128 -1.205 1.00 0.00 N ATOM 771 CA THR A 53 -6.479 12.252 -0.346 1.00 0.00 C ATOM 772 C THR A 53 -5.993 12.376 1.096 1.00 0.00 C ATOM 773 O THR A 53 -6.731 12.796 1.978 1.00 0.00 O ATOM 774 CB THR A 53 -6.535 10.765 -0.866 1.00 0.00 C ATOM 775 OG1 THR A 53 -5.642 10.377 -1.953 1.00 0.00 O ATOM 776 CG2 THR A 53 -8.009 10.317 -1.102 1.00 0.00 C ATOM 0 H THR A 53 -5.114 12.640 -1.886 1.00 0.00 H new ATOM 0 HA THR A 53 -7.518 12.581 -0.377 1.00 0.00 H new ATOM 0 HB THR A 53 -6.101 10.198 -0.042 1.00 0.00 H new ATOM 0 HG1 THR A 53 -4.854 10.959 -1.952 1.00 0.00 H new ATOM 0 HG21 THR A 53 -8.023 9.288 -1.461 1.00 0.00 H new ATOM 0 HG22 THR A 53 -8.564 10.383 -0.166 1.00 0.00 H new ATOM 0 HG23 THR A 53 -8.472 10.967 -1.845 1.00 0.00 H new ATOM 784 N LYS A 54 -4.723 11.959 1.241 1.00 0.00 N ATOM 785 CA LYS A 54 -3.963 11.899 2.493 1.00 0.00 C ATOM 786 C LYS A 54 -3.790 10.400 2.739 1.00 0.00 C ATOM 787 O LYS A 54 -4.068 9.886 3.813 1.00 0.00 O ATOM 788 CB LYS A 54 -4.600 12.630 3.695 1.00 0.00 C ATOM 789 CG LYS A 54 -3.645 12.783 4.887 1.00 0.00 C ATOM 790 CD LYS A 54 -4.169 13.792 5.917 1.00 0.00 C ATOM 791 CE LYS A 54 -3.141 14.147 6.997 1.00 0.00 C ATOM 792 NZ LYS A 54 -1.995 14.878 6.469 1.00 0.00 N ATOM 0 H LYS A 54 -4.174 11.639 0.443 1.00 0.00 H new ATOM 0 HA LYS A 54 -3.020 12.437 2.395 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -4.933 13.618 3.376 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -5.486 12.083 4.016 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -3.506 11.814 5.367 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -2.667 13.105 4.529 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -4.472 14.703 5.401 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -5.060 13.384 6.394 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -3.624 14.746 7.769 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -2.793 13.232 7.476 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -1.420 15.238 7.257 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -1.418 14.242 5.882 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -2.328 15.676 5.891 1.00 0.00 H new ATOM 805 N ALA A 55 -3.301 9.756 1.651 1.00 0.00 N ATOM 806 CA ALA A 55 -3.057 8.328 1.546 1.00 0.00 C ATOM 807 C ALA A 55 -2.228 7.879 2.754 1.00 0.00 C ATOM 808 O ALA A 55 -1.053 8.200 2.862 1.00 0.00 O ATOM 809 CB ALA A 55 -2.331 8.043 0.228 1.00 0.00 C ATOM 0 H ALA A 55 -3.061 10.255 0.794 1.00 0.00 H new ATOM 0 HA ALA A 55 -3.994 7.771 1.546 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -2.143 6.973 0.140 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -2.949 8.373 -0.607 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -1.383 8.580 0.211 1.00 0.00 H new ATOM 815 N ASP A 56 -2.903 7.112 3.646 1.00 0.00 N ATOM 816 CA ASP A 56 -2.233 6.623 4.841 1.00 0.00 C ATOM 817 C ASP A 56 -1.438 5.384 4.422 1.00 0.00 C ATOM 818 O ASP A 56 -0.294 5.223 4.831 1.00 0.00 O ATOM 819 CB ASP A 56 -3.230 6.333 5.984 1.00 0.00 C ATOM 820 CG ASP A 56 -2.550 5.651 7.189 1.00 0.00 C ATOM 821 OD1 ASP A 56 -1.886 6.344 7.959 1.00 0.00 O ATOM 822 OD2 ASP A 56 -2.685 4.436 7.338 1.00 0.00 O ATOM 0 H ASP A 56 -3.880 6.834 3.552 1.00 0.00 H new ATOM 0 HA ASP A 56 -1.562 7.379 5.247 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -3.690 7.266 6.309 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -4.032 5.695 5.612 1.00 0.00 H new ATOM 827 N LEU A 57 -2.086 4.528 3.593 1.00 0.00 N ATOM 828 CA LEU A 57 -1.375 3.330 3.181 1.00 0.00 C ATOM 829 C LEU A 57 -1.908 2.923 1.811 1.00 0.00 C ATOM 830 O LEU A 57 -2.991 3.307 1.380 1.00 0.00 O ATOM 831 CB LEU A 57 -1.516 2.234 4.251 1.00 0.00 C ATOM 832 CG LEU A 57 -2.894 1.514 4.281 1.00 0.00 C ATOM 833 CD1 LEU A 57 -2.715 0.058 3.761 1.00 0.00 C ATOM 834 CD2 LEU A 57 -4.055 2.028 5.161 1.00 0.00 C ATOM 0 H LEU A 57 -3.031 4.644 3.227 1.00 0.00 H new ATOM 0 HA LEU A 57 -0.304 3.508 3.088 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -0.737 1.488 4.090 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -1.334 2.678 5.230 1.00 0.00 H new ATOM 0 HG LEU A 57 -3.653 1.939 3.624 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -3.676 -0.455 3.778 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -2.334 0.081 2.740 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -2.009 -0.472 4.400 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -4.923 1.381 5.032 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -3.749 2.021 6.207 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -4.313 3.045 4.865 1.00 0.00 H new ATOM 846 N ILE A 58 -1.041 2.104 1.169 1.00 0.00 N ATOM 847 CA ILE A 58 -1.323 1.593 -0.166 1.00 0.00 C ATOM 848 C ILE A 58 -1.272 0.065 -0.058 1.00 0.00 C ATOM 849 O ILE A 58 -0.426 -0.510 0.614 1.00 0.00 O ATOM 850 CB ILE A 58 -0.306 2.167 -1.217 1.00 0.00 C ATOM 851 CG1 ILE A 58 0.251 3.597 -0.976 1.00 0.00 C ATOM 852 CG2 ILE A 58 -0.402 1.366 -2.558 1.00 0.00 C ATOM 853 CD1 ILE A 58 -0.849 4.642 -1.193 1.00 0.00 C ATOM 0 H ILE A 58 -0.152 1.793 1.561 1.00 0.00 H new ATOM 0 HA ILE A 58 -2.304 1.908 -0.522 1.00 0.00 H new ATOM 0 HB ILE A 58 0.771 2.034 -1.116 1.00 0.00 H new ATOM 0 HG12 ILE A 58 0.641 3.676 0.039 1.00 0.00 H new ATOM 0 HG13 ILE A 58 1.083 3.789 -1.654 1.00 0.00 H new ATOM 0 HG21 ILE A 58 0.308 1.774 -3.277 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -0.169 0.317 -2.373 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -1.412 1.448 -2.959 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -0.443 5.639 -1.020 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -1.220 4.573 -2.216 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -1.668 4.458 -0.497 1.00 0.00 H new ATOM 865 N CYS A 59 -2.247 -0.539 -0.780 1.00 0.00 N ATOM 866 CA CYS A 59 -2.383 -1.985 -0.851 1.00 0.00 C ATOM 867 C CYS A 59 -2.667 -2.294 -2.321 1.00 0.00 C ATOM 868 O CYS A 59 -3.605 -1.778 -2.920 1.00 0.00 O ATOM 869 CB CYS A 59 -3.543 -2.525 0.009 1.00 0.00 C ATOM 870 SG CYS A 59 -3.340 -2.200 1.769 1.00 0.00 S ATOM 0 H CYS A 59 -2.947 -0.029 -1.319 1.00 0.00 H new ATOM 0 HA CYS A 59 -1.478 -2.459 -0.471 1.00 0.00 H new ATOM 0 HB2 CYS A 59 -4.477 -2.076 -0.330 1.00 0.00 H new ATOM 0 HB3 CYS A 59 -3.631 -3.600 -0.147 1.00 0.00 H new ATOM 0 HG CYS A 59 -4.384 -2.631 2.413 1.00 0.00 H new ATOM 876 N VAL A 60 -1.782 -3.169 -2.848 1.00 0.00 N ATOM 877 CA VAL A 60 -1.918 -3.643 -4.228 1.00 0.00 C ATOM 878 C VAL A 60 -2.272 -5.132 -4.118 1.00 0.00 C ATOM 879 O VAL A 60 -1.666 -5.840 -3.320 1.00 0.00 O ATOM 880 CB VAL A 60 -0.638 -3.364 -5.085 1.00 0.00 C ATOM 881 CG1 VAL A 60 -0.388 -1.827 -5.157 1.00 0.00 C ATOM 882 CG2 VAL A 60 0.406 -4.407 -5.596 1.00 0.00 C ATOM 0 H VAL A 60 -0.982 -3.551 -2.343 1.00 0.00 H new ATOM 0 HA VAL A 60 -2.700 -3.104 -4.764 1.00 0.00 H new ATOM 0 HB VAL A 60 -0.693 -4.046 -5.934 1.00 0.00 H new ATOM 0 HG11 VAL A 60 0.503 -1.631 -5.753 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -1.247 -1.340 -5.618 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -0.245 -1.434 -4.150 1.00 0.00 H new ATOM 0 HG21 VAL A 60 1.182 -3.896 -6.166 1.00 0.00 H new ATOM 0 HG22 VAL A 60 0.857 -4.917 -4.745 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -0.092 -5.137 -6.234 1.00 0.00 H new ATOM 892 N SER A 61 -3.278 -5.569 -4.930 1.00 0.00 N ATOM 893 CA SER A 61 -3.675 -6.981 -4.815 1.00 0.00 C ATOM 894 C SER A 61 -3.197 -7.757 -6.058 1.00 0.00 C ATOM 895 O SER A 61 -3.737 -7.637 -7.149 1.00 0.00 O ATOM 896 CB SER A 61 -5.210 -7.051 -4.540 1.00 0.00 C ATOM 897 OG SER A 61 -5.895 -5.840 -4.019 1.00 0.00 O ATOM 0 H SER A 61 -3.786 -5.008 -5.614 1.00 0.00 H new ATOM 0 HA SER A 61 -3.194 -7.472 -3.969 1.00 0.00 H new ATOM 0 HB2 SER A 61 -5.701 -7.334 -5.471 1.00 0.00 H new ATOM 0 HB3 SER A 61 -5.383 -7.860 -3.830 1.00 0.00 H new ATOM 0 HG SER A 61 -6.591 -5.561 -4.650 1.00 0.00 H new ATOM 903 N SER A 62 -2.144 -8.563 -5.797 1.00 0.00 N ATOM 904 CA SER A 62 -1.457 -9.444 -6.745 1.00 0.00 C ATOM 905 C SER A 62 0.032 -9.134 -6.540 1.00 0.00 C ATOM 906 O SER A 62 0.417 -8.338 -5.692 1.00 0.00 O ATOM 907 CB SER A 62 -1.907 -9.355 -8.248 1.00 0.00 C ATOM 908 OG SER A 62 -3.330 -9.592 -8.614 1.00 0.00 O ATOM 0 H SER A 62 -1.734 -8.613 -4.864 1.00 0.00 H new ATOM 0 HA SER A 62 -1.716 -10.481 -6.533 1.00 0.00 H new ATOM 0 HB2 SER A 62 -1.641 -8.361 -8.608 1.00 0.00 H new ATOM 0 HB3 SER A 62 -1.305 -10.069 -8.810 1.00 0.00 H new ATOM 0 HG SER A 62 -3.912 -9.099 -7.999 1.00 0.00 H new ATOM 914 N LEU A 63 0.830 -9.819 -7.390 1.00 0.00 N ATOM 915 CA LEU A 63 2.278 -9.763 -7.413 1.00 0.00 C ATOM 916 C LEU A 63 2.710 -8.343 -7.832 1.00 0.00 C ATOM 917 O LEU A 63 1.934 -7.397 -7.792 1.00 0.00 O ATOM 918 CB LEU A 63 2.799 -10.874 -8.348 1.00 0.00 C ATOM 919 CG LEU A 63 2.358 -12.306 -7.904 1.00 0.00 C ATOM 920 CD1 LEU A 63 2.579 -13.289 -9.093 1.00 0.00 C ATOM 921 CD2 LEU A 63 2.218 -12.719 -6.415 1.00 0.00 C ATOM 0 H LEU A 63 0.451 -10.446 -8.100 1.00 0.00 H new ATOM 0 HA LEU A 63 2.713 -9.948 -6.431 1.00 0.00 H new ATOM 0 HB2 LEU A 63 2.440 -10.687 -9.360 1.00 0.00 H new ATOM 0 HB3 LEU A 63 3.888 -10.830 -8.383 1.00 0.00 H new ATOM 0 HG LEU A 63 1.305 -12.367 -7.628 1.00 0.00 H new ATOM 0 HD11 LEU A 63 2.275 -14.293 -8.796 1.00 0.00 H new ATOM 0 HD12 LEU A 63 1.983 -12.967 -9.947 1.00 0.00 H new ATOM 0 HD13 LEU A 63 3.634 -13.296 -9.368 1.00 0.00 H new ATOM 0 HD21 LEU A 63 1.900 -13.760 -6.354 1.00 0.00 H new ATOM 0 HD22 LEU A 63 3.179 -12.603 -5.913 1.00 0.00 H new ATOM 0 HD23 LEU A 63 1.477 -12.084 -5.930 1.00 0.00 H new ATOM 933 N TYR A 64 4.007 -8.261 -8.233 1.00 0.00 N ATOM 934 CA TYR A 64 4.628 -7.022 -8.661 1.00 0.00 C ATOM 935 C TYR A 64 3.935 -6.593 -9.962 1.00 0.00 C ATOM 936 O TYR A 64 4.248 -7.043 -11.057 1.00 0.00 O ATOM 937 CB TYR A 64 6.152 -7.166 -8.896 1.00 0.00 C ATOM 938 CG TYR A 64 6.973 -7.110 -7.630 1.00 0.00 C ATOM 939 CD1 TYR A 64 7.091 -5.921 -6.919 1.00 0.00 C ATOM 940 CD2 TYR A 64 7.639 -8.234 -7.159 1.00 0.00 C ATOM 941 CE1 TYR A 64 7.850 -5.852 -5.757 1.00 0.00 C ATOM 942 CE2 TYR A 64 8.407 -8.178 -6.003 1.00 0.00 C ATOM 943 CZ TYR A 64 8.518 -6.985 -5.280 1.00 0.00 C ATOM 944 OH TYR A 64 9.238 -6.933 -4.086 1.00 0.00 O ATOM 0 H TYR A 64 4.634 -9.065 -8.261 1.00 0.00 H new ATOM 0 HA TYR A 64 4.511 -6.276 -7.875 1.00 0.00 H new ATOM 0 HB2 TYR A 64 6.344 -8.113 -9.401 1.00 0.00 H new ATOM 0 HB3 TYR A 64 6.483 -6.374 -9.568 1.00 0.00 H new ATOM 0 HD1 TYR A 64 6.584 -5.036 -7.276 1.00 0.00 H new ATOM 0 HD2 TYR A 64 7.559 -9.165 -7.700 1.00 0.00 H new ATOM 0 HE1 TYR A 64 7.925 -4.918 -5.219 1.00 0.00 H new ATOM 0 HE2 TYR A 64 8.923 -9.062 -5.659 1.00 0.00 H new ATOM 0 HH TYR A 64 8.829 -6.275 -3.486 1.00 0.00 H new ATOM 954 N GLY A 65 2.980 -5.677 -9.723 1.00 0.00 N ATOM 955 CA GLY A 65 2.164 -5.032 -10.741 1.00 0.00 C ATOM 956 C GLY A 65 2.550 -3.547 -10.766 1.00 0.00 C ATOM 957 O GLY A 65 2.466 -2.862 -11.779 1.00 0.00 O ATOM 0 H GLY A 65 2.755 -5.361 -8.779 1.00 0.00 H new ATOM 0 HA2 GLY A 65 2.334 -5.489 -11.716 1.00 0.00 H new ATOM 0 HA3 GLY A 65 1.104 -5.149 -10.515 1.00 0.00 H new ATOM 961 N GLN A 66 2.996 -3.126 -9.559 1.00 0.00 N ATOM 962 CA GLN A 66 3.456 -1.787 -9.274 1.00 0.00 C ATOM 963 C GLN A 66 4.944 -1.738 -9.690 1.00 0.00 C ATOM 964 O GLN A 66 5.464 -0.721 -10.131 1.00 0.00 O ATOM 965 CB GLN A 66 3.192 -1.498 -7.779 1.00 0.00 C ATOM 966 CG GLN A 66 4.069 -2.320 -6.818 1.00 0.00 C ATOM 967 CD GLN A 66 3.747 -1.990 -5.356 1.00 0.00 C ATOM 968 OE1 GLN A 66 2.758 -2.444 -4.794 1.00 0.00 O ATOM 969 NE2 GLN A 66 4.653 -1.179 -4.783 1.00 0.00 N ATOM 0 H GLN A 66 3.039 -3.742 -8.747 1.00 0.00 H new ATOM 0 HA GLN A 66 2.934 -1.006 -9.826 1.00 0.00 H new ATOM 0 HB2 GLN A 66 3.359 -0.438 -7.590 1.00 0.00 H new ATOM 0 HB3 GLN A 66 2.143 -1.700 -7.560 1.00 0.00 H new ATOM 0 HG2 GLN A 66 3.911 -3.384 -6.997 1.00 0.00 H new ATOM 0 HG3 GLN A 66 5.121 -2.116 -7.017 1.00 0.00 H new ATOM 0 HE21 GLN A 66 5.451 -0.844 -5.323 1.00 0.00 H new ATOM 0 HE22 GLN A 66 4.542 -0.899 -3.809 1.00 0.00 H new ATOM 978 N GLY A 67 5.584 -2.913 -9.530 1.00 0.00 N ATOM 979 CA GLY A 67 6.993 -3.088 -9.864 1.00 0.00 C ATOM 980 C GLY A 67 7.891 -2.739 -8.671 1.00 0.00 C ATOM 981 O GLY A 67 7.429 -2.336 -7.612 1.00 0.00 O ATOM 0 H GLY A 67 5.135 -3.755 -9.168 1.00 0.00 H new ATOM 0 HA2 GLY A 67 7.172 -4.119 -10.169 1.00 0.00 H new ATOM 0 HA3 GLY A 67 7.250 -2.455 -10.714 1.00 0.00 H new ATOM 985 N GLU A 68 9.206 -2.913 -8.929 1.00 0.00 N ATOM 986 CA GLU A 68 10.228 -2.645 -7.927 1.00 0.00 C ATOM 987 C GLU A 68 10.491 -1.124 -7.889 1.00 0.00 C ATOM 988 O GLU A 68 11.190 -0.643 -7.005 1.00 0.00 O ATOM 989 CB GLU A 68 11.520 -3.408 -8.266 1.00 0.00 C ATOM 990 CG GLU A 68 11.368 -4.931 -8.115 1.00 0.00 C ATOM 991 CD GLU A 68 12.623 -5.669 -8.621 1.00 0.00 C ATOM 992 OE1 GLU A 68 13.728 -5.311 -8.212 1.00 0.00 O ATOM 993 OE2 GLU A 68 12.483 -6.596 -9.419 1.00 0.00 O ATOM 0 H GLU A 68 9.571 -3.238 -9.824 1.00 0.00 H new ATOM 0 HA GLU A 68 9.887 -2.983 -6.948 1.00 0.00 H new ATOM 0 HB2 GLU A 68 11.816 -3.176 -9.289 1.00 0.00 H new ATOM 0 HB3 GLU A 68 12.323 -3.061 -7.616 1.00 0.00 H new ATOM 0 HG2 GLU A 68 11.194 -5.180 -7.068 1.00 0.00 H new ATOM 0 HG3 GLU A 68 10.494 -5.269 -8.673 1.00 0.00 H new ATOM 1000 N ILE A 69 9.910 -0.394 -8.871 1.00 0.00 N ATOM 1001 CA ILE A 69 10.083 1.048 -8.961 1.00 0.00 C ATOM 1002 C ILE A 69 9.112 1.662 -7.947 1.00 0.00 C ATOM 1003 O ILE A 69 9.484 2.510 -7.145 1.00 0.00 O ATOM 1004 CB ILE A 69 9.818 1.543 -10.423 1.00 0.00 C ATOM 1005 CG1 ILE A 69 10.115 0.550 -11.575 1.00 0.00 C ATOM 1006 CG2 ILE A 69 9.813 3.105 -10.453 1.00 0.00 C ATOM 1007 CD1 ILE A 69 11.614 0.230 -11.620 1.00 0.00 C ATOM 0 H ILE A 69 9.322 -0.793 -9.603 1.00 0.00 H new ATOM 0 HA ILE A 69 11.104 1.352 -8.729 1.00 0.00 H new ATOM 0 HB ILE A 69 8.840 1.426 -10.890 1.00 0.00 H new ATOM 0 HG12 ILE A 69 9.543 -0.367 -11.432 1.00 0.00 H new ATOM 0 HG13 ILE A 69 9.798 0.978 -12.526 1.00 0.00 H new ATOM 0 HG21 ILE A 69 9.629 3.449 -11.471 1.00 0.00 H new ATOM 0 HG22 ILE A 69 9.028 3.479 -9.796 1.00 0.00 H new ATOM 0 HG23 ILE A 69 10.779 3.479 -10.113 1.00 0.00 H new ATOM 0 HD11 ILE A 69 11.813 -0.469 -12.433 1.00 0.00 H new ATOM 0 HD12 ILE A 69 12.177 1.148 -11.785 1.00 0.00 H new ATOM 0 HD13 ILE A 69 11.919 -0.218 -10.674 1.00 0.00 H new ATOM 1019 N ASP A 70 7.851 1.173 -8.022 1.00 0.00 N ATOM 1020 CA ASP A 70 6.813 1.660 -7.124 1.00 0.00 C ATOM 1021 C ASP A 70 7.110 1.103 -5.721 1.00 0.00 C ATOM 1022 O ASP A 70 6.641 1.644 -4.727 1.00 0.00 O ATOM 1023 CB ASP A 70 5.419 1.207 -7.593 1.00 0.00 C ATOM 1024 CG ASP A 70 4.964 1.825 -8.935 1.00 0.00 C ATOM 1025 OD1 ASP A 70 5.797 2.325 -9.693 1.00 0.00 O ATOM 1026 OD2 ASP A 70 3.765 1.799 -9.208 1.00 0.00 O ATOM 0 H ASP A 70 7.547 0.459 -8.683 1.00 0.00 H new ATOM 0 HA ASP A 70 6.813 2.750 -7.114 1.00 0.00 H new ATOM 0 HB2 ASP A 70 5.416 0.121 -7.688 1.00 0.00 H new ATOM 0 HB3 ASP A 70 4.690 1.462 -6.824 1.00 0.00 H new ATOM 1031 N CYS A 71 7.912 0.008 -5.686 1.00 0.00 N ATOM 1032 CA CYS A 71 8.282 -0.603 -4.422 1.00 0.00 C ATOM 1033 C CYS A 71 9.248 0.380 -3.745 1.00 0.00 C ATOM 1034 O CYS A 71 9.098 0.684 -2.572 1.00 0.00 O ATOM 1035 CB CYS A 71 8.901 -1.994 -4.638 1.00 0.00 C ATOM 1036 SG CYS A 71 8.968 -3.009 -3.144 1.00 0.00 S ATOM 0 H CYS A 71 8.299 -0.449 -6.512 1.00 0.00 H new ATOM 0 HA CYS A 71 7.415 -0.778 -3.785 1.00 0.00 H new ATOM 0 HB2 CYS A 71 8.326 -2.522 -5.398 1.00 0.00 H new ATOM 0 HB3 CYS A 71 9.911 -1.874 -5.029 1.00 0.00 H new ATOM 0 HG CYS A 71 10.198 -3.359 -2.912 1.00 0.00 H new ATOM 1042 N LYS A 72 10.214 0.892 -4.556 1.00 0.00 N ATOM 1043 CA LYS A 72 11.203 1.848 -4.061 1.00 0.00 C ATOM 1044 C LYS A 72 10.672 3.273 -4.245 1.00 0.00 C ATOM 1045 O LYS A 72 11.421 4.240 -4.203 1.00 0.00 O ATOM 1046 CB LYS A 72 12.546 1.685 -4.798 1.00 0.00 C ATOM 1047 CG LYS A 72 13.240 0.360 -4.488 1.00 0.00 C ATOM 1048 CD LYS A 72 14.554 0.185 -5.263 1.00 0.00 C ATOM 1049 CE LYS A 72 14.329 -0.211 -6.727 1.00 0.00 C ATOM 1050 NZ LYS A 72 15.582 -0.393 -7.448 1.00 0.00 N ATOM 0 H LYS A 72 10.316 0.652 -5.542 1.00 0.00 H new ATOM 0 HA LYS A 72 11.374 1.655 -3.002 1.00 0.00 H new ATOM 0 HB2 LYS A 72 12.376 1.757 -5.872 1.00 0.00 H new ATOM 0 HB3 LYS A 72 13.207 2.508 -4.524 1.00 0.00 H new ATOM 0 HG2 LYS A 72 13.443 0.302 -3.419 1.00 0.00 H new ATOM 0 HG3 LYS A 72 12.568 -0.463 -4.730 1.00 0.00 H new ATOM 0 HD2 LYS A 72 15.120 1.116 -5.225 1.00 0.00 H new ATOM 0 HD3 LYS A 72 15.161 -0.577 -4.774 1.00 0.00 H new ATOM 0 HE2 LYS A 72 13.752 -1.135 -6.767 1.00 0.00 H new ATOM 0 HE3 LYS A 72 13.735 0.558 -7.222 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 15.380 -0.660 -8.433 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 16.123 0.495 -7.434 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 16.138 -1.144 -6.993 1.00 0.00 H new ATOM 1063 N GLY A 73 9.354 3.346 -4.434 1.00 0.00 N ATOM 1064 CA GLY A 73 8.653 4.601 -4.633 1.00 0.00 C ATOM 1065 C GLY A 73 7.974 5.042 -3.335 1.00 0.00 C ATOM 1066 O GLY A 73 7.836 6.226 -3.054 1.00 0.00 O ATOM 0 H GLY A 73 8.745 2.528 -4.452 1.00 0.00 H new ATOM 0 HA2 GLY A 73 9.353 5.368 -4.964 1.00 0.00 H new ATOM 0 HA3 GLY A 73 7.908 4.488 -5.421 1.00 0.00 H new ATOM 1070 N LEU A 74 7.572 4.003 -2.570 1.00 0.00 N ATOM 1071 CA LEU A 74 6.910 4.196 -1.294 1.00 0.00 C ATOM 1072 C LEU A 74 8.014 4.269 -0.228 1.00 0.00 C ATOM 1073 O LEU A 74 7.834 4.881 0.817 1.00 0.00 O ATOM 1074 CB LEU A 74 5.887 3.068 -1.075 1.00 0.00 C ATOM 1075 CG LEU A 74 4.897 2.962 -2.307 1.00 0.00 C ATOM 1076 CD1 LEU A 74 3.966 1.839 -2.909 1.00 0.00 C ATOM 1077 CD2 LEU A 74 4.049 4.254 -2.295 1.00 0.00 C ATOM 0 H LEU A 74 7.702 3.025 -2.829 1.00 0.00 H new ATOM 0 HA LEU A 74 6.334 5.120 -1.245 1.00 0.00 H new ATOM 0 HB2 LEU A 74 6.407 2.120 -0.938 1.00 0.00 H new ATOM 0 HB3 LEU A 74 5.321 3.256 -0.163 1.00 0.00 H new ATOM 0 HG LEU A 74 5.719 2.656 -2.954 1.00 0.00 H new ATOM 0 HD11 LEU A 74 3.452 2.226 -3.789 1.00 0.00 H new ATOM 0 HD12 LEU A 74 4.571 0.978 -3.192 1.00 0.00 H new ATOM 0 HD13 LEU A 74 3.231 1.537 -2.163 1.00 0.00 H new ATOM 0 HD21 LEU A 74 3.345 4.235 -3.127 1.00 0.00 H new ATOM 0 HD22 LEU A 74 3.499 4.320 -1.356 1.00 0.00 H new ATOM 0 HD23 LEU A 74 4.704 5.120 -2.393 1.00 0.00 H new ATOM 1089 N ARG A 75 9.170 3.639 -0.547 1.00 0.00 N ATOM 1090 CA ARG A 75 10.319 3.668 0.351 1.00 0.00 C ATOM 1091 C ARG A 75 10.913 5.084 0.208 1.00 0.00 C ATOM 1092 O ARG A 75 11.497 5.626 1.138 1.00 0.00 O ATOM 1093 CB ARG A 75 11.349 2.582 -0.026 1.00 0.00 C ATOM 1094 CG ARG A 75 10.750 1.169 -0.072 1.00 0.00 C ATOM 1095 CD ARG A 75 10.774 0.383 1.253 1.00 0.00 C ATOM 1096 NE ARG A 75 9.513 -0.326 1.497 1.00 0.00 N ATOM 1097 CZ ARG A 75 8.882 -1.089 0.568 1.00 0.00 C ATOM 1098 NH1 ARG A 75 9.458 -1.404 -0.587 1.00 0.00 N ATOM 1099 NH2 ARG A 75 7.659 -1.546 0.807 1.00 0.00 N ATOM 0 H ARG A 75 9.318 3.115 -1.410 1.00 0.00 H new ATOM 0 HA ARG A 75 10.033 3.457 1.381 1.00 0.00 H new ATOM 0 HB2 ARG A 75 11.778 2.820 -1.000 1.00 0.00 H new ATOM 0 HB3 ARG A 75 12.166 2.600 0.695 1.00 0.00 H new ATOM 0 HG2 ARG A 75 9.716 1.245 -0.408 1.00 0.00 H new ATOM 0 HG3 ARG A 75 11.288 0.592 -0.824 1.00 0.00 H new ATOM 0 HD2 ARG A 75 11.595 -0.334 1.234 1.00 0.00 H new ATOM 0 HD3 ARG A 75 10.969 1.069 2.077 1.00 0.00 H new ATOM 0 HE ARG A 75 9.085 -0.241 2.419 1.00 0.00 H new ATOM 0 HH11 ARG A 75 10.399 -1.071 -0.795 1.00 0.00 H new ATOM 0 HH12 ARG A 75 8.959 -1.979 -1.266 1.00 0.00 H new ATOM 0 HH21 ARG A 75 7.195 -1.324 1.688 1.00 0.00 H new ATOM 0 HH22 ARG A 75 7.184 -2.119 0.110 1.00 0.00 H new ATOM 1113 N GLU A 76 10.708 5.645 -1.013 1.00 0.00 N ATOM 1114 CA GLU A 76 11.163 6.980 -1.348 1.00 0.00 C ATOM 1115 C GLU A 76 10.160 7.982 -0.741 1.00 0.00 C ATOM 1116 O GLU A 76 10.530 9.116 -0.478 1.00 0.00 O ATOM 1117 CB GLU A 76 11.274 7.120 -2.876 1.00 0.00 C ATOM 1118 CG GLU A 76 11.704 8.520 -3.344 1.00 0.00 C ATOM 1119 CD GLU A 76 11.859 8.550 -4.874 1.00 0.00 C ATOM 1120 OE1 GLU A 76 10.856 8.732 -5.564 1.00 0.00 O ATOM 1121 OE2 GLU A 76 12.980 8.393 -5.358 1.00 0.00 O ATOM 0 H GLU A 76 10.223 5.170 -1.775 1.00 0.00 H new ATOM 0 HA GLU A 76 12.153 7.180 -0.939 1.00 0.00 H new ATOM 0 HB2 GLU A 76 11.991 6.388 -3.247 1.00 0.00 H new ATOM 0 HB3 GLU A 76 10.310 6.878 -3.324 1.00 0.00 H new ATOM 0 HG2 GLU A 76 10.964 9.258 -3.033 1.00 0.00 H new ATOM 0 HG3 GLU A 76 12.647 8.795 -2.871 1.00 0.00 H new ATOM 1128 N LYS A 77 8.898 7.526 -0.525 1.00 0.00 N ATOM 1129 CA LYS A 77 7.837 8.342 0.043 1.00 0.00 C ATOM 1130 C LYS A 77 8.064 8.464 1.573 1.00 0.00 C ATOM 1131 O LYS A 77 7.472 9.306 2.236 1.00 0.00 O ATOM 1132 CB LYS A 77 6.475 7.681 -0.258 1.00 0.00 C ATOM 1133 CG LYS A 77 5.251 8.557 0.033 1.00 0.00 C ATOM 1134 CD LYS A 77 3.944 7.761 -0.064 1.00 0.00 C ATOM 1135 CE LYS A 77 2.703 8.634 0.153 1.00 0.00 C ATOM 1136 NZ LYS A 77 1.465 7.863 0.151 1.00 0.00 N ATOM 0 H LYS A 77 8.605 6.575 -0.747 1.00 0.00 H new ATOM 0 HA LYS A 77 7.844 9.340 -0.396 1.00 0.00 H new ATOM 0 HB2 LYS A 77 6.453 7.390 -1.308 1.00 0.00 H new ATOM 0 HB3 LYS A 77 6.395 6.765 0.328 1.00 0.00 H new ATOM 0 HG2 LYS A 77 5.341 8.987 1.030 1.00 0.00 H new ATOM 0 HG3 LYS A 77 5.223 9.388 -0.672 1.00 0.00 H new ATOM 0 HD2 LYS A 77 3.883 7.288 -1.044 1.00 0.00 H new ATOM 0 HD3 LYS A 77 3.955 6.961 0.676 1.00 0.00 H new ATOM 0 HE2 LYS A 77 2.796 9.161 1.102 1.00 0.00 H new ATOM 0 HE3 LYS A 77 2.656 9.392 -0.629 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 0.730 8.386 0.668 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 1.155 7.707 -0.829 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 1.627 6.945 0.613 1.00 0.00 H new ATOM 1149 N CYS A 78 8.933 7.572 2.097 1.00 0.00 N ATOM 1150 CA CYS A 78 9.261 7.513 3.516 1.00 0.00 C ATOM 1151 C CYS A 78 10.446 8.416 3.737 1.00 0.00 C ATOM 1152 O CYS A 78 10.523 9.232 4.649 1.00 0.00 O ATOM 1153 CB CYS A 78 9.477 6.063 3.976 1.00 0.00 C ATOM 1154 SG CYS A 78 8.034 5.033 3.629 1.00 0.00 S ATOM 0 H CYS A 78 9.422 6.875 1.535 1.00 0.00 H new ATOM 0 HA CYS A 78 8.437 7.869 4.135 1.00 0.00 H new ATOM 0 HB2 CYS A 78 10.351 5.648 3.473 1.00 0.00 H new ATOM 0 HB3 CYS A 78 9.687 6.047 5.045 1.00 0.00 H new ATOM 0 HG CYS A 78 7.676 5.191 2.389 1.00 0.00 H new ATOM 1160 N ASP A 79 11.335 8.192 2.774 1.00 0.00 N ATOM 1161 CA ASP A 79 12.585 8.883 2.620 1.00 0.00 C ATOM 1162 C ASP A 79 12.309 10.294 2.074 1.00 0.00 C ATOM 1163 O ASP A 79 13.213 11.103 1.905 1.00 0.00 O ATOM 1164 CB ASP A 79 13.590 8.044 1.806 1.00 0.00 C ATOM 1165 CG ASP A 79 15.009 8.640 1.843 1.00 0.00 C ATOM 1166 OD1 ASP A 79 15.663 8.541 2.881 1.00 0.00 O ATOM 1167 OD2 ASP A 79 15.445 9.195 0.834 1.00 0.00 O ATOM 0 H ASP A 79 11.184 7.488 2.052 1.00 0.00 H new ATOM 0 HA ASP A 79 13.078 9.017 3.583 1.00 0.00 H new ATOM 0 HB2 ASP A 79 13.614 7.028 2.199 1.00 0.00 H new ATOM 0 HB3 ASP A 79 13.252 7.978 0.772 1.00 0.00 H new ATOM 1172 N GLU A 80 11.010 10.537 1.838 1.00 0.00 N ATOM 1173 CA GLU A 80 10.503 11.807 1.375 1.00 0.00 C ATOM 1174 C GLU A 80 10.422 12.658 2.636 1.00 0.00 C ATOM 1175 O GLU A 80 10.957 13.756 2.723 1.00 0.00 O ATOM 1176 CB GLU A 80 9.131 11.710 0.677 1.00 0.00 C ATOM 1177 CG GLU A 80 8.556 13.062 0.223 1.00 0.00 C ATOM 1178 CD GLU A 80 9.451 13.732 -0.832 1.00 0.00 C ATOM 1179 OE1 GLU A 80 9.358 13.363 -2.003 1.00 0.00 O ATOM 1180 OE2 GLU A 80 10.229 14.615 -0.473 1.00 0.00 O ATOM 0 H GLU A 80 10.283 9.834 1.971 1.00 0.00 H new ATOM 0 HA GLU A 80 11.154 12.229 0.609 1.00 0.00 H new ATOM 0 HB2 GLU A 80 9.223 11.058 -0.191 1.00 0.00 H new ATOM 0 HB3 GLU A 80 8.423 11.237 1.357 1.00 0.00 H new ATOM 0 HG2 GLU A 80 7.557 12.914 -0.187 1.00 0.00 H new ATOM 0 HG3 GLU A 80 8.452 13.722 1.085 1.00 0.00 H new ATOM 1187 N ALA A 81 9.699 12.037 3.595 1.00 0.00 N ATOM 1188 CA ALA A 81 9.449 12.605 4.915 1.00 0.00 C ATOM 1189 C ALA A 81 8.683 13.925 4.711 1.00 0.00 C ATOM 1190 O ALA A 81 8.967 14.943 5.331 1.00 0.00 O ATOM 1191 CB ALA A 81 10.754 12.779 5.713 1.00 0.00 C ATOM 0 H ALA A 81 9.274 11.119 3.461 1.00 0.00 H new ATOM 0 HA ALA A 81 8.843 11.930 5.519 1.00 0.00 H new ATOM 0 HB1 ALA A 81 10.529 13.204 6.691 1.00 0.00 H new ATOM 0 HB2 ALA A 81 11.234 11.809 5.841 1.00 0.00 H new ATOM 0 HB3 ALA A 81 11.425 13.447 5.173 1.00 0.00 H new ATOM 1197 N GLY A 82 7.703 13.817 3.792 1.00 0.00 N ATOM 1198 CA GLY A 82 6.832 14.920 3.413 1.00 0.00 C ATOM 1199 C GLY A 82 5.462 14.339 3.064 1.00 0.00 C ATOM 1200 O GLY A 82 4.421 14.806 3.511 1.00 0.00 O ATOM 0 H GLY A 82 7.501 12.950 3.294 1.00 0.00 H new ATOM 0 HA2 GLY A 82 6.746 15.636 4.230 1.00 0.00 H new ATOM 0 HA3 GLY A 82 7.247 15.458 2.560 1.00 0.00 H new ATOM 1204 N LEU A 83 5.559 13.273 2.240 1.00 0.00 N ATOM 1205 CA LEU A 83 4.396 12.528 1.803 1.00 0.00 C ATOM 1206 C LEU A 83 4.227 11.460 2.887 1.00 0.00 C ATOM 1207 O LEU A 83 5.120 10.661 3.141 1.00 0.00 O ATOM 1208 CB LEU A 83 4.662 11.881 0.439 1.00 0.00 C ATOM 1209 CG LEU A 83 4.793 12.898 -0.738 1.00 0.00 C ATOM 1210 CD1 LEU A 83 5.326 12.129 -1.983 1.00 0.00 C ATOM 1211 CD2 LEU A 83 3.961 14.191 -0.845 1.00 0.00 C ATOM 0 H LEU A 83 6.443 12.921 1.872 1.00 0.00 H new ATOM 0 HA LEU A 83 3.508 13.149 1.680 1.00 0.00 H new ATOM 0 HB2 LEU A 83 5.578 11.294 0.501 1.00 0.00 H new ATOM 0 HB3 LEU A 83 3.853 11.186 0.215 1.00 0.00 H new ATOM 0 HG LEU A 83 5.504 13.672 -0.448 1.00 0.00 H new ATOM 0 HD11 LEU A 83 5.427 12.819 -2.821 1.00 0.00 H new ATOM 0 HD12 LEU A 83 6.298 11.693 -1.753 1.00 0.00 H new ATOM 0 HD13 LEU A 83 4.627 11.336 -2.248 1.00 0.00 H new ATOM 0 HD21 LEU A 83 4.237 14.727 -1.753 1.00 0.00 H new ATOM 0 HD22 LEU A 83 2.901 13.940 -0.880 1.00 0.00 H new ATOM 0 HD23 LEU A 83 4.156 14.822 0.022 1.00 0.00 H new ATOM 1223 N LYS A 84 3.030 11.510 3.508 1.00 0.00 N ATOM 1224 CA LYS A 84 2.708 10.580 4.578 1.00 0.00 C ATOM 1225 C LYS A 84 2.292 9.274 3.893 1.00 0.00 C ATOM 1226 O LYS A 84 1.346 9.227 3.119 1.00 0.00 O ATOM 1227 CB LYS A 84 1.634 11.175 5.513 1.00 0.00 C ATOM 1228 CG LYS A 84 0.260 11.442 4.864 1.00 0.00 C ATOM 1229 CD LYS A 84 -0.790 10.370 5.193 1.00 0.00 C ATOM 1230 CE LYS A 84 -1.300 10.453 6.637 1.00 0.00 C ATOM 1231 NZ LYS A 84 -2.417 9.553 6.886 1.00 0.00 N ATOM 0 H LYS A 84 2.291 12.176 3.283 1.00 0.00 H new ATOM 0 HA LYS A 84 3.556 10.383 5.234 1.00 0.00 H new ATOM 0 HB2 LYS A 84 1.493 10.496 6.354 1.00 0.00 H new ATOM 0 HB3 LYS A 84 2.012 12.113 5.921 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -0.107 12.413 5.195 1.00 0.00 H new ATOM 0 HG3 LYS A 84 0.383 11.500 3.782 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -1.633 10.473 4.510 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -0.360 9.383 5.022 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -0.486 10.214 7.321 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -1.607 11.476 6.852 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -2.875 9.809 7.784 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -3.106 9.632 6.111 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -2.069 8.575 6.941 1.00 0.00 H new ATOM 1244 N GLY A 85 3.082 8.231 4.219 1.00 0.00 N ATOM 1245 CA GLY A 85 2.840 6.911 3.659 1.00 0.00 C ATOM 1246 C GLY A 85 4.036 6.001 3.947 1.00 0.00 C ATOM 1247 O GLY A 85 4.855 5.710 3.082 1.00 0.00 O ATOM 0 H GLY A 85 3.876 8.287 4.857 1.00 0.00 H new ATOM 0 HA2 GLY A 85 1.934 6.484 4.089 1.00 0.00 H new ATOM 0 HA3 GLY A 85 2.678 6.986 2.584 1.00 0.00 H new ATOM 1251 N ILE A 86 4.058 5.581 5.230 1.00 0.00 N ATOM 1252 CA ILE A 86 5.089 4.702 5.765 1.00 0.00 C ATOM 1253 C ILE A 86 4.383 3.398 6.154 1.00 0.00 C ATOM 1254 O ILE A 86 4.787 2.712 7.085 1.00 0.00 O ATOM 1255 CB ILE A 86 5.781 5.366 6.992 1.00 0.00 C ATOM 1256 CG1 ILE A 86 7.177 5.996 6.593 1.00 0.00 C ATOM 1257 CG2 ILE A 86 4.677 5.842 8.018 1.00 0.00 C ATOM 1258 CD1 ILE A 86 7.974 6.660 7.738 1.00 0.00 C ATOM 0 H ILE A 86 3.353 5.850 5.917 1.00 0.00 H new ATOM 0 HA ILE A 86 5.874 4.508 5.034 1.00 0.00 H new ATOM 0 HB ILE A 86 6.304 4.819 7.776 1.00 0.00 H new ATOM 0 HG12 ILE A 86 7.795 5.212 6.154 1.00 0.00 H new ATOM 0 HG13 ILE A 86 7.008 6.741 5.816 1.00 0.00 H new ATOM 0 HG21 ILE A 86 5.157 6.308 8.879 1.00 0.00 H new ATOM 0 HG22 ILE A 86 4.019 6.564 7.535 1.00 0.00 H new ATOM 0 HG23 ILE A 86 4.093 4.983 8.349 1.00 0.00 H new ATOM 0 HD11 ILE A 86 8.911 7.056 7.347 1.00 0.00 H new ATOM 0 HD12 ILE A 86 7.387 7.473 8.166 1.00 0.00 H new ATOM 0 HD13 ILE A 86 8.186 5.920 8.510 1.00 0.00 H new ATOM 1270 N LYS A 87 3.307 3.103 5.388 1.00 0.00 N ATOM 1271 CA LYS A 87 2.500 1.924 5.625 1.00 0.00 C ATOM 1272 C LYS A 87 2.115 1.430 4.229 1.00 0.00 C ATOM 1273 O LYS A 87 1.483 2.132 3.450 1.00 0.00 O ATOM 1274 CB LYS A 87 1.236 2.308 6.415 1.00 0.00 C ATOM 1275 CG LYS A 87 1.476 2.987 7.774 1.00 0.00 C ATOM 1276 CD LYS A 87 2.043 2.054 8.851 1.00 0.00 C ATOM 1277 CE LYS A 87 2.430 2.800 10.130 1.00 0.00 C ATOM 1278 NZ LYS A 87 2.906 1.897 11.171 1.00 0.00 N ATOM 0 H LYS A 87 2.993 3.677 4.605 1.00 0.00 H new ATOM 0 HA LYS A 87 3.028 1.165 6.202 1.00 0.00 H new ATOM 0 HB2 LYS A 87 0.634 2.975 5.798 1.00 0.00 H new ATOM 0 HB3 LYS A 87 0.646 1.407 6.580 1.00 0.00 H new ATOM 0 HG2 LYS A 87 2.163 3.822 7.634 1.00 0.00 H new ATOM 0 HG3 LYS A 87 0.534 3.405 8.130 1.00 0.00 H new ATOM 0 HD2 LYS A 87 1.304 1.289 9.090 1.00 0.00 H new ATOM 0 HD3 LYS A 87 2.919 1.539 8.456 1.00 0.00 H new ATOM 0 HE2 LYS A 87 3.206 3.530 9.902 1.00 0.00 H new ATOM 0 HE3 LYS A 87 1.568 3.356 10.499 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 3.157 2.445 12.018 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 2.157 1.216 11.409 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 3.744 1.385 10.830 1.00 0.00 H new ATOM 1291 N LEU A 88 2.562 0.191 3.955 1.00 0.00 N ATOM 1292 CA LEU A 88 2.272 -0.442 2.678 1.00 0.00 C ATOM 1293 C LEU A 88 1.980 -1.895 3.027 1.00 0.00 C ATOM 1294 O LEU A 88 2.876 -2.617 3.445 1.00 0.00 O ATOM 1295 CB LEU A 88 3.465 -0.311 1.716 1.00 0.00 C ATOM 1296 CG LEU A 88 3.922 1.163 1.541 1.00 0.00 C ATOM 1297 CD1 LEU A 88 2.907 1.936 0.647 1.00 0.00 C ATOM 1298 CD2 LEU A 88 5.161 1.703 2.319 1.00 0.00 C ATOM 0 H LEU A 88 3.116 -0.376 4.597 1.00 0.00 H new ATOM 0 HA LEU A 88 1.432 0.023 2.162 1.00 0.00 H new ATOM 0 HB2 LEU A 88 4.298 -0.905 2.091 1.00 0.00 H new ATOM 0 HB3 LEU A 88 3.192 -0.722 0.744 1.00 0.00 H new ATOM 0 HG LEU A 88 4.795 1.778 1.323 1.00 0.00 H new ATOM 0 HD11 LEU A 88 3.237 2.968 0.531 1.00 0.00 H new ATOM 0 HD12 LEU A 88 2.849 1.461 -0.332 1.00 0.00 H new ATOM 0 HD13 LEU A 88 1.923 1.920 1.116 1.00 0.00 H new ATOM 0 HD21 LEU A 88 5.322 2.751 2.065 1.00 0.00 H new ATOM 0 HD22 LEU A 88 4.986 1.612 3.391 1.00 0.00 H new ATOM 0 HD23 LEU A 88 6.043 1.124 2.045 1.00 0.00 H new ATOM 1310 N PHE A 89 0.697 -2.291 2.837 1.00 0.00 N ATOM 1311 CA PHE A 89 0.314 -3.664 3.137 1.00 0.00 C ATOM 1312 C PHE A 89 0.112 -4.263 1.741 1.00 0.00 C ATOM 1313 O PHE A 89 -0.984 -4.363 1.199 1.00 0.00 O ATOM 1314 CB PHE A 89 -0.914 -3.699 4.078 1.00 0.00 C ATOM 1315 CG PHE A 89 -1.083 -4.954 4.910 1.00 0.00 C ATOM 1316 CD1 PHE A 89 -0.146 -5.990 4.936 1.00 0.00 C ATOM 1317 CD2 PHE A 89 -2.232 -5.092 5.683 1.00 0.00 C ATOM 1318 CE1 PHE A 89 -0.354 -7.128 5.702 1.00 0.00 C ATOM 1319 CE2 PHE A 89 -2.434 -6.229 6.453 1.00 0.00 C ATOM 1320 CZ PHE A 89 -1.497 -7.245 6.468 1.00 0.00 C ATOM 0 H PHE A 89 -0.054 -1.694 2.490 1.00 0.00 H new ATOM 0 HA PHE A 89 1.044 -4.247 3.698 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -0.853 -2.846 4.753 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -1.812 -3.564 3.475 1.00 0.00 H new ATOM 0 HD1 PHE A 89 0.757 -5.903 4.349 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -2.974 -4.307 5.684 1.00 0.00 H new ATOM 0 HE1 PHE A 89 0.378 -7.922 5.699 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -3.332 -6.321 7.046 1.00 0.00 H new ATOM 0 HZ PHE A 89 -1.658 -8.124 7.074 1.00 0.00 H new ATOM 1330 N VAL A 90 1.279 -4.678 1.209 1.00 0.00 N ATOM 1331 CA VAL A 90 1.313 -5.200 -0.142 1.00 0.00 C ATOM 1332 C VAL A 90 1.077 -6.714 -0.153 1.00 0.00 C ATOM 1333 O VAL A 90 1.938 -7.553 0.090 1.00 0.00 O ATOM 1334 CB VAL A 90 2.671 -4.801 -0.812 1.00 0.00 C ATOM 1335 CG1 VAL A 90 2.414 -4.557 -2.331 1.00 0.00 C ATOM 1336 CG2 VAL A 90 3.854 -4.138 -0.060 1.00 0.00 C ATOM 0 H VAL A 90 2.178 -4.658 1.690 1.00 0.00 H new ATOM 0 HA VAL A 90 0.503 -4.762 -0.726 1.00 0.00 H new ATOM 0 HB VAL A 90 3.354 -5.636 -0.657 1.00 0.00 H new ATOM 0 HG11 VAL A 90 3.348 -4.277 -2.818 1.00 0.00 H new ATOM 0 HG12 VAL A 90 2.027 -5.469 -2.786 1.00 0.00 H new ATOM 0 HG13 VAL A 90 1.687 -3.754 -2.453 1.00 0.00 H new ATOM 0 HG21 VAL A 90 4.676 -3.965 -0.755 1.00 0.00 H new ATOM 0 HG22 VAL A 90 3.529 -3.187 0.362 1.00 0.00 H new ATOM 0 HG23 VAL A 90 4.190 -4.795 0.742 1.00 0.00 H new ATOM 1346 N GLY A 91 -0.201 -6.981 -0.461 1.00 0.00 N ATOM 1347 CA GLY A 91 -0.632 -8.364 -0.585 1.00 0.00 C ATOM 1348 C GLY A 91 -0.087 -8.977 -1.881 1.00 0.00 C ATOM 1349 O GLY A 91 -0.315 -8.481 -2.977 1.00 0.00 O ATOM 0 H GLY A 91 -0.924 -6.280 -0.622 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -0.283 -8.939 0.272 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -1.721 -8.415 -0.580 1.00 0.00 H new ATOM 1353 N GLY A 92 0.656 -10.084 -1.654 1.00 0.00 N ATOM 1354 CA GLY A 92 1.313 -10.806 -2.732 1.00 0.00 C ATOM 1355 C GLY A 92 2.693 -10.167 -2.916 1.00 0.00 C ATOM 1356 O GLY A 92 3.635 -10.452 -2.187 1.00 0.00 O ATOM 0 H GLY A 92 0.807 -10.485 -0.728 1.00 0.00 H new ATOM 0 HA2 GLY A 92 1.406 -11.864 -2.488 1.00 0.00 H new ATOM 0 HA3 GLY A 92 0.731 -10.741 -3.651 1.00 0.00 H new ATOM 1360 N ASN A 93 2.719 -9.277 -3.933 1.00 0.00 N ATOM 1361 CA ASN A 93 3.873 -8.481 -4.319 1.00 0.00 C ATOM 1362 C ASN A 93 4.963 -9.451 -4.819 1.00 0.00 C ATOM 1363 O ASN A 93 4.972 -9.877 -5.966 1.00 0.00 O ATOM 1364 CB ASN A 93 4.256 -7.533 -3.153 1.00 0.00 C ATOM 1365 CG ASN A 93 5.155 -6.374 -3.606 1.00 0.00 C ATOM 1366 OD1 ASN A 93 4.933 -5.759 -4.641 1.00 0.00 O ATOM 1367 ND2 ASN A 93 6.164 -6.109 -2.757 1.00 0.00 N ATOM 0 H ASN A 93 1.903 -9.098 -4.518 1.00 0.00 H new ATOM 0 HA ASN A 93 3.681 -7.803 -5.151 1.00 0.00 H new ATOM 0 HB2 ASN A 93 3.348 -7.130 -2.704 1.00 0.00 H new ATOM 0 HB3 ASN A 93 4.768 -8.104 -2.379 1.00 0.00 H new ATOM 0 HD21 ASN A 93 6.812 -5.347 -2.957 1.00 0.00 H new ATOM 0 HD22 ASN A 93 6.281 -6.670 -1.913 1.00 0.00 H new ATOM 1374 N ILE A 94 5.882 -9.764 -3.886 1.00 0.00 N ATOM 1375 CA ILE A 94 6.992 -10.664 -4.140 1.00 0.00 C ATOM 1376 C ILE A 94 6.438 -12.072 -3.900 1.00 0.00 C ATOM 1377 O ILE A 94 6.107 -12.473 -2.791 1.00 0.00 O ATOM 1378 CB ILE A 94 8.238 -10.290 -3.281 1.00 0.00 C ATOM 1379 CG1 ILE A 94 8.012 -9.193 -2.171 1.00 0.00 C ATOM 1380 CG2 ILE A 94 9.377 -11.341 -3.509 1.00 0.00 C ATOM 1381 CD1 ILE A 94 7.000 -9.427 -1.018 1.00 0.00 C ATOM 0 H ILE A 94 5.864 -9.392 -2.936 1.00 0.00 H new ATOM 0 HA ILE A 94 7.370 -10.596 -5.160 1.00 0.00 H new ATOM 0 HB ILE A 94 9.009 -9.520 -3.307 1.00 0.00 H new ATOM 0 HG12 ILE A 94 8.981 -8.997 -1.712 1.00 0.00 H new ATOM 0 HG13 ILE A 94 7.710 -8.278 -2.681 1.00 0.00 H new ATOM 0 HG21 ILE A 94 10.245 -11.074 -2.906 1.00 0.00 H new ATOM 0 HG22 ILE A 94 9.023 -12.330 -3.218 1.00 0.00 H new ATOM 0 HG23 ILE A 94 9.657 -11.352 -4.562 1.00 0.00 H new ATOM 0 HD11 ILE A 94 6.990 -8.558 -0.360 1.00 0.00 H new ATOM 0 HD12 ILE A 94 6.004 -9.579 -1.433 1.00 0.00 H new ATOM 0 HD13 ILE A 94 7.294 -10.309 -0.449 1.00 0.00 H new ATOM 1393 N VAL A 95 6.369 -12.770 -5.054 1.00 0.00 N ATOM 1394 CA VAL A 95 5.878 -14.135 -5.159 1.00 0.00 C ATOM 1395 C VAL A 95 6.996 -15.084 -4.707 1.00 0.00 C ATOM 1396 O VAL A 95 8.144 -14.690 -4.532 1.00 0.00 O ATOM 1397 CB VAL A 95 5.476 -14.395 -6.651 1.00 0.00 C ATOM 1398 CG1 VAL A 95 4.391 -15.510 -6.757 1.00 0.00 C ATOM 1399 CG2 VAL A 95 5.944 -13.466 -7.813 1.00 0.00 C ATOM 0 H VAL A 95 6.662 -12.380 -5.950 1.00 0.00 H new ATOM 0 HA VAL A 95 5.005 -14.301 -4.528 1.00 0.00 H new ATOM 0 HB VAL A 95 6.226 -14.646 -7.401 1.00 0.00 H new ATOM 0 HG11 VAL A 95 4.133 -15.668 -7.804 1.00 0.00 H new ATOM 0 HG12 VAL A 95 4.780 -16.437 -6.335 1.00 0.00 H new ATOM 0 HG13 VAL A 95 3.501 -15.206 -6.206 1.00 0.00 H new ATOM 0 HG21 VAL A 95 5.547 -13.837 -8.758 1.00 0.00 H new ATOM 0 HG22 VAL A 95 5.579 -12.454 -7.639 1.00 0.00 H new ATOM 0 HG23 VAL A 95 7.033 -13.457 -7.856 1.00 0.00 H new ATOM 1409 N VAL A 96 6.561 -16.356 -4.533 1.00 0.00 N ATOM 1410 CA VAL A 96 7.373 -17.495 -4.119 1.00 0.00 C ATOM 1411 C VAL A 96 8.382 -17.128 -3.020 1.00 0.00 C ATOM 1412 O VAL A 96 9.588 -17.303 -3.151 1.00 0.00 O ATOM 1413 CB VAL A 96 8.010 -18.205 -5.359 1.00 0.00 C ATOM 1414 CG1 VAL A 96 8.870 -17.221 -6.215 1.00 0.00 C ATOM 1415 CG2 VAL A 96 8.061 -19.745 -5.587 1.00 0.00 C ATOM 0 H VAL A 96 5.586 -16.613 -4.688 1.00 0.00 H new ATOM 0 HA VAL A 96 6.716 -18.228 -3.651 1.00 0.00 H new ATOM 0 HB VAL A 96 7.149 -18.670 -5.840 1.00 0.00 H new ATOM 0 HG11 VAL A 96 9.294 -17.754 -7.066 1.00 0.00 H new ATOM 0 HG12 VAL A 96 8.241 -16.406 -6.574 1.00 0.00 H new ATOM 0 HG13 VAL A 96 9.676 -16.815 -5.603 1.00 0.00 H new ATOM 0 HG21 VAL A 96 8.562 -19.957 -6.532 1.00 0.00 H new ATOM 0 HG22 VAL A 96 8.611 -20.216 -4.772 1.00 0.00 H new ATOM 0 HG23 VAL A 96 7.046 -20.142 -5.617 1.00 0.00 H new ATOM 1425 N GLY A 97 7.781 -16.612 -1.930 1.00 0.00 N ATOM 1426 CA GLY A 97 8.562 -16.197 -0.779 1.00 0.00 C ATOM 1427 C GLY A 97 7.622 -15.812 0.364 1.00 0.00 C ATOM 1428 O GLY A 97 6.494 -15.380 0.155 1.00 0.00 O ATOM 0 H GLY A 97 6.774 -16.480 -1.835 1.00 0.00 H new ATOM 0 HA2 GLY A 97 9.223 -17.005 -0.464 1.00 0.00 H new ATOM 0 HA3 GLY A 97 9.196 -15.351 -1.043 1.00 0.00 H new ATOM 1432 N LYS A 98 8.176 -16.012 1.577 1.00 0.00 N ATOM 1433 CA LYS A 98 7.472 -15.709 2.810 1.00 0.00 C ATOM 1434 C LYS A 98 8.515 -15.929 3.903 1.00 0.00 C ATOM 1435 O LYS A 98 9.207 -16.939 3.924 1.00 0.00 O ATOM 1436 CB LYS A 98 6.221 -16.588 3.005 1.00 0.00 C ATOM 1437 CG LYS A 98 5.520 -16.341 4.350 1.00 0.00 C ATOM 1438 CD LYS A 98 4.059 -16.810 4.365 1.00 0.00 C ATOM 1439 CE LYS A 98 3.872 -18.283 3.986 1.00 0.00 C ATOM 1440 NZ LYS A 98 4.538 -19.197 4.905 1.00 0.00 N ATOM 0 H LYS A 98 9.115 -16.385 1.714 1.00 0.00 H new ATOM 0 HA LYS A 98 7.079 -14.692 2.818 1.00 0.00 H new ATOM 0 HB2 LYS A 98 5.518 -16.396 2.194 1.00 0.00 H new ATOM 0 HB3 LYS A 98 6.507 -17.638 2.937 1.00 0.00 H new ATOM 0 HG2 LYS A 98 6.068 -16.857 5.138 1.00 0.00 H new ATOM 0 HG3 LYS A 98 5.556 -15.276 4.581 1.00 0.00 H new ATOM 0 HD2 LYS A 98 3.646 -16.647 5.360 1.00 0.00 H new ATOM 0 HD3 LYS A 98 3.483 -16.192 3.676 1.00 0.00 H new ATOM 0 HE2 LYS A 98 2.807 -18.514 3.961 1.00 0.00 H new ATOM 0 HE3 LYS A 98 4.257 -18.445 2.979 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 4.376 -20.177 4.598 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 5.559 -19.000 4.911 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 4.155 -19.067 5.863 1.00 0.00 H new ATOM 1453 N GLN A 99 8.572 -14.903 4.787 1.00 0.00 N ATOM 1454 CA GLN A 99 9.472 -14.823 5.933 1.00 0.00 C ATOM 1455 C GLN A 99 10.758 -14.180 5.401 1.00 0.00 C ATOM 1456 O GLN A 99 11.076 -13.036 5.705 1.00 0.00 O ATOM 1457 CB GLN A 99 9.679 -16.170 6.672 1.00 0.00 C ATOM 1458 CG GLN A 99 10.399 -16.044 8.027 1.00 0.00 C ATOM 1459 CD GLN A 99 11.893 -15.719 7.868 1.00 0.00 C ATOM 1460 OE1 GLN A 99 12.351 -14.627 8.179 1.00 0.00 O ATOM 1461 NE2 GLN A 99 12.612 -16.740 7.366 1.00 0.00 N ATOM 0 H GLN A 99 7.966 -14.087 4.707 1.00 0.00 H new ATOM 0 HA GLN A 99 9.041 -14.213 6.727 1.00 0.00 H new ATOM 0 HB2 GLN A 99 8.707 -16.637 6.832 1.00 0.00 H new ATOM 0 HB3 GLN A 99 10.252 -16.839 6.030 1.00 0.00 H new ATOM 0 HG2 GLN A 99 9.921 -15.263 8.618 1.00 0.00 H new ATOM 0 HG3 GLN A 99 10.290 -16.976 8.582 1.00 0.00 H new ATOM 0 HE21 GLN A 99 12.153 -17.620 7.132 1.00 0.00 H new ATOM 0 HE22 GLN A 99 13.616 -16.633 7.220 1.00 0.00 H new ATOM 1470 N ASN A 100 11.471 -14.998 4.600 1.00 0.00 N ATOM 1471 CA ASN A 100 12.721 -14.601 3.981 1.00 0.00 C ATOM 1472 C ASN A 100 12.315 -14.053 2.614 1.00 0.00 C ATOM 1473 O ASN A 100 11.367 -14.524 1.995 1.00 0.00 O ATOM 1474 CB ASN A 100 13.682 -15.803 3.883 1.00 0.00 C ATOM 1475 CG ASN A 100 13.041 -17.020 3.188 1.00 0.00 C ATOM 1476 OD1 ASN A 100 12.357 -17.826 3.807 1.00 0.00 O ATOM 1477 ND2 ASN A 100 13.313 -17.093 1.872 1.00 0.00 N ATOM 0 H ASN A 100 11.183 -15.950 4.373 1.00 0.00 H new ATOM 0 HA ASN A 100 13.266 -13.851 4.555 1.00 0.00 H new ATOM 0 HB2 ASN A 100 14.576 -15.505 3.334 1.00 0.00 H new ATOM 0 HB3 ASN A 100 14.003 -16.089 4.885 1.00 0.00 H new ATOM 0 HD21 ASN A 100 12.939 -17.862 1.316 1.00 0.00 H new ATOM 0 HD22 ASN A 100 13.893 -16.379 1.431 1.00 0.00 H new ATOM 1484 N TRP A 101 13.087 -13.024 2.201 1.00 0.00 N ATOM 1485 CA TRP A 101 12.841 -12.371 0.926 1.00 0.00 C ATOM 1486 C TRP A 101 14.199 -12.345 0.216 1.00 0.00 C ATOM 1487 O TRP A 101 15.235 -12.474 0.858 1.00 0.00 O ATOM 1488 CB TRP A 101 12.302 -10.946 1.153 1.00 0.00 C ATOM 1489 CG TRP A 101 11.009 -11.023 1.931 1.00 0.00 C ATOM 1490 CD1 TRP A 101 10.809 -10.613 3.252 1.00 0.00 C ATOM 1491 CD2 TRP A 101 9.752 -11.555 1.470 1.00 0.00 C ATOM 1492 NE1 TRP A 101 9.526 -10.864 3.607 1.00 0.00 N ATOM 1493 CE2 TRP A 101 8.841 -11.442 2.545 1.00 0.00 C ATOM 1494 CE3 TRP A 101 9.351 -12.096 0.278 1.00 0.00 C ATOM 1495 CZ2 TRP A 101 7.553 -11.875 2.393 1.00 0.00 C ATOM 1496 CZ3 TRP A 101 8.039 -12.539 0.122 1.00 0.00 C ATOM 1497 CH2 TRP A 101 7.138 -12.427 1.180 1.00 0.00 C ATOM 0 H TRP A 101 13.870 -12.643 2.732 1.00 0.00 H new ATOM 0 HA TRP A 101 12.093 -12.894 0.330 1.00 0.00 H new ATOM 0 HB2 TRP A 101 13.034 -10.350 1.698 1.00 0.00 H new ATOM 0 HB3 TRP A 101 12.136 -10.450 0.197 1.00 0.00 H new ATOM 0 HD1 TRP A 101 11.558 -10.167 3.889 1.00 0.00 H new ATOM 0 HE1 TRP A 101 9.122 -10.659 4.521 1.00 0.00 H new ATOM 0 HE3 TRP A 101 10.051 -12.179 -0.540 1.00 0.00 H new ATOM 0 HZ2 TRP A 101 6.855 -11.790 3.213 1.00 0.00 H new ATOM 0 HZ3 TRP A 101 7.721 -12.968 -0.817 1.00 0.00 H new ATOM 0 HH2 TRP A 101 6.120 -12.767 1.061 1.00 0.00 H new ATOM 1508 N PRO A 102 14.175 -12.169 -1.144 1.00 0.00 N ATOM 1509 CA PRO A 102 15.407 -12.115 -1.930 1.00 0.00 C ATOM 1510 C PRO A 102 16.129 -10.785 -1.599 1.00 0.00 C ATOM 1511 O PRO A 102 15.988 -10.216 -0.523 1.00 0.00 O ATOM 1512 CB PRO A 102 14.938 -12.220 -3.406 1.00 0.00 C ATOM 1513 CG PRO A 102 13.450 -12.570 -3.363 1.00 0.00 C ATOM 1514 CD PRO A 102 12.965 -12.168 -1.971 1.00 0.00 C ATOM 0 HA PRO A 102 16.122 -12.910 -1.719 1.00 0.00 H new ATOM 0 HB2 PRO A 102 15.101 -11.280 -3.933 1.00 0.00 H new ATOM 0 HB3 PRO A 102 15.502 -12.986 -3.939 1.00 0.00 H new ATOM 0 HG2 PRO A 102 12.900 -12.035 -4.138 1.00 0.00 H new ATOM 0 HG3 PRO A 102 13.294 -13.634 -3.539 1.00 0.00 H new ATOM 0 HD2 PRO A 102 12.494 -11.185 -1.984 1.00 0.00 H new ATOM 0 HD3 PRO A 102 12.224 -12.871 -1.591 1.00 0.00 H new ATOM 1522 N ASP A 103 16.878 -10.310 -2.619 1.00 0.00 N ATOM 1523 CA ASP A 103 17.655 -9.082 -2.532 1.00 0.00 C ATOM 1524 C ASP A 103 16.681 -7.893 -2.518 1.00 0.00 C ATOM 1525 O ASP A 103 16.992 -6.837 -1.975 1.00 0.00 O ATOM 1526 CB ASP A 103 18.667 -8.998 -3.695 1.00 0.00 C ATOM 1527 CG ASP A 103 17.987 -9.046 -5.081 1.00 0.00 C ATOM 1528 OD1 ASP A 103 17.798 -10.142 -5.610 1.00 0.00 O ATOM 1529 OD2 ASP A 103 17.658 -7.987 -5.615 1.00 0.00 O ATOM 0 H ASP A 103 16.952 -10.778 -3.522 1.00 0.00 H new ATOM 0 HA ASP A 103 18.240 -9.064 -1.613 1.00 0.00 H new ATOM 0 HB2 ASP A 103 19.239 -8.074 -3.607 1.00 0.00 H new ATOM 0 HB3 ASP A 103 19.376 -9.822 -3.614 1.00 0.00 H new ATOM 1534 N VAL A 104 15.493 -8.130 -3.133 1.00 0.00 N ATOM 1535 CA VAL A 104 14.445 -7.123 -3.231 1.00 0.00 C ATOM 1536 C VAL A 104 14.121 -6.553 -1.844 1.00 0.00 C ATOM 1537 O VAL A 104 14.501 -5.422 -1.566 1.00 0.00 O ATOM 1538 CB VAL A 104 13.228 -7.608 -4.080 1.00 0.00 C ATOM 1539 CG1 VAL A 104 13.433 -6.990 -5.526 1.00 0.00 C ATOM 1540 CG2 VAL A 104 12.755 -9.025 -3.553 1.00 0.00 C ATOM 0 H VAL A 104 15.252 -9.022 -3.566 1.00 0.00 H new ATOM 0 HA VAL A 104 14.811 -6.273 -3.807 1.00 0.00 H new ATOM 0 HB VAL A 104 12.191 -7.278 -4.020 1.00 0.00 H new ATOM 0 HG11 VAL A 104 12.609 -7.294 -6.172 1.00 0.00 H new ATOM 0 HG12 VAL A 104 13.457 -5.902 -5.457 1.00 0.00 H new ATOM 0 HG13 VAL A 104 14.374 -7.348 -5.945 1.00 0.00 H new ATOM 0 HG21 VAL A 104 11.905 -9.368 -4.143 1.00 0.00 H new ATOM 0 HG22 VAL A 104 13.573 -9.739 -3.646 1.00 0.00 H new ATOM 0 HG23 VAL A 104 12.461 -8.944 -2.506 1.00 0.00 H new ATOM 1550 N GLU A 105 13.445 -7.351 -0.979 1.00 0.00 N ATOM 1551 CA GLU A 105 13.133 -6.816 0.332 1.00 0.00 C ATOM 1552 C GLU A 105 14.264 -7.144 1.302 1.00 0.00 C ATOM 1553 O GLU A 105 14.036 -7.206 2.501 1.00 0.00 O ATOM 1554 CB GLU A 105 11.752 -7.189 0.874 1.00 0.00 C ATOM 1555 CG GLU A 105 10.636 -7.066 -0.173 1.00 0.00 C ATOM 1556 CD GLU A 105 9.253 -7.207 0.485 1.00 0.00 C ATOM 1557 OE1 GLU A 105 8.967 -8.273 1.024 1.00 0.00 O ATOM 1558 OE2 GLU A 105 8.477 -6.251 0.453 1.00 0.00 O ATOM 0 H GLU A 105 13.131 -8.304 -1.164 1.00 0.00 H new ATOM 0 HA GLU A 105 13.063 -5.734 0.220 1.00 0.00 H new ATOM 0 HB2 GLU A 105 11.780 -8.213 1.247 1.00 0.00 H new ATOM 0 HB3 GLU A 105 11.517 -6.547 1.723 1.00 0.00 H new ATOM 0 HG2 GLU A 105 10.708 -6.102 -0.676 1.00 0.00 H new ATOM 0 HG3 GLU A 105 10.761 -7.834 -0.936 1.00 0.00 H new ATOM 1565 N GLN A 106 15.495 -7.360 0.785 1.00 0.00 N ATOM 1566 CA GLN A 106 16.585 -7.573 1.730 1.00 0.00 C ATOM 1567 C GLN A 106 16.759 -6.194 2.395 1.00 0.00 C ATOM 1568 O GLN A 106 16.794 -6.053 3.611 1.00 0.00 O ATOM 1569 CB GLN A 106 17.875 -8.016 1.019 1.00 0.00 C ATOM 1570 CG GLN A 106 19.071 -8.168 1.973 1.00 0.00 C ATOM 1571 CD GLN A 106 20.325 -8.652 1.231 1.00 0.00 C ATOM 1572 OE1 GLN A 106 20.312 -8.923 0.036 1.00 0.00 O ATOM 1573 NE2 GLN A 106 21.406 -8.739 2.027 1.00 0.00 N ATOM 0 H GLN A 106 15.737 -7.389 -0.205 1.00 0.00 H new ATOM 0 HA GLN A 106 16.370 -8.367 2.445 1.00 0.00 H new ATOM 0 HB2 GLN A 106 17.697 -8.966 0.516 1.00 0.00 H new ATOM 0 HB3 GLN A 106 18.125 -7.288 0.247 1.00 0.00 H new ATOM 0 HG2 GLN A 106 19.278 -7.212 2.454 1.00 0.00 H new ATOM 0 HG3 GLN A 106 18.819 -8.875 2.764 1.00 0.00 H new ATOM 0 HE21 GLN A 106 21.333 -8.494 3.015 1.00 0.00 H new ATOM 0 HE22 GLN A 106 22.298 -9.050 1.643 1.00 0.00 H new ATOM 1582 N ARG A 107 16.803 -5.202 1.478 1.00 0.00 N ATOM 1583 CA ARG A 107 16.962 -3.810 1.838 1.00 0.00 C ATOM 1584 C ARG A 107 15.573 -3.164 2.050 1.00 0.00 C ATOM 1585 O ARG A 107 15.513 -2.134 2.709 1.00 0.00 O ATOM 1586 CB ARG A 107 17.781 -3.077 0.757 1.00 0.00 C ATOM 1587 CG ARG A 107 17.287 -3.349 -0.675 1.00 0.00 C ATOM 1588 CD ARG A 107 17.877 -2.393 -1.716 1.00 0.00 C ATOM 1589 NE ARG A 107 17.428 -1.030 -1.452 1.00 0.00 N ATOM 1590 CZ ARG A 107 17.553 -0.033 -2.358 1.00 0.00 C ATOM 1591 NH1 ARG A 107 18.120 -0.243 -3.544 1.00 0.00 N ATOM 1592 NH2 ARG A 107 17.098 1.179 -2.057 1.00 0.00 N ATOM 0 H ARG A 107 16.728 -5.363 0.474 1.00 0.00 H new ATOM 0 HA ARG A 107 17.512 -3.730 2.776 1.00 0.00 H new ATOM 0 HB2 ARG A 107 17.744 -2.005 0.949 1.00 0.00 H new ATOM 0 HB3 ARG A 107 18.825 -3.379 0.836 1.00 0.00 H new ATOM 0 HG2 ARG A 107 17.539 -4.373 -0.950 1.00 0.00 H new ATOM 0 HG3 ARG A 107 16.200 -3.272 -0.697 1.00 0.00 H new ATOM 0 HD2 ARG A 107 18.966 -2.438 -1.688 1.00 0.00 H new ATOM 0 HD3 ARG A 107 17.571 -2.698 -2.717 1.00 0.00 H new ATOM 0 HE ARG A 107 17.003 -0.821 -0.549 1.00 0.00 H new ATOM 0 HH11 ARG A 107 18.471 -1.170 -3.785 1.00 0.00 H new ATOM 0 HH12 ARG A 107 18.204 0.523 -4.212 1.00 0.00 H new ATOM 0 HH21 ARG A 107 16.661 1.349 -1.151 1.00 0.00 H new ATOM 0 HH22 ARG A 107 17.186 1.939 -2.732 1.00 0.00 H new ATOM 1606 N PHE A 108 14.468 -3.753 1.508 1.00 0.00 N ATOM 1607 CA PHE A 108 13.166 -3.089 1.700 1.00 0.00 C ATOM 1608 C PHE A 108 12.596 -3.502 3.054 1.00 0.00 C ATOM 1609 O PHE A 108 12.120 -2.667 3.813 1.00 0.00 O ATOM 1610 CB PHE A 108 12.124 -3.291 0.573 1.00 0.00 C ATOM 1611 CG PHE A 108 12.632 -3.055 -0.832 1.00 0.00 C ATOM 1612 CD1 PHE A 108 13.730 -2.238 -1.096 1.00 0.00 C ATOM 1613 CD2 PHE A 108 11.998 -3.677 -1.907 1.00 0.00 C ATOM 1614 CE1 PHE A 108 14.200 -2.082 -2.392 1.00 0.00 C ATOM 1615 CE2 PHE A 108 12.464 -3.513 -3.204 1.00 0.00 C ATOM 1616 CZ PHE A 108 13.572 -2.723 -3.446 1.00 0.00 C ATOM 0 H PHE A 108 14.455 -4.622 0.974 1.00 0.00 H new ATOM 0 HA PHE A 108 13.371 -2.019 1.664 1.00 0.00 H new ATOM 0 HB2 PHE A 108 11.739 -4.309 0.636 1.00 0.00 H new ATOM 0 HB3 PHE A 108 11.284 -2.621 0.754 1.00 0.00 H new ATOM 0 HD1 PHE A 108 14.220 -1.721 -0.284 1.00 0.00 H new ATOM 0 HD2 PHE A 108 11.131 -4.296 -1.728 1.00 0.00 H new ATOM 0 HE1 PHE A 108 15.061 -1.457 -2.580 1.00 0.00 H new ATOM 0 HE2 PHE A 108 11.961 -4.003 -4.024 1.00 0.00 H new ATOM 0 HZ PHE A 108 13.946 -2.606 -4.452 1.00 0.00 H new ATOM 1626 N LYS A 109 12.671 -4.824 3.309 1.00 0.00 N ATOM 1627 CA LYS A 109 12.169 -5.377 4.567 1.00 0.00 C ATOM 1628 C LYS A 109 13.233 -5.145 5.654 1.00 0.00 C ATOM 1629 O LYS A 109 13.006 -5.511 6.801 1.00 0.00 O ATOM 1630 CB LYS A 109 11.672 -6.840 4.523 1.00 0.00 C ATOM 1631 CG LYS A 109 10.300 -7.008 3.844 1.00 0.00 C ATOM 1632 CD LYS A 109 9.150 -7.269 4.824 1.00 0.00 C ATOM 1633 CE LYS A 109 7.839 -7.591 4.098 1.00 0.00 C ATOM 1634 NZ LYS A 109 6.764 -7.943 5.014 1.00 0.00 N ATOM 0 H LYS A 109 13.068 -5.512 2.669 1.00 0.00 H new ATOM 0 HA LYS A 109 11.250 -4.839 4.801 1.00 0.00 H new ATOM 0 HB2 LYS A 109 12.406 -7.448 3.994 1.00 0.00 H new ATOM 0 HB3 LYS A 109 11.613 -7.225 5.541 1.00 0.00 H new ATOM 0 HG2 LYS A 109 10.078 -6.109 3.269 1.00 0.00 H new ATOM 0 HG3 LYS A 109 10.355 -7.834 3.135 1.00 0.00 H new ATOM 0 HD2 LYS A 109 9.414 -8.098 5.480 1.00 0.00 H new ATOM 0 HD3 LYS A 109 9.008 -6.394 5.458 1.00 0.00 H new ATOM 0 HE2 LYS A 109 7.537 -6.730 3.503 1.00 0.00 H new ATOM 0 HE3 LYS A 109 8.005 -8.415 3.404 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 5.851 -7.870 4.522 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 6.899 -8.918 5.350 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 6.773 -7.293 5.826 1.00 0.00 H new ATOM 1647 N ALA A 110 14.385 -4.514 5.278 1.00 0.00 N ATOM 1648 CA ALA A 110 15.402 -4.171 6.271 1.00 0.00 C ATOM 1649 C ALA A 110 14.701 -3.205 7.248 1.00 0.00 C ATOM 1650 O ALA A 110 14.925 -3.233 8.452 1.00 0.00 O ATOM 1651 CB ALA A 110 16.616 -3.478 5.635 1.00 0.00 C ATOM 0 H ALA A 110 14.612 -4.247 4.320 1.00 0.00 H new ATOM 0 HA ALA A 110 15.784 -5.067 6.760 1.00 0.00 H new ATOM 0 HB1 ALA A 110 17.346 -3.241 6.409 1.00 0.00 H new ATOM 0 HB2 ALA A 110 17.070 -4.142 4.899 1.00 0.00 H new ATOM 0 HB3 ALA A 110 16.295 -2.559 5.145 1.00 0.00 H new ATOM 1657 N MET A 111 13.825 -2.372 6.630 1.00 0.00 N ATOM 1658 CA MET A 111 13.012 -1.427 7.366 1.00 0.00 C ATOM 1659 C MET A 111 11.752 -2.221 7.744 1.00 0.00 C ATOM 1660 O MET A 111 11.352 -2.240 8.902 1.00 0.00 O ATOM 1661 CB MET A 111 12.657 -0.184 6.533 1.00 0.00 C ATOM 1662 CG MET A 111 13.874 0.633 6.084 1.00 0.00 C ATOM 1663 SD MET A 111 14.743 -0.126 4.701 1.00 0.00 S ATOM 1664 CE MET A 111 13.634 0.370 3.369 1.00 0.00 C ATOM 0 H MET A 111 13.679 -2.352 5.621 1.00 0.00 H new ATOM 0 HA MET A 111 13.541 -1.036 8.235 1.00 0.00 H new ATOM 0 HB2 MET A 111 12.097 -0.497 5.652 1.00 0.00 H new ATOM 0 HB3 MET A 111 11.998 0.457 7.118 1.00 0.00 H new ATOM 0 HG2 MET A 111 13.550 1.634 5.800 1.00 0.00 H new ATOM 0 HG3 MET A 111 14.561 0.746 6.923 1.00 0.00 H new ATOM 0 HE1 MET A 111 14.118 0.194 2.408 1.00 0.00 H new ATOM 0 HE2 MET A 111 12.715 -0.213 3.425 1.00 0.00 H new ATOM 0 HE3 MET A 111 13.398 1.430 3.468 1.00 0.00 H new ATOM 1674 N GLY A 112 11.151 -2.871 6.708 1.00 0.00 N ATOM 1675 CA GLY A 112 9.958 -3.681 6.910 1.00 0.00 C ATOM 1676 C GLY A 112 8.784 -3.000 7.633 1.00 0.00 C ATOM 1677 O GLY A 112 8.081 -3.634 8.411 1.00 0.00 O ATOM 0 H GLY A 112 11.483 -2.839 5.744 1.00 0.00 H new ATOM 0 HA2 GLY A 112 9.608 -4.022 5.936 1.00 0.00 H new ATOM 0 HA3 GLY A 112 10.240 -4.569 7.476 1.00 0.00 H new ATOM 1681 N PHE A 113 8.603 -1.690 7.329 1.00 0.00 N ATOM 1682 CA PHE A 113 7.473 -0.955 7.900 1.00 0.00 C ATOM 1683 C PHE A 113 6.223 -1.338 7.069 1.00 0.00 C ATOM 1684 O PHE A 113 5.099 -0.980 7.400 1.00 0.00 O ATOM 1685 CB PHE A 113 7.710 0.572 7.931 1.00 0.00 C ATOM 1686 CG PHE A 113 8.362 1.136 6.690 1.00 0.00 C ATOM 1687 CD1 PHE A 113 7.730 1.106 5.448 1.00 0.00 C ATOM 1688 CD2 PHE A 113 9.627 1.710 6.781 1.00 0.00 C ATOM 1689 CE1 PHE A 113 8.359 1.628 4.324 1.00 0.00 C ATOM 1690 CE2 PHE A 113 10.254 2.236 5.660 1.00 0.00 C ATOM 1691 CZ PHE A 113 9.620 2.194 4.430 1.00 0.00 C ATOM 0 H PHE A 113 9.208 -1.147 6.713 1.00 0.00 H new ATOM 0 HA PHE A 113 7.337 -1.230 8.946 1.00 0.00 H new ATOM 0 HB2 PHE A 113 6.753 1.071 8.081 1.00 0.00 H new ATOM 0 HB3 PHE A 113 8.333 0.812 8.793 1.00 0.00 H new ATOM 0 HD1 PHE A 113 6.744 0.674 5.358 1.00 0.00 H new ATOM 0 HD2 PHE A 113 10.128 1.747 7.737 1.00 0.00 H new ATOM 0 HE1 PHE A 113 7.864 1.593 3.365 1.00 0.00 H new ATOM 0 HE2 PHE A 113 11.236 2.678 5.747 1.00 0.00 H new ATOM 0 HZ PHE A 113 10.106 2.601 3.556 1.00 0.00 H new ATOM 1701 N ASP A 114 6.509 -2.085 5.981 1.00 0.00 N ATOM 1702 CA ASP A 114 5.566 -2.598 5.024 1.00 0.00 C ATOM 1703 C ASP A 114 5.453 -4.091 5.348 1.00 0.00 C ATOM 1704 O ASP A 114 6.450 -4.776 5.547 1.00 0.00 O ATOM 1705 CB ASP A 114 6.134 -2.377 3.605 1.00 0.00 C ATOM 1706 CG ASP A 114 7.545 -2.996 3.418 1.00 0.00 C ATOM 1707 OD1 ASP A 114 8.530 -2.360 3.795 1.00 0.00 O ATOM 1708 OD2 ASP A 114 7.639 -4.104 2.889 1.00 0.00 O ATOM 0 H ASP A 114 7.468 -2.349 5.754 1.00 0.00 H new ATOM 0 HA ASP A 114 4.592 -2.111 5.067 1.00 0.00 H new ATOM 0 HB2 ASP A 114 5.452 -2.811 2.874 1.00 0.00 H new ATOM 0 HB3 ASP A 114 6.182 -1.307 3.400 1.00 0.00 H new ATOM 1713 N ARG A 115 4.185 -4.540 5.407 1.00 0.00 N ATOM 1714 CA ARG A 115 3.885 -5.937 5.654 1.00 0.00 C ATOM 1715 C ARG A 115 3.342 -6.401 4.308 1.00 0.00 C ATOM 1716 O ARG A 115 3.099 -5.605 3.410 1.00 0.00 O ATOM 1717 CB ARG A 115 2.886 -6.156 6.809 1.00 0.00 C ATOM 1718 CG ARG A 115 2.031 -4.935 7.163 1.00 0.00 C ATOM 1719 CD ARG A 115 2.754 -3.990 8.133 1.00 0.00 C ATOM 1720 NE ARG A 115 1.896 -2.869 8.473 1.00 0.00 N ATOM 1721 CZ ARG A 115 1.665 -1.858 7.610 1.00 0.00 C ATOM 1722 NH1 ARG A 115 2.230 -1.820 6.407 1.00 0.00 N ATOM 1723 NH2 ARG A 115 0.853 -0.880 7.971 1.00 0.00 N ATOM 0 H ARG A 115 3.364 -3.947 5.286 1.00 0.00 H new ATOM 0 HA ARG A 115 4.756 -6.502 5.987 1.00 0.00 H new ATOM 0 HB2 ARG A 115 2.224 -6.981 6.546 1.00 0.00 H new ATOM 0 HB3 ARG A 115 3.440 -6.463 7.696 1.00 0.00 H new ATOM 0 HG2 ARG A 115 1.776 -4.394 6.252 1.00 0.00 H new ATOM 0 HG3 ARG A 115 1.093 -5.266 7.610 1.00 0.00 H new ATOM 0 HD2 ARG A 115 3.035 -4.530 9.037 1.00 0.00 H new ATOM 0 HD3 ARG A 115 3.676 -3.627 7.679 1.00 0.00 H new ATOM 0 HE ARG A 115 1.455 -2.845 9.392 1.00 0.00 H new ATOM 0 HH11 ARG A 115 2.858 -2.569 6.114 1.00 0.00 H new ATOM 0 HH12 ARG A 115 2.036 -1.042 5.777 1.00 0.00 H new ATOM 0 HH21 ARG A 115 0.411 -0.897 8.890 1.00 0.00 H new ATOM 0 HH22 ARG A 115 0.668 -0.108 7.330 1.00 0.00 H new ATOM 1737 N VAL A 116 3.187 -7.732 4.219 1.00 0.00 N ATOM 1738 CA VAL A 116 2.652 -8.324 3.004 1.00 0.00 C ATOM 1739 C VAL A 116 1.710 -9.447 3.424 1.00 0.00 C ATOM 1740 O VAL A 116 1.709 -9.885 4.568 1.00 0.00 O ATOM 1741 CB VAL A 116 3.816 -8.820 2.083 1.00 0.00 C ATOM 1742 CG1 VAL A 116 4.650 -7.583 1.627 1.00 0.00 C ATOM 1743 CG2 VAL A 116 4.412 -10.248 2.082 1.00 0.00 C ATOM 0 H VAL A 116 3.420 -8.395 4.958 1.00 0.00 H new ATOM 0 HA VAL A 116 2.095 -7.596 2.415 1.00 0.00 H new ATOM 0 HB VAL A 116 3.326 -9.341 1.260 1.00 0.00 H new ATOM 0 HG11 VAL A 116 5.466 -7.912 0.984 1.00 0.00 H new ATOM 0 HG12 VAL A 116 4.009 -6.895 1.077 1.00 0.00 H new ATOM 0 HG13 VAL A 116 5.059 -7.077 2.502 1.00 0.00 H new ATOM 0 HG21 VAL A 116 5.208 -10.309 1.340 1.00 0.00 H new ATOM 0 HG22 VAL A 116 4.817 -10.474 3.069 1.00 0.00 H new ATOM 0 HG23 VAL A 116 3.631 -10.968 1.836 1.00 0.00 H new ATOM 1753 N TYR A 117 0.929 -9.893 2.417 1.00 0.00 N ATOM 1754 CA TYR A 117 -0.020 -10.965 2.674 1.00 0.00 C ATOM 1755 C TYR A 117 0.703 -12.216 2.141 1.00 0.00 C ATOM 1756 O TYR A 117 1.507 -12.121 1.220 1.00 0.00 O ATOM 1757 CB TYR A 117 -1.359 -10.724 1.956 1.00 0.00 C ATOM 1758 CG TYR A 117 -2.128 -9.495 2.396 1.00 0.00 C ATOM 1759 CD1 TYR A 117 -1.586 -8.212 2.411 1.00 0.00 C ATOM 1760 CD2 TYR A 117 -3.458 -9.637 2.759 1.00 0.00 C ATOM 1761 CE1 TYR A 117 -2.358 -7.106 2.716 1.00 0.00 C ATOM 1762 CE2 TYR A 117 -4.235 -8.542 3.102 1.00 0.00 C ATOM 1763 CZ TYR A 117 -3.703 -7.253 3.052 1.00 0.00 C ATOM 1764 OH TYR A 117 -4.496 -6.145 3.328 1.00 0.00 O ATOM 0 H TYR A 117 0.942 -9.537 1.461 1.00 0.00 H new ATOM 0 HA TYR A 117 -0.288 -11.052 3.727 1.00 0.00 H new ATOM 0 HB2 TYR A 117 -1.168 -10.646 0.886 1.00 0.00 H new ATOM 0 HB3 TYR A 117 -1.992 -11.599 2.104 1.00 0.00 H new ATOM 0 HD1 TYR A 117 -0.540 -8.078 2.179 1.00 0.00 H new ATOM 0 HD2 TYR A 117 -3.899 -10.623 2.775 1.00 0.00 H new ATOM 0 HE1 TYR A 117 -1.916 -6.121 2.694 1.00 0.00 H new ATOM 0 HE2 TYR A 117 -5.260 -8.687 3.410 1.00 0.00 H new ATOM 0 HH TYR A 117 -4.021 -5.548 3.943 1.00 0.00 H new ATOM 1774 N PRO A 118 0.400 -13.402 2.751 1.00 0.00 N ATOM 1775 CA PRO A 118 1.051 -14.655 2.378 1.00 0.00 C ATOM 1776 C PRO A 118 0.652 -15.008 0.931 1.00 0.00 C ATOM 1777 O PRO A 118 -0.346 -14.522 0.411 1.00 0.00 O ATOM 1778 CB PRO A 118 0.548 -15.680 3.411 1.00 0.00 C ATOM 1779 CG PRO A 118 -0.743 -15.083 3.969 1.00 0.00 C ATOM 1780 CD PRO A 118 -0.578 -13.569 3.832 1.00 0.00 C ATOM 0 HA PRO A 118 2.140 -14.616 2.391 1.00 0.00 H new ATOM 0 HB2 PRO A 118 0.366 -16.650 2.948 1.00 0.00 H new ATOM 0 HB3 PRO A 118 1.283 -15.837 4.200 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -1.612 -15.436 3.414 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -0.892 -15.370 5.010 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -1.525 -13.087 3.588 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -0.223 -13.123 4.761 1.00 0.00 H new ATOM 1788 N PRO A 119 1.489 -15.891 0.298 1.00 0.00 N ATOM 1789 CA PRO A 119 1.274 -16.338 -1.075 1.00 0.00 C ATOM 1790 C PRO A 119 0.045 -17.251 -1.013 1.00 0.00 C ATOM 1791 O PRO A 119 0.003 -18.242 -0.293 1.00 0.00 O ATOM 1792 CB PRO A 119 2.561 -17.090 -1.450 1.00 0.00 C ATOM 1793 CG PRO A 119 3.164 -17.527 -0.112 1.00 0.00 C ATOM 1794 CD PRO A 119 2.682 -16.490 0.903 1.00 0.00 C ATOM 0 HA PRO A 119 1.091 -15.557 -1.814 1.00 0.00 H new ATOM 0 HB2 PRO A 119 2.346 -17.949 -2.086 1.00 0.00 H new ATOM 0 HB3 PRO A 119 3.247 -16.448 -2.002 1.00 0.00 H new ATOM 0 HG2 PRO A 119 2.832 -18.529 0.161 1.00 0.00 H new ATOM 0 HG3 PRO A 119 4.253 -17.554 -0.161 1.00 0.00 H new ATOM 0 HD2 PRO A 119 2.448 -16.955 1.861 1.00 0.00 H new ATOM 0 HD3 PRO A 119 3.448 -15.738 1.093 1.00 0.00 H new ATOM 1802 N GLY A 120 -0.941 -16.817 -1.819 1.00 0.00 N ATOM 1803 CA GLY A 120 -2.232 -17.475 -1.922 1.00 0.00 C ATOM 1804 C GLY A 120 -3.267 -16.508 -1.361 1.00 0.00 C ATOM 1805 O GLY A 120 -2.968 -15.351 -1.085 1.00 0.00 O ATOM 0 H GLY A 120 -0.852 -15.994 -2.416 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -2.457 -17.723 -2.959 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -2.234 -18.411 -1.363 1.00 0.00 H new ATOM 1809 N THR A 121 -4.493 -17.046 -1.193 1.00 0.00 N ATOM 1810 CA THR A 121 -5.579 -16.270 -0.651 1.00 0.00 C ATOM 1811 C THR A 121 -5.215 -16.055 0.819 1.00 0.00 C ATOM 1812 O THR A 121 -4.602 -16.907 1.453 1.00 0.00 O ATOM 1813 CB THR A 121 -6.887 -17.098 -0.756 1.00 0.00 C ATOM 1814 OG1 THR A 121 -7.125 -18.148 0.235 1.00 0.00 O ATOM 1815 CG2 THR A 121 -7.151 -17.560 -2.215 1.00 0.00 C ATOM 0 H THR A 121 -4.734 -18.009 -1.429 1.00 0.00 H new ATOM 0 HA THR A 121 -5.730 -15.326 -1.175 1.00 0.00 H new ATOM 0 HB THR A 121 -7.651 -16.377 -0.465 1.00 0.00 H new ATOM 0 HG1 THR A 121 -7.983 -18.585 0.050 1.00 0.00 H new ATOM 0 HG21 THR A 121 -8.075 -18.137 -2.252 1.00 0.00 H new ATOM 0 HG22 THR A 121 -7.242 -16.688 -2.862 1.00 0.00 H new ATOM 0 HG23 THR A 121 -6.322 -18.180 -2.556 1.00 0.00 H new ATOM 1823 N SER A 122 -5.614 -14.871 1.313 1.00 0.00 N ATOM 1824 CA SER A 122 -5.346 -14.540 2.687 1.00 0.00 C ATOM 1825 C SER A 122 -6.498 -13.615 3.087 1.00 0.00 C ATOM 1826 O SER A 122 -6.334 -12.405 3.191 1.00 0.00 O ATOM 1827 CB SER A 122 -3.918 -13.929 2.800 1.00 0.00 C ATOM 1828 OG SER A 122 -3.017 -13.909 1.621 1.00 0.00 O ATOM 0 H SER A 122 -6.110 -14.155 0.782 1.00 0.00 H new ATOM 0 HA SER A 122 -5.322 -15.387 3.373 1.00 0.00 H new ATOM 0 HB2 SER A 122 -4.034 -12.898 3.135 1.00 0.00 H new ATOM 0 HB3 SER A 122 -3.399 -14.466 3.594 1.00 0.00 H new ATOM 0 HG SER A 122 -2.602 -14.790 1.512 1.00 0.00 H new ATOM 1834 N PRO A 123 -7.695 -14.237 3.323 1.00 0.00 N ATOM 1835 CA PRO A 123 -8.875 -13.468 3.669 1.00 0.00 C ATOM 1836 C PRO A 123 -8.802 -13.011 5.149 1.00 0.00 C ATOM 1837 O PRO A 123 -9.457 -12.059 5.556 1.00 0.00 O ATOM 1838 CB PRO A 123 -10.057 -14.453 3.499 1.00 0.00 C ATOM 1839 CG PRO A 123 -9.467 -15.711 2.857 1.00 0.00 C ATOM 1840 CD PRO A 123 -7.978 -15.667 3.183 1.00 0.00 C ATOM 0 HA PRO A 123 -8.974 -12.577 3.049 1.00 0.00 H new ATOM 0 HB2 PRO A 123 -10.515 -14.684 4.461 1.00 0.00 H new ATOM 0 HB3 PRO A 123 -10.837 -14.023 2.870 1.00 0.00 H new ATOM 0 HG2 PRO A 123 -9.931 -16.612 3.258 1.00 0.00 H new ATOM 0 HG3 PRO A 123 -9.634 -15.719 1.780 1.00 0.00 H new ATOM 0 HD2 PRO A 123 -7.753 -16.211 4.100 1.00 0.00 H new ATOM 0 HD3 PRO A 123 -7.381 -16.118 2.390 1.00 0.00 H new ATOM 1848 N GLU A 124 -7.959 -13.738 5.918 1.00 0.00 N ATOM 1849 CA GLU A 124 -7.787 -13.506 7.344 1.00 0.00 C ATOM 1850 C GLU A 124 -6.889 -12.285 7.555 1.00 0.00 C ATOM 1851 O GLU A 124 -7.043 -11.542 8.518 1.00 0.00 O ATOM 1852 CB GLU A 124 -7.150 -14.760 7.973 1.00 0.00 C ATOM 1853 CG GLU A 124 -6.866 -14.609 9.476 1.00 0.00 C ATOM 1854 CD GLU A 124 -6.372 -15.935 10.078 1.00 0.00 C ATOM 1855 OE1 GLU A 124 -5.167 -16.186 10.046 1.00 0.00 O ATOM 1856 OE2 GLU A 124 -7.197 -16.702 10.574 1.00 0.00 O ATOM 0 H GLU A 124 -7.385 -14.499 5.554 1.00 0.00 H new ATOM 0 HA GLU A 124 -8.750 -13.314 7.818 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -7.813 -15.612 7.819 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -6.218 -14.984 7.455 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -6.117 -13.833 9.632 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -7.771 -14.287 9.990 1.00 0.00 H new ATOM 1863 N THR A 125 -5.948 -12.126 6.609 1.00 0.00 N ATOM 1864 CA THR A 125 -4.982 -11.053 6.685 1.00 0.00 C ATOM 1865 C THR A 125 -5.654 -9.740 6.243 1.00 0.00 C ATOM 1866 O THR A 125 -5.073 -8.682 6.448 1.00 0.00 O ATOM 1867 CB THR A 125 -3.759 -11.489 5.812 1.00 0.00 C ATOM 1868 OG1 THR A 125 -3.384 -12.909 5.811 1.00 0.00 O ATOM 1869 CG2 THR A 125 -2.569 -10.508 5.975 1.00 0.00 C ATOM 0 H THR A 125 -5.848 -12.730 5.793 1.00 0.00 H new ATOM 0 HA THR A 125 -4.619 -10.864 7.695 1.00 0.00 H new ATOM 0 HB THR A 125 -4.131 -11.403 4.791 1.00 0.00 H new ATOM 0 HG1 THR A 125 -2.407 -12.989 5.822 1.00 0.00 H new ATOM 0 HG21 THR A 125 -1.736 -10.840 5.355 1.00 0.00 H new ATOM 0 HG22 THR A 125 -2.876 -9.509 5.665 1.00 0.00 H new ATOM 0 HG23 THR A 125 -2.257 -10.484 7.019 1.00 0.00 H new ATOM 1877 N THR A 126 -6.878 -9.811 5.653 1.00 0.00 N ATOM 1878 CA THR A 126 -7.522 -8.576 5.251 1.00 0.00 C ATOM 1879 C THR A 126 -8.362 -8.046 6.416 1.00 0.00 C ATOM 1880 O THR A 126 -8.703 -6.864 6.475 1.00 0.00 O ATOM 1881 CB THR A 126 -8.491 -8.680 4.078 1.00 0.00 C ATOM 1882 OG1 THR A 126 -9.743 -9.396 4.325 1.00 0.00 O ATOM 1883 CG2 THR A 126 -7.767 -9.052 2.764 1.00 0.00 C ATOM 0 H THR A 126 -7.397 -10.668 5.462 1.00 0.00 H new ATOM 0 HA THR A 126 -6.694 -7.934 4.950 1.00 0.00 H new ATOM 0 HB THR A 126 -8.871 -7.667 3.944 1.00 0.00 H new ATOM 0 HG1 THR A 126 -9.547 -10.272 4.717 1.00 0.00 H new ATOM 0 HG21 THR A 126 -8.493 -9.116 1.954 1.00 0.00 H new ATOM 0 HG22 THR A 126 -7.026 -8.288 2.528 1.00 0.00 H new ATOM 0 HG23 THR A 126 -7.270 -10.015 2.882 1.00 0.00 H new ATOM 1891 N ILE A 127 -8.699 -8.968 7.341 1.00 0.00 N ATOM 1892 CA ILE A 127 -9.402 -8.506 8.529 1.00 0.00 C ATOM 1893 C ILE A 127 -8.351 -7.630 9.264 1.00 0.00 C ATOM 1894 O ILE A 127 -8.673 -6.689 9.980 1.00 0.00 O ATOM 1895 CB ILE A 127 -9.887 -9.708 9.395 1.00 0.00 C ATOM 1896 CG1 ILE A 127 -10.278 -10.985 8.628 1.00 0.00 C ATOM 1897 CG2 ILE A 127 -10.459 -9.170 10.746 1.00 0.00 C ATOM 1898 CD1 ILE A 127 -10.784 -12.160 9.487 1.00 0.00 C ATOM 0 H ILE A 127 -8.507 -9.968 7.289 1.00 0.00 H new ATOM 0 HA ILE A 127 -10.309 -7.946 8.302 1.00 0.00 H new ATOM 0 HB ILE A 127 -9.158 -10.384 9.841 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -11.053 -10.728 7.906 1.00 0.00 H new ATOM 0 HG13 ILE A 127 -9.412 -11.323 8.059 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -10.800 -10.007 11.356 1.00 0.00 H new ATOM 0 HG22 ILE A 127 -9.680 -8.626 11.280 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -11.297 -8.502 10.546 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -11.029 -13.003 8.842 1.00 0.00 H new ATOM 0 HD12 ILE A 127 -10.007 -12.456 10.192 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -11.674 -11.852 10.036 1.00 0.00 H new ATOM 1910 N ALA A 128 -7.072 -8.001 8.977 1.00 0.00 N ATOM 1911 CA ALA A 128 -5.916 -7.332 9.500 1.00 0.00 C ATOM 1912 C ALA A 128 -5.500 -6.229 8.513 1.00 0.00 C ATOM 1913 O ALA A 128 -4.567 -5.502 8.814 1.00 0.00 O ATOM 1914 CB ALA A 128 -4.787 -8.340 9.766 1.00 0.00 C ATOM 0 H ALA A 128 -6.846 -8.786 8.366 1.00 0.00 H new ATOM 0 HA ALA A 128 -6.145 -6.866 10.458 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -3.917 -7.816 10.162 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -5.125 -9.082 10.490 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -4.517 -8.838 8.835 1.00 0.00 H new ATOM 1920 N ASP A 129 -6.189 -6.096 7.346 1.00 0.00 N ATOM 1921 CA ASP A 129 -5.881 -5.070 6.350 1.00 0.00 C ATOM 1922 C ASP A 129 -5.880 -3.721 7.073 1.00 0.00 C ATOM 1923 O ASP A 129 -4.893 -3.000 7.144 1.00 0.00 O ATOM 1924 CB ASP A 129 -6.946 -5.015 5.219 1.00 0.00 C ATOM 1925 CG ASP A 129 -6.585 -4.117 4.014 1.00 0.00 C ATOM 1926 OD1 ASP A 129 -5.808 -3.174 4.163 1.00 0.00 O ATOM 1927 OD2 ASP A 129 -7.093 -4.381 2.925 1.00 0.00 O ATOM 0 H ASP A 129 -6.967 -6.701 7.085 1.00 0.00 H new ATOM 0 HA ASP A 129 -4.919 -5.301 5.892 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -7.120 -6.028 4.857 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -7.886 -4.663 5.644 1.00 0.00 H new ATOM 1932 N MET A 130 -7.081 -3.474 7.614 1.00 0.00 N ATOM 1933 CA MET A 130 -7.331 -2.212 8.280 1.00 0.00 C ATOM 1934 C MET A 130 -6.984 -2.299 9.776 1.00 0.00 C ATOM 1935 O MET A 130 -6.729 -1.274 10.397 1.00 0.00 O ATOM 1936 CB MET A 130 -8.813 -1.840 8.083 1.00 0.00 C ATOM 1937 CG MET A 130 -9.109 -0.375 8.434 1.00 0.00 C ATOM 1938 SD MET A 130 -10.564 -0.167 9.470 1.00 0.00 S ATOM 1939 CE MET A 130 -9.881 -0.813 11.010 1.00 0.00 C ATOM 0 H MET A 130 -7.870 -4.121 7.600 1.00 0.00 H new ATOM 0 HA MET A 130 -6.696 -1.439 7.846 1.00 0.00 H new ATOM 0 HB2 MET A 130 -9.095 -2.025 7.046 1.00 0.00 H new ATOM 0 HB3 MET A 130 -9.432 -2.490 8.702 1.00 0.00 H new ATOM 0 HG2 MET A 130 -8.245 0.050 8.945 1.00 0.00 H new ATOM 0 HG3 MET A 130 -9.245 0.191 7.512 1.00 0.00 H new ATOM 0 HE1 MET A 130 -10.655 -0.819 11.777 1.00 0.00 H new ATOM 0 HE2 MET A 130 -9.520 -1.829 10.850 1.00 0.00 H new ATOM 0 HE3 MET A 130 -9.054 -0.181 11.335 1.00 0.00 H new ATOM 1949 N LYS A 131 -6.971 -3.527 10.342 1.00 0.00 N ATOM 1950 CA LYS A 131 -6.738 -3.619 11.780 1.00 0.00 C ATOM 1951 C LYS A 131 -5.232 -3.659 12.091 1.00 0.00 C ATOM 1952 O LYS A 131 -4.851 -3.490 13.241 1.00 0.00 O ATOM 1953 CB LYS A 131 -7.501 -4.836 12.335 1.00 0.00 C ATOM 1954 CG LYS A 131 -7.599 -4.866 13.866 1.00 0.00 C ATOM 1955 CD LYS A 131 -8.486 -6.015 14.360 1.00 0.00 C ATOM 1956 CE LYS A 131 -8.602 -6.049 15.886 1.00 0.00 C ATOM 1957 NZ LYS A 131 -9.457 -7.135 16.350 1.00 0.00 N ATOM 0 H LYS A 131 -7.111 -4.411 9.852 1.00 0.00 H new ATOM 0 HA LYS A 131 -7.121 -2.729 12.279 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -8.507 -4.843 11.917 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -7.008 -5.747 11.995 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -6.601 -4.969 14.292 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -8.001 -3.918 14.223 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -9.480 -5.915 13.925 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -8.078 -6.962 14.008 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -7.609 -6.159 16.322 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -9.001 -5.098 16.239 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -9.506 -7.119 17.389 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -10.412 -7.017 15.956 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -9.063 -8.045 16.036 1.00 0.00 H new ATOM 1970 N GLU A 132 -4.384 -3.884 11.066 1.00 0.00 N ATOM 1971 CA GLU A 132 -2.952 -3.950 11.333 1.00 0.00 C ATOM 1972 C GLU A 132 -2.373 -2.550 11.192 1.00 0.00 C ATOM 1973 O GLU A 132 -1.738 -2.010 12.086 1.00 0.00 O ATOM 1974 CB GLU A 132 -2.240 -4.974 10.429 1.00 0.00 C ATOM 1975 CG GLU A 132 -0.747 -5.128 10.776 1.00 0.00 C ATOM 1976 CD GLU A 132 -0.068 -6.321 10.071 1.00 0.00 C ATOM 1977 OE1 GLU A 132 -0.762 -7.209 9.576 1.00 0.00 O ATOM 1978 OE2 GLU A 132 1.161 -6.353 10.033 1.00 0.00 O ATOM 0 H GLU A 132 -4.658 -4.016 10.092 1.00 0.00 H new ATOM 0 HA GLU A 132 -2.788 -4.305 12.351 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -2.733 -5.941 10.522 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -2.338 -4.665 9.388 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -0.223 -4.211 10.505 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -0.644 -5.248 11.854 1.00 0.00 H new ATOM 1985 N VAL A 133 -2.637 -2.009 10.001 1.00 0.00 N ATOM 1986 CA VAL A 133 -2.108 -0.697 9.655 1.00 0.00 C ATOM 1987 C VAL A 133 -2.635 0.448 10.537 1.00 0.00 C ATOM 1988 O VAL A 133 -1.848 1.204 11.095 1.00 0.00 O ATOM 1989 CB VAL A 133 -2.330 -0.432 8.132 1.00 0.00 C ATOM 1990 CG1 VAL A 133 -1.873 1.021 7.797 1.00 0.00 C ATOM 1991 CG2 VAL A 133 -2.335 -1.515 7.025 1.00 0.00 C ATOM 0 H VAL A 133 -3.202 -2.451 9.276 1.00 0.00 H new ATOM 0 HA VAL A 133 -1.038 -0.713 9.862 1.00 0.00 H new ATOM 0 HB VAL A 133 -3.403 -0.588 8.019 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -2.025 1.214 6.735 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -2.458 1.730 8.382 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -0.816 1.135 8.039 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -2.513 -1.046 6.058 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -1.371 -2.024 7.010 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -3.124 -2.239 7.228 1.00 0.00 H new ATOM 2001 N LEU A 134 -3.978 0.540 10.633 1.00 0.00 N ATOM 2002 CA LEU A 134 -4.560 1.627 11.408 1.00 0.00 C ATOM 2003 C LEU A 134 -4.719 1.190 12.872 1.00 0.00 C ATOM 2004 O LEU A 134 -4.978 2.033 13.722 1.00 0.00 O ATOM 2005 CB LEU A 134 -5.871 2.120 10.771 1.00 0.00 C ATOM 2006 CG LEU A 134 -5.668 2.591 9.292 1.00 0.00 C ATOM 2007 CD1 LEU A 134 -6.094 1.457 8.320 1.00 0.00 C ATOM 2008 CD2 LEU A 134 -5.592 4.073 8.845 1.00 0.00 C ATOM 0 H LEU A 134 -4.645 -0.100 10.201 1.00 0.00 H new ATOM 0 HA LEU A 134 -3.888 2.485 11.400 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -6.610 1.319 10.797 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -6.273 2.944 11.361 1.00 0.00 H new ATOM 0 HG LEU A 134 -4.605 2.815 9.201 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -5.952 1.787 7.291 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -5.485 0.572 8.504 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -7.144 1.215 8.481 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -5.447 4.121 7.766 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -6.520 4.581 9.109 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -4.756 4.561 9.345 1.00 0.00 H new ATOM 2020 N GLY A 135 -4.559 -0.128 13.151 1.00 0.00 N ATOM 2021 CA GLY A 135 -4.673 -0.582 14.533 1.00 0.00 C ATOM 2022 C GLY A 135 -3.302 -0.549 15.216 1.00 0.00 C ATOM 2023 O GLY A 135 -2.993 0.356 15.981 1.00 0.00 O ATOM 0 H GLY A 135 -4.360 -0.855 12.464 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -5.373 0.053 15.076 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -5.076 -1.594 14.559 1.00 0.00 H new ATOM 2027 N VAL A 136 -2.507 -1.594 14.888 1.00 0.00 N ATOM 2028 CA VAL A 136 -1.169 -1.706 15.452 1.00 0.00 C ATOM 2029 C VAL A 136 -0.364 -2.707 14.613 1.00 0.00 C ATOM 2030 O VAL A 136 -0.893 -3.653 14.042 1.00 0.00 O ATOM 2031 CB VAL A 136 -1.233 -2.162 16.946 1.00 0.00 C ATOM 2032 CG1 VAL A 136 -0.017 -1.597 17.737 1.00 0.00 C ATOM 2033 CG2 VAL A 136 -2.470 -2.842 17.601 1.00 0.00 C ATOM 0 H VAL A 136 -2.772 -2.346 14.252 1.00 0.00 H new ATOM 0 HA VAL A 136 -0.680 -0.732 15.428 1.00 0.00 H new ATOM 0 HB VAL A 136 -1.367 -3.236 17.077 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -0.075 -1.923 18.776 1.00 0.00 H new ATOM 0 HG12 VAL A 136 0.908 -1.964 17.293 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -0.031 -0.508 17.697 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -2.255 -3.058 18.647 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -3.329 -2.174 17.538 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -2.694 -3.771 17.077 1.00 0.00 H new ATOM 2043 N GLU A 137 0.951 -2.405 14.595 1.00 0.00 N ATOM 2044 CA GLU A 137 1.979 -3.154 13.892 1.00 0.00 C ATOM 2045 C GLU A 137 1.749 -2.970 12.374 1.00 0.00 C ATOM 2046 O GLU A 137 1.218 -1.937 11.961 1.00 0.00 O ATOM 2047 CB GLU A 137 2.010 -4.626 14.361 1.00 0.00 C ATOM 2048 CG GLU A 137 2.141 -4.803 15.885 1.00 0.00 C ATOM 2049 CD GLU A 137 3.450 -4.194 16.421 1.00 0.00 C ATOM 2050 OE1 GLU A 137 4.500 -4.813 16.255 1.00 0.00 O ATOM 2051 OE2 GLU A 137 3.404 -3.108 16.998 1.00 0.00 O ATOM 2052 OXT GLU A 137 2.121 -3.861 11.612 1.00 0.00 O ATOM 0 H GLU A 137 1.326 -1.598 15.094 1.00 0.00 H new ATOM 0 HA GLU A 137 2.974 -2.775 14.124 1.00 0.00 H new ATOM 0 HB2 GLU A 137 1.098 -5.121 14.027 1.00 0.00 H new ATOM 0 HB3 GLU A 137 2.844 -5.132 13.875 1.00 0.00 H new ATOM 0 HG2 GLU A 137 1.292 -4.332 16.380 1.00 0.00 H new ATOM 0 HG3 GLU A 137 2.106 -5.864 16.132 1.00 0.00 H new TER 2059 GLU A 137 HETATM 2060 N4 FOP A 138 -3.236 -12.948 -9.757 1.00 0.00 N HETATM 2061 C5 FOP A 138 -2.093 -13.695 -10.277 1.00 0.00 C HETATM 2062 C6 FOP A 138 -2.187 -15.222 -10.118 1.00 0.00 C HETATM 2063 C7 FOP A 138 -1.003 -15.957 -10.762 1.00 0.00 C HETATM 2064 O7 FOP A 138 -2.438 -15.687 -8.808 1.00 0.00 O HETATM 0 H73 FOP A 138 -0.972 -15.733 -11.828 1.00 0.00 H new HETATM 0 H72 FOP A 138 -0.074 -15.629 -10.296 1.00 0.00 H new HETATM 0 H71 FOP A 138 -1.121 -17.031 -10.620 1.00 0.00 H new HETATM 0 H6 FOP A 138 -3.089 -15.477 -10.675 1.00 0.00 H new HETATM 0 H52 FOP A 138 -1.977 -13.462 -11.335 1.00 0.00 H new HETATM 0 H51 FOP A 138 -1.191 -13.347 -9.773 1.00 0.00 H new HETATM 0 H43 FOP A 138 -2.909 -12.086 -9.320 1.00 0.00 H new HETATM 0 H42 FOP A 138 -3.871 -12.721 -10.522 1.00 0.00 H new HETATM 0 H41 FOP A 138 -3.727 -13.514 -9.065 1.00 0.00 H new HETATM 2074 P DBI A 139 -1.441 -15.287 -7.641 1.00 0.00 P HETATM 2075 O1P DBI A 139 -1.006 -16.593 -6.866 1.00 0.00 O HETATM 2076 O2P DBI A 139 -0.142 -14.562 -8.171 1.00 0.00 O HETATM 2077 O3' DBI A 139 -2.203 -14.317 -6.651 1.00 0.00 O HETATM 2078 O5' DBI A 139 -5.086 -14.807 -8.338 1.00 0.00 O HETATM 2079 C5' DBI A 139 -5.593 -14.621 -7.044 1.00 0.00 C HETATM 2080 C4' DBI A 139 -4.538 -14.071 -6.076 1.00 0.00 C HETATM 2081 O4' DBI A 139 -5.093 -14.038 -4.773 1.00 0.00 O HETATM 2082 C1' DBI A 139 -4.023 -14.084 -3.850 1.00 0.00 C HETATM 2083 N1 DBI A 139 -3.532 -12.733 -3.609 1.00 0.00 N HETATM 2084 C8 DBI A 139 -3.969 -11.841 -2.637 1.00 0.00 C HETATM 2085 C7 DBI A 139 -4.867 -11.930 -1.610 1.00 0.00 C HETATM 2086 C6 DBI A 139 -5.119 -10.832 -0.778 1.00 0.00 C HETATM 2087 C11 DBI A 139 -6.078 -10.982 0.367 1.00 0.00 C HETATM 2088 C10 DBI A 139 -4.757 -8.349 -0.248 1.00 0.00 C HETATM 2089 C5 DBI A 139 -4.484 -9.606 -1.038 1.00 0.00 C HETATM 2090 C4 DBI A 139 -3.553 -9.540 -2.069 1.00 0.00 C HETATM 2091 C9 DBI A 139 -3.281 -10.621 -2.851 1.00 0.00 C HETATM 2092 N3 DBI A 139 -2.404 -10.816 -3.895 1.00 0.00 N HETATM 2093 C2 DBI A 139 -2.600 -12.075 -4.317 1.00 0.00 C HETATM 2094 C2' DBI A 139 -3.025 -15.060 -4.475 1.00 0.00 C HETATM 2095 O2' DBI A 139 -1.691 -14.859 -4.067 1.00 0.00 O HETATM 2096 C3' DBI A 139 -3.277 -14.933 -5.971 1.00 0.00 C HETATM 0 HO21 DBI A 139 -1.182 -14.455 -4.800 1.00 0.00 H new HETATM 0 H5'2 DBI A 139 -6.439 -13.935 -7.083 1.00 0.00 H new HETATM 0 H5'1 DBI A 139 -5.970 -15.571 -6.665 1.00 0.00 H new HETATM 0 H113 DBI A 139 -7.060 -11.262 -0.015 1.00 0.00 H new HETATM 0 H112 DBI A 139 -5.718 -11.756 1.044 1.00 0.00 H new HETATM 0 H111 DBI A 139 -6.154 -10.037 0.904 1.00 0.00 H new HETATM 0 H103 DBI A 139 -5.811 -8.086 -0.336 1.00 0.00 H new HETATM 0 H102 DBI A 139 -4.512 -8.518 0.801 1.00 0.00 H new HETATM 0 H101 DBI A 139 -4.146 -7.535 -0.637 1.00 0.00 H new HETATM 0 HO5 DBI A 139 -4.218 -15.260 -8.287 1.00 0.00 H new HETATM 0 H7 DBI A 139 -5.394 -12.868 -1.436 1.00 0.00 H new HETATM 0 H4' DBI A 139 -4.259 -13.092 -6.465 1.00 0.00 H new HETATM 0 H4 DBI A 139 -3.030 -8.602 -2.255 1.00 0.00 H new HETATM 0 H3' DBI A 139 -3.386 -15.914 -6.434 1.00 0.00 H new HETATM 0 H2' DBI A 139 -3.177 -16.085 -4.137 1.00 0.00 H new HETATM 0 H2 DBI A 139 -2.057 -12.519 -5.151 1.00 0.00 H new HETATM 0 H1' DBI A 139 -4.282 -14.441 -2.853 1.00 0.00 H new