USER MOD reduce.3.24.130724 H: found=0, std=0, add=889, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 889 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 MET CE :methyl -164:sc= -0.0375 (180deg=-0.391) USER MOD Single : A 1 MET N :NH3+ 134:sc= 0.116 (180deg=-0.127) USER MOD Single : A 2 SER OG : rot 180:sc= 0.0183 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 6 GLN : amide:sc= -0.527 K(o=-0.53,f=-6.1!) USER MOD Single : A 18 MET CE :methyl 174:sc= -0.117 (180deg=-0.177) USER MOD Single : A 19 MET CE :methyl -135:sc= -0.0281 (180deg=-0.336) USER MOD Single : A 29 LYS NZ :NH3+ -162:sc= 1.14 (180deg=0.677) USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot 157:sc= 1.21 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 ASN : amide:sc= 0.976 K(o=0.98,f=-3.2!) USER MOD Single : A 64 LYS NZ :NH3+ -175:sc= 1.17 (180deg=1.1) USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot 180:sc= -0.659 USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 101 GLN : amide:sc= -1.73! C(o=-1.7!,f=-1.7!) USER MOD Single : A 102 LYS NZ :NH3+ -159:sc= -0.099 (180deg=-0.517) USER MOD Single : A 105 THR OG1 : rot 180:sc= 0.0319 USER MOD Single : A 106 MET CE :methyl -157:sc= -0.963 (180deg=-2.22) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.888 -1.162 -4.698 1.00 0.00 N ATOM 2 CA MET A 1 3.065 -0.402 -5.169 1.00 0.00 C ATOM 3 C MET A 1 3.504 0.611 -4.112 1.00 0.00 C ATOM 4 O MET A 1 2.796 0.830 -3.129 1.00 0.00 O ATOM 5 CB MET A 1 2.771 0.301 -6.501 1.00 0.00 C ATOM 6 CG MET A 1 1.675 1.358 -6.342 1.00 0.00 C ATOM 7 SD MET A 1 1.302 2.274 -7.861 1.00 0.00 S ATOM 8 CE MET A 1 2.858 3.184 -8.047 1.00 0.00 C ATOM 0 H1 MET A 1 1.178 -1.208 -5.457 1.00 0.00 H new ATOM 0 H2 MET A 1 2.179 -2.126 -4.437 1.00 0.00 H new ATOM 0 H3 MET A 1 1.477 -0.687 -3.869 1.00 0.00 H new ATOM 0 HA MET A 1 3.879 -1.107 -5.334 1.00 0.00 H new ATOM 0 HB2 MET A 1 3.681 0.771 -6.875 1.00 0.00 H new ATOM 0 HB3 MET A 1 2.464 -0.436 -7.243 1.00 0.00 H new ATOM 0 HG2 MET A 1 0.765 0.872 -5.991 1.00 0.00 H new ATOM 0 HG3 MET A 1 1.977 2.065 -5.569 1.00 0.00 H new ATOM 0 HE1 MET A 1 2.718 4.003 -8.752 1.00 0.00 H new ATOM 0 HE2 MET A 1 3.163 3.585 -7.080 1.00 0.00 H new ATOM 0 HE3 MET A 1 3.630 2.512 -8.420 1.00 0.00 H new ATOM 20 N SER A 2 4.670 1.227 -4.314 1.00 0.00 N ATOM 21 CA SER A 2 5.217 2.207 -3.387 1.00 0.00 C ATOM 22 C SER A 2 6.150 3.162 -4.131 1.00 0.00 C ATOM 23 O SER A 2 6.342 3.031 -5.341 1.00 0.00 O ATOM 24 CB SER A 2 5.976 1.486 -2.273 1.00 0.00 C ATOM 25 OG SER A 2 7.142 0.886 -2.802 1.00 0.00 O ATOM 0 H SER A 2 5.260 1.057 -5.129 1.00 0.00 H new ATOM 0 HA SER A 2 4.404 2.785 -2.948 1.00 0.00 H new ATOM 0 HB2 SER A 2 6.243 2.191 -1.486 1.00 0.00 H new ATOM 0 HB3 SER A 2 5.339 0.727 -1.818 1.00 0.00 H new ATOM 0 HG SER A 2 7.627 0.426 -2.085 1.00 0.00 H new ATOM 31 N ALA A 3 6.725 4.128 -3.406 1.00 0.00 N ATOM 32 CA ALA A 3 7.639 5.106 -3.976 1.00 0.00 C ATOM 33 C ALA A 3 9.018 4.503 -4.261 1.00 0.00 C ATOM 34 O ALA A 3 9.940 5.225 -4.642 1.00 0.00 O ATOM 35 CB ALA A 3 7.756 6.287 -3.013 1.00 0.00 C ATOM 0 H ALA A 3 6.565 4.248 -2.406 1.00 0.00 H new ATOM 0 HA ALA A 3 7.240 5.442 -4.933 1.00 0.00 H new ATOM 0 HB1 ALA A 3 8.439 7.029 -3.428 1.00 0.00 H new ATOM 0 HB2 ALA A 3 6.774 6.738 -2.869 1.00 0.00 H new ATOM 0 HB3 ALA A 3 8.139 5.938 -2.054 1.00 0.00 H new ATOM 41 N LEU A 4 9.170 3.187 -4.081 1.00 0.00 N ATOM 42 CA LEU A 4 10.441 2.516 -4.303 1.00 0.00 C ATOM 43 C LEU A 4 10.202 1.072 -4.746 1.00 0.00 C ATOM 44 O LEU A 4 10.033 0.180 -3.915 1.00 0.00 O ATOM 45 CB LEU A 4 11.277 2.588 -3.016 1.00 0.00 C ATOM 46 CG LEU A 4 12.539 1.719 -3.080 1.00 0.00 C ATOM 47 CD1 LEU A 4 13.379 2.064 -4.302 1.00 0.00 C ATOM 48 CD2 LEU A 4 13.378 1.967 -1.831 1.00 0.00 C ATOM 0 H LEU A 4 8.418 2.567 -3.780 1.00 0.00 H new ATOM 0 HA LEU A 4 10.994 3.012 -5.100 1.00 0.00 H new ATOM 0 HB2 LEU A 4 11.563 3.623 -2.831 1.00 0.00 H new ATOM 0 HB3 LEU A 4 10.665 2.271 -2.172 1.00 0.00 H new ATOM 0 HG LEU A 4 12.234 0.674 -3.144 1.00 0.00 H new ATOM 0 HD11 LEU A 4 14.268 1.433 -4.323 1.00 0.00 H new ATOM 0 HD12 LEU A 4 12.793 1.895 -5.206 1.00 0.00 H new ATOM 0 HD13 LEU A 4 13.678 3.111 -4.254 1.00 0.00 H new ATOM 0 HD21 LEU A 4 14.277 1.352 -1.869 1.00 0.00 H new ATOM 0 HD22 LEU A 4 13.659 3.019 -1.784 1.00 0.00 H new ATOM 0 HD23 LEU A 4 12.798 1.707 -0.946 1.00 0.00 H new ATOM 60 N THR A 5 10.189 0.847 -6.064 1.00 0.00 N ATOM 61 CA THR A 5 10.037 -0.489 -6.634 1.00 0.00 C ATOM 62 C THR A 5 10.936 -0.736 -7.843 1.00 0.00 C ATOM 63 O THR A 5 11.373 -1.862 -8.060 1.00 0.00 O ATOM 64 CB THR A 5 8.570 -0.785 -6.979 1.00 0.00 C ATOM 65 OG1 THR A 5 8.264 -0.243 -8.244 1.00 0.00 O ATOM 66 CG2 THR A 5 7.595 -0.216 -5.952 1.00 0.00 C ATOM 0 H THR A 5 10.283 1.586 -6.761 1.00 0.00 H new ATOM 0 HA THR A 5 10.362 -1.183 -5.859 1.00 0.00 H new ATOM 0 HB THR A 5 8.457 -1.869 -6.979 1.00 0.00 H new ATOM 0 HG1 THR A 5 7.328 -0.434 -8.464 1.00 0.00 H new ATOM 0 HG21 THR A 5 6.574 -0.456 -6.248 1.00 0.00 H new ATOM 0 HG22 THR A 5 7.801 -0.651 -4.974 1.00 0.00 H new ATOM 0 HG23 THR A 5 7.713 0.866 -5.899 1.00 0.00 H new ATOM 74 N GLN A 6 11.220 0.305 -8.629 1.00 0.00 N ATOM 75 CA GLN A 6 12.080 0.163 -9.796 1.00 0.00 C ATOM 76 C GLN A 6 13.534 0.229 -9.336 1.00 0.00 C ATOM 77 O GLN A 6 14.012 1.294 -8.959 1.00 0.00 O ATOM 78 CB GLN A 6 11.779 1.278 -10.800 1.00 0.00 C ATOM 79 CG GLN A 6 10.273 1.483 -11.024 1.00 0.00 C ATOM 80 CD GLN A 6 9.574 0.242 -11.564 1.00 0.00 C ATOM 81 OE1 GLN A 6 10.214 -0.696 -12.031 1.00 0.00 O ATOM 82 NE2 GLN A 6 8.244 0.228 -11.504 1.00 0.00 N ATOM 0 H GLN A 6 10.867 1.250 -8.476 1.00 0.00 H new ATOM 0 HA GLN A 6 11.898 -0.793 -10.287 1.00 0.00 H new ATOM 0 HB2 GLN A 6 12.220 2.210 -10.445 1.00 0.00 H new ATOM 0 HB3 GLN A 6 12.255 1.043 -11.752 1.00 0.00 H new ATOM 0 HG2 GLN A 6 9.808 1.773 -10.082 1.00 0.00 H new ATOM 0 HG3 GLN A 6 10.124 2.308 -11.720 1.00 0.00 H new ATOM 0 HE21 GLN A 6 7.743 1.024 -11.110 1.00 0.00 H new ATOM 0 HE22 GLN A 6 7.726 -0.579 -11.852 1.00 0.00 H new ATOM 91 N ILE A 7 14.244 -0.904 -9.365 1.00 0.00 N ATOM 92 CA ILE A 7 15.609 -0.953 -8.869 1.00 0.00 C ATOM 93 C ILE A 7 16.547 -1.600 -9.884 1.00 0.00 C ATOM 94 O ILE A 7 16.221 -2.640 -10.457 1.00 0.00 O ATOM 95 CB ILE A 7 15.641 -1.666 -7.509 1.00 0.00 C ATOM 96 CG1 ILE A 7 14.809 -0.838 -6.513 1.00 0.00 C ATOM 97 CG2 ILE A 7 17.086 -1.809 -7.021 1.00 0.00 C ATOM 98 CD1 ILE A 7 14.897 -1.374 -5.084 1.00 0.00 C ATOM 0 H ILE A 7 13.892 -1.791 -9.726 1.00 0.00 H new ATOM 0 HA ILE A 7 15.971 0.065 -8.725 1.00 0.00 H new ATOM 0 HB ILE A 7 15.220 -2.668 -7.597 1.00 0.00 H new ATOM 0 HG12 ILE A 7 15.152 0.196 -6.531 1.00 0.00 H new ATOM 0 HG13 ILE A 7 13.767 -0.834 -6.832 1.00 0.00 H new ATOM 0 HG21 ILE A 7 17.096 -2.316 -6.056 1.00 0.00 H new ATOM 0 HG22 ILE A 7 17.658 -2.392 -7.743 1.00 0.00 H new ATOM 0 HG23 ILE A 7 17.534 -0.821 -6.916 1.00 0.00 H new ATOM 0 HD11 ILE A 7 14.292 -0.752 -4.424 1.00 0.00 H new ATOM 0 HD12 ILE A 7 14.528 -2.399 -5.057 1.00 0.00 H new ATOM 0 HD13 ILE A 7 15.935 -1.353 -4.751 1.00 0.00 H new ATOM 110 N LEU A 8 17.710 -0.980 -10.095 1.00 0.00 N ATOM 111 CA LEU A 8 18.756 -1.530 -10.947 1.00 0.00 C ATOM 112 C LEU A 8 19.791 -2.265 -10.093 1.00 0.00 C ATOM 113 O LEU A 8 19.970 -1.943 -8.920 1.00 0.00 O ATOM 114 CB LEU A 8 19.425 -0.408 -11.751 1.00 0.00 C ATOM 115 CG LEU A 8 20.137 -0.983 -12.984 1.00 0.00 C ATOM 116 CD1 LEU A 8 19.170 -1.007 -14.167 1.00 0.00 C ATOM 117 CD2 LEU A 8 21.348 -0.135 -13.360 1.00 0.00 C ATOM 0 H LEU A 8 17.949 -0.081 -9.677 1.00 0.00 H new ATOM 0 HA LEU A 8 18.311 -2.239 -11.645 1.00 0.00 H new ATOM 0 HB2 LEU A 8 18.677 0.321 -12.062 1.00 0.00 H new ATOM 0 HB3 LEU A 8 20.142 0.120 -11.123 1.00 0.00 H new ATOM 0 HG LEU A 8 20.471 -1.992 -12.744 1.00 0.00 H new ATOM 0 HD11 LEU A 8 19.676 -1.415 -15.042 1.00 0.00 H new ATOM 0 HD12 LEU A 8 18.310 -1.630 -13.921 1.00 0.00 H new ATOM 0 HD13 LEU A 8 18.834 0.007 -14.383 1.00 0.00 H new ATOM 0 HD21 LEU A 8 21.834 -0.564 -14.236 1.00 0.00 H new ATOM 0 HD22 LEU A 8 21.025 0.881 -13.585 1.00 0.00 H new ATOM 0 HD23 LEU A 8 22.051 -0.116 -12.528 1.00 0.00 H new ATOM 129 N ILE A 9 20.473 -3.248 -10.677 1.00 0.00 N ATOM 130 CA ILE A 9 21.524 -3.986 -9.994 1.00 0.00 C ATOM 131 C ILE A 9 22.790 -3.964 -10.839 1.00 0.00 C ATOM 132 O ILE A 9 22.725 -4.030 -12.066 1.00 0.00 O ATOM 133 CB ILE A 9 21.059 -5.426 -9.721 1.00 0.00 C ATOM 134 CG1 ILE A 9 19.749 -5.441 -8.918 1.00 0.00 C ATOM 135 CG2 ILE A 9 22.142 -6.202 -8.963 1.00 0.00 C ATOM 136 CD1 ILE A 9 19.125 -6.834 -8.936 1.00 0.00 C ATOM 0 H ILE A 9 20.310 -3.552 -11.637 1.00 0.00 H new ATOM 0 HA ILE A 9 21.743 -3.517 -9.035 1.00 0.00 H new ATOM 0 HB ILE A 9 20.880 -5.907 -10.682 1.00 0.00 H new ATOM 0 HG12 ILE A 9 19.943 -5.137 -7.890 1.00 0.00 H new ATOM 0 HG13 ILE A 9 19.050 -4.718 -9.338 1.00 0.00 H new ATOM 0 HG21 ILE A 9 21.798 -7.219 -8.777 1.00 0.00 H new ATOM 0 HG22 ILE A 9 23.054 -6.231 -9.559 1.00 0.00 H new ATOM 0 HG23 ILE A 9 22.345 -5.709 -8.013 1.00 0.00 H new ATOM 0 HD11 ILE A 9 18.198 -6.825 -8.362 1.00 0.00 H new ATOM 0 HD12 ILE A 9 18.912 -7.124 -9.965 1.00 0.00 H new ATOM 0 HD13 ILE A 9 19.819 -7.549 -8.494 1.00 0.00 H new ATOM 148 N VAL A 10 23.946 -3.875 -10.182 1.00 0.00 N ATOM 149 CA VAL A 10 25.237 -3.923 -10.847 1.00 0.00 C ATOM 150 C VAL A 10 26.129 -4.922 -10.134 1.00 0.00 C ATOM 151 O VAL A 10 26.597 -4.663 -9.025 1.00 0.00 O ATOM 152 CB VAL A 10 25.874 -2.531 -10.905 1.00 0.00 C ATOM 153 CG1 VAL A 10 27.141 -2.575 -11.756 1.00 0.00 C ATOM 154 CG2 VAL A 10 24.901 -1.503 -11.490 1.00 0.00 C ATOM 0 H VAL A 10 24.008 -3.767 -9.170 1.00 0.00 H new ATOM 0 HA VAL A 10 25.104 -4.251 -11.878 1.00 0.00 H new ATOM 0 HB VAL A 10 26.124 -2.230 -9.887 1.00 0.00 H new ATOM 0 HG11 VAL A 10 27.589 -1.582 -11.793 1.00 0.00 H new ATOM 0 HG12 VAL A 10 27.850 -3.277 -11.317 1.00 0.00 H new ATOM 0 HG13 VAL A 10 26.890 -2.898 -12.766 1.00 0.00 H new ATOM 0 HG21 VAL A 10 25.380 -0.524 -11.519 1.00 0.00 H new ATOM 0 HG22 VAL A 10 24.622 -1.801 -12.501 1.00 0.00 H new ATOM 0 HG23 VAL A 10 24.008 -1.452 -10.867 1.00 0.00 H new ATOM 164 N GLU A 11 26.359 -6.068 -10.773 1.00 0.00 N ATOM 165 CA GLU A 11 27.056 -7.186 -10.167 1.00 0.00 C ATOM 166 C GLU A 11 27.685 -8.061 -11.253 1.00 0.00 C ATOM 167 O GLU A 11 27.147 -8.159 -12.354 1.00 0.00 O ATOM 168 CB GLU A 11 26.047 -7.987 -9.332 1.00 0.00 C ATOM 169 CG GLU A 11 26.661 -9.259 -8.743 1.00 0.00 C ATOM 170 CD GLU A 11 27.797 -8.947 -7.768 1.00 0.00 C ATOM 171 OE1 GLU A 11 28.766 -9.735 -7.754 1.00 0.00 O ATOM 172 OE2 GLU A 11 27.675 -7.930 -7.051 1.00 0.00 O ATOM 0 H GLU A 11 26.062 -6.241 -11.733 1.00 0.00 H new ATOM 0 HA GLU A 11 27.859 -6.829 -9.522 1.00 0.00 H new ATOM 0 HB2 GLU A 11 25.669 -7.361 -8.524 1.00 0.00 H new ATOM 0 HB3 GLU A 11 25.193 -8.253 -9.955 1.00 0.00 H new ATOM 0 HG2 GLU A 11 25.888 -9.830 -8.229 1.00 0.00 H new ATOM 0 HG3 GLU A 11 27.038 -9.887 -9.550 1.00 0.00 H new ATOM 179 N ASP A 12 28.820 -8.698 -10.947 1.00 0.00 N ATOM 180 CA ASP A 12 29.500 -9.567 -11.901 1.00 0.00 C ATOM 181 C ASP A 12 29.405 -11.052 -11.519 1.00 0.00 C ATOM 182 O ASP A 12 29.516 -11.920 -12.382 1.00 0.00 O ATOM 183 CB ASP A 12 30.947 -9.098 -12.086 1.00 0.00 C ATOM 184 CG ASP A 12 31.783 -10.091 -12.889 1.00 0.00 C ATOM 185 OD1 ASP A 12 32.867 -10.464 -12.389 1.00 0.00 O ATOM 186 OD2 ASP A 12 31.331 -10.462 -13.997 1.00 0.00 O ATOM 0 H ASP A 12 29.285 -8.625 -10.042 1.00 0.00 H new ATOM 0 HA ASP A 12 28.989 -9.487 -12.861 1.00 0.00 H new ATOM 0 HB2 ASP A 12 30.951 -8.132 -12.591 1.00 0.00 H new ATOM 0 HB3 ASP A 12 31.405 -8.949 -11.108 1.00 0.00 H new ATOM 191 N GLU A 13 29.198 -11.352 -10.233 1.00 0.00 N ATOM 192 CA GLU A 13 29.033 -12.732 -9.794 1.00 0.00 C ATOM 193 C GLU A 13 27.614 -13.206 -10.138 1.00 0.00 C ATOM 194 O GLU A 13 26.655 -12.480 -9.887 1.00 0.00 O ATOM 195 CB GLU A 13 29.275 -12.816 -8.280 1.00 0.00 C ATOM 196 CG GLU A 13 29.240 -14.266 -7.782 1.00 0.00 C ATOM 197 CD GLU A 13 30.443 -15.085 -8.265 1.00 0.00 C ATOM 198 OE1 GLU A 13 30.479 -16.291 -7.930 1.00 0.00 O ATOM 199 OE2 GLU A 13 31.310 -14.510 -8.958 1.00 0.00 O ATOM 0 H GLU A 13 29.142 -10.660 -9.486 1.00 0.00 H new ATOM 0 HA GLU A 13 29.753 -13.374 -10.301 1.00 0.00 H new ATOM 0 HB2 GLU A 13 30.241 -12.372 -8.040 1.00 0.00 H new ATOM 0 HB3 GLU A 13 28.517 -12.233 -7.757 1.00 0.00 H new ATOM 0 HG2 GLU A 13 29.216 -14.271 -6.692 1.00 0.00 H new ATOM 0 HG3 GLU A 13 28.321 -14.742 -8.124 1.00 0.00 H new ATOM 206 N PRO A 14 27.461 -14.412 -10.705 1.00 0.00 N ATOM 207 CA PRO A 14 26.164 -14.944 -11.086 1.00 0.00 C ATOM 208 C PRO A 14 25.239 -15.091 -9.879 1.00 0.00 C ATOM 209 O PRO A 14 24.050 -14.790 -9.972 1.00 0.00 O ATOM 210 CB PRO A 14 26.445 -16.317 -11.707 1.00 0.00 C ATOM 211 CG PRO A 14 27.924 -16.271 -12.084 1.00 0.00 C ATOM 212 CD PRO A 14 28.532 -15.319 -11.060 1.00 0.00 C ATOM 0 HA PRO A 14 25.659 -14.273 -11.780 1.00 0.00 H new ATOM 0 HB2 PRO A 14 26.240 -17.121 -11.001 1.00 0.00 H new ATOM 0 HB3 PRO A 14 25.818 -16.493 -12.581 1.00 0.00 H new ATOM 0 HG2 PRO A 14 28.381 -17.259 -12.032 1.00 0.00 H new ATOM 0 HG3 PRO A 14 28.066 -15.907 -13.102 1.00 0.00 H new ATOM 0 HD2 PRO A 14 28.896 -15.860 -10.187 1.00 0.00 H new ATOM 0 HD3 PRO A 14 29.382 -14.780 -11.479 1.00 0.00 H new ATOM 220 N LEU A 15 25.784 -15.552 -8.749 1.00 0.00 N ATOM 221 CA LEU A 15 24.990 -15.854 -7.568 1.00 0.00 C ATOM 222 C LEU A 15 24.438 -14.585 -6.930 1.00 0.00 C ATOM 223 O LEU A 15 23.241 -14.505 -6.666 1.00 0.00 O ATOM 224 CB LEU A 15 25.853 -16.609 -6.555 1.00 0.00 C ATOM 225 CG LEU A 15 25.870 -18.107 -6.865 1.00 0.00 C ATOM 226 CD1 LEU A 15 26.952 -18.780 -6.029 1.00 0.00 C ATOM 227 CD2 LEU A 15 24.523 -18.733 -6.505 1.00 0.00 C ATOM 0 H LEU A 15 26.783 -15.723 -8.634 1.00 0.00 H new ATOM 0 HA LEU A 15 24.145 -16.472 -7.872 1.00 0.00 H new ATOM 0 HB2 LEU A 15 26.870 -16.218 -6.574 1.00 0.00 H new ATOM 0 HB3 LEU A 15 25.467 -16.446 -5.549 1.00 0.00 H new ATOM 0 HG LEU A 15 26.067 -18.245 -7.928 1.00 0.00 H new ATOM 0 HD11 LEU A 15 26.968 -19.848 -6.246 1.00 0.00 H new ATOM 0 HD12 LEU A 15 27.922 -18.346 -6.271 1.00 0.00 H new ATOM 0 HD13 LEU A 15 26.741 -18.628 -4.970 1.00 0.00 H new ATOM 0 HD21 LEU A 15 24.546 -19.799 -6.730 1.00 0.00 H new ATOM 0 HD22 LEU A 15 24.328 -18.590 -5.442 1.00 0.00 H new ATOM 0 HD23 LEU A 15 23.733 -18.257 -7.086 1.00 0.00 H new ATOM 239 N ILE A 16 25.286 -13.591 -6.676 1.00 0.00 N ATOM 240 CA ILE A 16 24.848 -12.397 -5.968 1.00 0.00 C ATOM 241 C ILE A 16 23.868 -11.608 -6.833 1.00 0.00 C ATOM 242 O ILE A 16 23.039 -10.867 -6.311 1.00 0.00 O ATOM 243 CB ILE A 16 26.070 -11.553 -5.574 1.00 0.00 C ATOM 244 CG1 ILE A 16 27.138 -12.413 -4.878 1.00 0.00 C ATOM 245 CG2 ILE A 16 25.636 -10.403 -4.658 1.00 0.00 C ATOM 246 CD1 ILE A 16 26.589 -13.153 -3.653 1.00 0.00 C ATOM 0 H ILE A 16 26.269 -13.590 -6.948 1.00 0.00 H new ATOM 0 HA ILE A 16 24.326 -12.679 -5.053 1.00 0.00 H new ATOM 0 HB ILE A 16 26.510 -11.143 -6.483 1.00 0.00 H new ATOM 0 HG12 ILE A 16 27.536 -13.138 -5.588 1.00 0.00 H new ATOM 0 HG13 ILE A 16 27.969 -11.777 -4.572 1.00 0.00 H new ATOM 0 HG21 ILE A 16 26.507 -9.809 -4.382 1.00 0.00 H new ATOM 0 HG22 ILE A 16 24.917 -9.772 -5.181 1.00 0.00 H new ATOM 0 HG23 ILE A 16 25.174 -10.809 -3.758 1.00 0.00 H new ATOM 0 HD11 ILE A 16 27.384 -13.745 -3.199 1.00 0.00 H new ATOM 0 HD12 ILE A 16 26.216 -12.430 -2.928 1.00 0.00 H new ATOM 0 HD13 ILE A 16 25.776 -13.811 -3.960 1.00 0.00 H new ATOM 258 N ALA A 17 23.952 -11.767 -8.157 1.00 0.00 N ATOM 259 CA ALA A 17 23.043 -11.098 -9.070 1.00 0.00 C ATOM 260 C ALA A 17 21.660 -11.747 -9.017 1.00 0.00 C ATOM 261 O ALA A 17 20.659 -11.043 -8.902 1.00 0.00 O ATOM 262 CB ALA A 17 23.617 -11.157 -10.486 1.00 0.00 C ATOM 0 H ALA A 17 24.646 -12.358 -8.615 1.00 0.00 H new ATOM 0 HA ALA A 17 22.934 -10.055 -8.774 1.00 0.00 H new ATOM 0 HB1 ALA A 17 22.937 -10.656 -11.175 1.00 0.00 H new ATOM 0 HB2 ALA A 17 24.587 -10.660 -10.507 1.00 0.00 H new ATOM 0 HB3 ALA A 17 23.737 -12.198 -10.787 1.00 0.00 H new ATOM 268 N MET A 18 21.593 -13.080 -9.098 1.00 0.00 N ATOM 269 CA MET A 18 20.309 -13.773 -9.127 1.00 0.00 C ATOM 270 C MET A 18 19.643 -13.734 -7.751 1.00 0.00 C ATOM 271 O MET A 18 18.420 -13.811 -7.656 1.00 0.00 O ATOM 272 CB MET A 18 20.499 -15.218 -9.604 1.00 0.00 C ATOM 273 CG MET A 18 21.340 -16.041 -8.627 1.00 0.00 C ATOM 274 SD MET A 18 21.453 -17.802 -9.043 1.00 0.00 S ATOM 275 CE MET A 18 22.401 -17.690 -10.588 1.00 0.00 C ATOM 0 H MET A 18 22.407 -13.693 -9.144 1.00 0.00 H new ATOM 0 HA MET A 18 19.652 -13.262 -9.831 1.00 0.00 H new ATOM 0 HB2 MET A 18 19.524 -15.689 -9.728 1.00 0.00 H new ATOM 0 HB3 MET A 18 20.979 -15.216 -10.582 1.00 0.00 H new ATOM 0 HG2 MET A 18 22.346 -15.623 -8.590 1.00 0.00 H new ATOM 0 HG3 MET A 18 20.916 -15.942 -7.628 1.00 0.00 H new ATOM 0 HE1 MET A 18 22.656 -18.692 -10.932 1.00 0.00 H new ATOM 0 HE2 MET A 18 21.801 -17.188 -11.347 1.00 0.00 H new ATOM 0 HE3 MET A 18 23.315 -17.122 -10.414 1.00 0.00 H new ATOM 285 N MET A 19 20.439 -13.614 -6.683 1.00 0.00 N ATOM 286 CA MET A 19 19.902 -13.518 -5.336 1.00 0.00 C ATOM 287 C MET A 19 19.233 -12.161 -5.120 1.00 0.00 C ATOM 288 O MET A 19 18.208 -12.078 -4.447 1.00 0.00 O ATOM 289 CB MET A 19 21.026 -13.728 -4.318 1.00 0.00 C ATOM 290 CG MET A 19 21.437 -15.202 -4.273 1.00 0.00 C ATOM 291 SD MET A 19 20.169 -16.326 -3.619 1.00 0.00 S ATOM 292 CE MET A 19 20.117 -15.764 -1.896 1.00 0.00 C ATOM 0 H MET A 19 21.457 -13.582 -6.733 1.00 0.00 H new ATOM 0 HA MET A 19 19.148 -14.293 -5.199 1.00 0.00 H new ATOM 0 HB2 MET A 19 21.885 -13.112 -4.583 1.00 0.00 H new ATOM 0 HB3 MET A 19 20.696 -13.406 -3.330 1.00 0.00 H new ATOM 0 HG2 MET A 19 21.701 -15.522 -5.281 1.00 0.00 H new ATOM 0 HG3 MET A 19 22.335 -15.296 -3.663 1.00 0.00 H new ATOM 0 HE1 MET A 19 20.111 -16.628 -1.231 1.00 0.00 H new ATOM 0 HE2 MET A 19 20.994 -15.151 -1.687 1.00 0.00 H new ATOM 0 HE3 MET A 19 19.215 -15.175 -1.733 1.00 0.00 H new ATOM 302 N LEU A 20 19.806 -11.098 -5.688 1.00 0.00 N ATOM 303 CA LEU A 20 19.245 -9.763 -5.557 1.00 0.00 C ATOM 304 C LEU A 20 17.989 -9.628 -6.419 1.00 0.00 C ATOM 305 O LEU A 20 17.060 -8.919 -6.048 1.00 0.00 O ATOM 306 CB LEU A 20 20.299 -8.736 -5.980 1.00 0.00 C ATOM 307 CG LEU A 20 21.390 -8.578 -4.915 1.00 0.00 C ATOM 308 CD1 LEU A 20 22.518 -7.716 -5.481 1.00 0.00 C ATOM 309 CD2 LEU A 20 20.835 -7.901 -3.665 1.00 0.00 C ATOM 0 H LEU A 20 20.660 -11.142 -6.243 1.00 0.00 H new ATOM 0 HA LEU A 20 18.963 -9.585 -4.519 1.00 0.00 H new ATOM 0 HB2 LEU A 20 20.751 -9.045 -6.922 1.00 0.00 H new ATOM 0 HB3 LEU A 20 19.820 -7.773 -6.157 1.00 0.00 H new ATOM 0 HG LEU A 20 21.759 -9.568 -4.646 1.00 0.00 H new ATOM 0 HD11 LEU A 20 23.299 -7.599 -4.729 1.00 0.00 H new ATOM 0 HD12 LEU A 20 22.935 -8.198 -6.365 1.00 0.00 H new ATOM 0 HD13 LEU A 20 22.126 -6.736 -5.753 1.00 0.00 H new ATOM 0 HD21 LEU A 20 21.628 -7.800 -2.924 1.00 0.00 H new ATOM 0 HD22 LEU A 20 20.453 -6.914 -3.925 1.00 0.00 H new ATOM 0 HD23 LEU A 20 20.027 -8.505 -3.252 1.00 0.00 H new ATOM 321 N GLU A 21 17.952 -10.313 -7.566 1.00 0.00 N ATOM 322 CA GLU A 21 16.783 -10.290 -8.438 1.00 0.00 C ATOM 323 C GLU A 21 15.621 -11.047 -7.797 1.00 0.00 C ATOM 324 O GLU A 21 14.459 -10.717 -8.036 1.00 0.00 O ATOM 325 CB GLU A 21 17.141 -10.915 -9.790 1.00 0.00 C ATOM 326 CG GLU A 21 18.107 -10.006 -10.560 1.00 0.00 C ATOM 327 CD GLU A 21 18.661 -10.689 -11.812 1.00 0.00 C ATOM 328 OE1 GLU A 21 18.303 -11.864 -12.047 1.00 0.00 O ATOM 329 OE2 GLU A 21 19.447 -10.021 -12.522 1.00 0.00 O ATOM 0 H GLU A 21 18.721 -10.889 -7.909 1.00 0.00 H new ATOM 0 HA GLU A 21 16.474 -9.256 -8.590 1.00 0.00 H new ATOM 0 HB2 GLU A 21 17.596 -11.893 -9.636 1.00 0.00 H new ATOM 0 HB3 GLU A 21 16.236 -11.073 -10.376 1.00 0.00 H new ATOM 0 HG2 GLU A 21 17.592 -9.089 -10.845 1.00 0.00 H new ATOM 0 HG3 GLU A 21 18.932 -9.719 -9.908 1.00 0.00 H new ATOM 336 N ASP A 22 15.927 -12.062 -6.984 1.00 0.00 N ATOM 337 CA ASP A 22 14.908 -12.858 -6.319 1.00 0.00 C ATOM 338 C ASP A 22 14.291 -12.075 -5.161 1.00 0.00 C ATOM 339 O ASP A 22 13.081 -12.135 -4.941 1.00 0.00 O ATOM 340 CB ASP A 22 15.547 -14.161 -5.830 1.00 0.00 C ATOM 341 CG ASP A 22 14.551 -15.064 -5.103 1.00 0.00 C ATOM 342 OD1 ASP A 22 13.337 -14.943 -5.386 1.00 0.00 O ATOM 343 OD2 ASP A 22 15.016 -15.872 -4.267 1.00 0.00 O ATOM 0 H ASP A 22 16.883 -12.349 -6.773 1.00 0.00 H new ATOM 0 HA ASP A 22 14.104 -13.093 -7.017 1.00 0.00 H new ATOM 0 HB2 ASP A 22 15.966 -14.698 -6.681 1.00 0.00 H new ATOM 0 HB3 ASP A 22 16.376 -13.927 -5.162 1.00 0.00 H new ATOM 348 N PHE A 23 15.118 -11.334 -4.414 1.00 0.00 N ATOM 349 CA PHE A 23 14.636 -10.559 -3.284 1.00 0.00 C ATOM 350 C PHE A 23 13.773 -9.356 -3.653 1.00 0.00 C ATOM 351 O PHE A 23 12.927 -8.938 -2.864 1.00 0.00 O ATOM 352 CB PHE A 23 15.785 -10.172 -2.353 1.00 0.00 C ATOM 353 CG PHE A 23 16.257 -11.299 -1.460 1.00 0.00 C ATOM 354 CD1 PHE A 23 17.600 -11.701 -1.490 1.00 0.00 C ATOM 355 CD2 PHE A 23 15.355 -11.937 -0.597 1.00 0.00 C ATOM 356 CE1 PHE A 23 18.038 -12.738 -0.658 1.00 0.00 C ATOM 357 CE2 PHE A 23 15.793 -12.978 0.234 1.00 0.00 C ATOM 358 CZ PHE A 23 17.134 -13.376 0.205 1.00 0.00 C ATOM 0 H PHE A 23 16.122 -11.260 -4.578 1.00 0.00 H new ATOM 0 HA PHE A 23 13.959 -11.223 -2.747 1.00 0.00 H new ATOM 0 HB2 PHE A 23 16.624 -9.822 -2.954 1.00 0.00 H new ATOM 0 HB3 PHE A 23 15.469 -9.336 -1.730 1.00 0.00 H new ATOM 0 HD1 PHE A 23 18.296 -11.211 -2.155 1.00 0.00 H new ATOM 0 HD2 PHE A 23 14.321 -11.626 -0.572 1.00 0.00 H new ATOM 0 HE1 PHE A 23 19.073 -13.047 -0.680 1.00 0.00 H new ATOM 0 HE2 PHE A 23 15.096 -13.472 0.895 1.00 0.00 H new ATOM 0 HZ PHE A 23 17.474 -14.175 0.847 1.00 0.00 H new ATOM 368 N LEU A 24 13.971 -8.793 -4.849 1.00 0.00 N ATOM 369 CA LEU A 24 13.148 -7.680 -5.288 1.00 0.00 C ATOM 370 C LEU A 24 11.748 -8.181 -5.633 1.00 0.00 C ATOM 371 O LEU A 24 10.763 -7.520 -5.320 1.00 0.00 O ATOM 372 CB LEU A 24 13.794 -7.014 -6.507 1.00 0.00 C ATOM 373 CG LEU A 24 15.072 -6.259 -6.124 1.00 0.00 C ATOM 374 CD1 LEU A 24 15.736 -5.735 -7.395 1.00 0.00 C ATOM 375 CD2 LEU A 24 14.750 -5.072 -5.218 1.00 0.00 C ATOM 0 H LEU A 24 14.684 -9.089 -5.516 1.00 0.00 H new ATOM 0 HA LEU A 24 13.069 -6.945 -4.487 1.00 0.00 H new ATOM 0 HB2 LEU A 24 14.028 -7.771 -7.255 1.00 0.00 H new ATOM 0 HB3 LEU A 24 13.085 -6.323 -6.964 1.00 0.00 H new ATOM 0 HG LEU A 24 15.735 -6.942 -5.592 1.00 0.00 H new ATOM 0 HD11 LEU A 24 16.647 -5.196 -7.134 1.00 0.00 H new ATOM 0 HD12 LEU A 24 15.984 -6.572 -8.048 1.00 0.00 H new ATOM 0 HD13 LEU A 24 15.052 -5.062 -7.912 1.00 0.00 H new ATOM 0 HD21 LEU A 24 15.672 -4.551 -4.959 1.00 0.00 H new ATOM 0 HD22 LEU A 24 14.081 -4.388 -5.739 1.00 0.00 H new ATOM 0 HD23 LEU A 24 14.267 -5.429 -4.308 1.00 0.00 H new ATOM 387 N GLU A 25 11.658 -9.345 -6.277 1.00 0.00 N ATOM 388 CA GLU A 25 10.381 -9.859 -6.741 1.00 0.00 C ATOM 389 C GLU A 25 9.491 -10.295 -5.575 1.00 0.00 C ATOM 390 O GLU A 25 8.273 -10.135 -5.642 1.00 0.00 O ATOM 391 CB GLU A 25 10.648 -11.019 -7.698 1.00 0.00 C ATOM 392 CG GLU A 25 9.340 -11.679 -8.146 1.00 0.00 C ATOM 393 CD GLU A 25 9.580 -12.781 -9.176 1.00 0.00 C ATOM 394 OE1 GLU A 25 10.748 -12.957 -9.585 1.00 0.00 O ATOM 395 OE2 GLU A 25 8.584 -13.444 -9.547 1.00 0.00 O ATOM 0 H GLU A 25 12.456 -9.945 -6.486 1.00 0.00 H new ATOM 0 HA GLU A 25 9.840 -9.069 -7.262 1.00 0.00 H new ATOM 0 HB2 GLU A 25 11.193 -10.657 -8.570 1.00 0.00 H new ATOM 0 HB3 GLU A 25 11.283 -11.758 -7.210 1.00 0.00 H new ATOM 0 HG2 GLU A 25 8.829 -12.098 -7.279 1.00 0.00 H new ATOM 0 HG3 GLU A 25 8.679 -10.923 -8.571 1.00 0.00 H new ATOM 402 N VAL A 26 10.084 -10.839 -4.506 1.00 0.00 N ATOM 403 CA VAL A 26 9.314 -11.265 -3.341 1.00 0.00 C ATOM 404 C VAL A 26 8.851 -10.069 -2.511 1.00 0.00 C ATOM 405 O VAL A 26 7.863 -10.163 -1.783 1.00 0.00 O ATOM 406 CB VAL A 26 10.129 -12.265 -2.512 1.00 0.00 C ATOM 407 CG1 VAL A 26 11.268 -11.568 -1.773 1.00 0.00 C ATOM 408 CG2 VAL A 26 9.235 -12.962 -1.490 1.00 0.00 C ATOM 0 H VAL A 26 11.089 -10.992 -4.427 1.00 0.00 H new ATOM 0 HA VAL A 26 8.411 -11.770 -3.683 1.00 0.00 H new ATOM 0 HB VAL A 26 10.546 -12.999 -3.202 1.00 0.00 H new ATOM 0 HG11 VAL A 26 11.829 -12.302 -1.194 1.00 0.00 H new ATOM 0 HG12 VAL A 26 11.932 -11.091 -2.494 1.00 0.00 H new ATOM 0 HG13 VAL A 26 10.858 -10.813 -1.103 1.00 0.00 H new ATOM 0 HG21 VAL A 26 9.828 -13.669 -0.910 1.00 0.00 H new ATOM 0 HG22 VAL A 26 8.799 -12.219 -0.822 1.00 0.00 H new ATOM 0 HG23 VAL A 26 8.439 -13.496 -2.008 1.00 0.00 H new ATOM 418 N LEU A 27 9.564 -8.943 -2.617 1.00 0.00 N ATOM 419 CA LEU A 27 9.154 -7.691 -1.999 1.00 0.00 C ATOM 420 C LEU A 27 8.164 -6.943 -2.895 1.00 0.00 C ATOM 421 O LEU A 27 7.887 -5.767 -2.663 1.00 0.00 O ATOM 422 CB LEU A 27 10.386 -6.824 -1.709 1.00 0.00 C ATOM 423 CG LEU A 27 11.257 -7.408 -0.597 1.00 0.00 C ATOM 424 CD1 LEU A 27 12.518 -6.556 -0.455 1.00 0.00 C ATOM 425 CD2 LEU A 27 10.505 -7.401 0.734 1.00 0.00 C ATOM 0 H LEU A 27 10.441 -8.880 -3.135 1.00 0.00 H new ATOM 0 HA LEU A 27 8.652 -7.913 -1.057 1.00 0.00 H new ATOM 0 HB2 LEU A 27 10.979 -6.724 -2.618 1.00 0.00 H new ATOM 0 HB3 LEU A 27 10.064 -5.822 -1.427 1.00 0.00 H new ATOM 0 HG LEU A 27 11.515 -8.435 -0.854 1.00 0.00 H new ATOM 0 HD11 LEU A 27 13.146 -6.965 0.336 1.00 0.00 H new ATOM 0 HD12 LEU A 27 13.069 -6.562 -1.395 1.00 0.00 H new ATOM 0 HD13 LEU A 27 12.239 -5.532 -0.205 1.00 0.00 H new ATOM 0 HD21 LEU A 27 11.141 -7.820 1.513 1.00 0.00 H new ATOM 0 HD22 LEU A 27 10.238 -6.377 0.996 1.00 0.00 H new ATOM 0 HD23 LEU A 27 9.599 -8.000 0.643 1.00 0.00 H new ATOM 437 N ASP A 28 7.632 -7.622 -3.920 1.00 0.00 N ATOM 438 CA ASP A 28 6.735 -7.019 -4.900 1.00 0.00 C ATOM 439 C ASP A 28 7.356 -5.836 -5.651 1.00 0.00 C ATOM 440 O ASP A 28 6.642 -4.983 -6.175 1.00 0.00 O ATOM 441 CB ASP A 28 5.370 -6.690 -4.274 1.00 0.00 C ATOM 442 CG ASP A 28 4.562 -7.942 -3.931 1.00 0.00 C ATOM 443 OD1 ASP A 28 3.462 -7.764 -3.358 1.00 0.00 O ATOM 444 OD2 ASP A 28 5.044 -9.054 -4.241 1.00 0.00 O ATOM 0 H ASP A 28 7.816 -8.611 -4.089 1.00 0.00 H new ATOM 0 HA ASP A 28 6.562 -7.769 -5.672 1.00 0.00 H new ATOM 0 HB2 ASP A 28 5.522 -6.101 -3.369 1.00 0.00 H new ATOM 0 HB3 ASP A 28 4.798 -6.071 -4.965 1.00 0.00 H new ATOM 449 N LYS A 29 8.688 -5.786 -5.695 1.00 0.00 N ATOM 450 CA LYS A 29 9.420 -4.753 -6.420 1.00 0.00 C ATOM 451 C LYS A 29 9.772 -5.260 -7.817 1.00 0.00 C ATOM 452 O LYS A 29 9.384 -6.365 -8.200 1.00 0.00 O ATOM 453 CB LYS A 29 10.678 -4.348 -5.642 1.00 0.00 C ATOM 454 CG LYS A 29 10.310 -3.887 -4.233 1.00 0.00 C ATOM 455 CD LYS A 29 11.538 -3.283 -3.544 1.00 0.00 C ATOM 456 CE LYS A 29 11.200 -2.895 -2.102 1.00 0.00 C ATOM 457 NZ LYS A 29 10.082 -1.928 -2.047 1.00 0.00 N ATOM 0 H LYS A 29 9.289 -6.464 -5.227 1.00 0.00 H new ATOM 0 HA LYS A 29 8.793 -3.867 -6.522 1.00 0.00 H new ATOM 0 HB2 LYS A 29 11.366 -5.192 -5.587 1.00 0.00 H new ATOM 0 HB3 LYS A 29 11.197 -3.547 -6.169 1.00 0.00 H new ATOM 0 HG2 LYS A 29 9.509 -3.149 -4.280 1.00 0.00 H new ATOM 0 HG3 LYS A 29 9.934 -4.729 -3.652 1.00 0.00 H new ATOM 0 HD2 LYS A 29 12.358 -4.001 -3.552 1.00 0.00 H new ATOM 0 HD3 LYS A 29 11.877 -2.405 -4.094 1.00 0.00 H new ATOM 0 HE2 LYS A 29 10.937 -3.789 -1.536 1.00 0.00 H new ATOM 0 HE3 LYS A 29 12.080 -2.463 -1.625 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 10.074 -1.459 -1.119 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 10.202 -1.215 -2.795 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 9.182 -2.429 -2.189 1.00 0.00 H new ATOM 471 N THR A 30 10.507 -4.451 -8.582 1.00 0.00 N ATOM 472 CA THR A 30 10.812 -4.747 -9.971 1.00 0.00 C ATOM 473 C THR A 30 12.295 -4.595 -10.296 1.00 0.00 C ATOM 474 O THR A 30 12.825 -3.482 -10.250 1.00 0.00 O ATOM 475 CB THR A 30 9.958 -3.860 -10.885 1.00 0.00 C ATOM 476 OG1 THR A 30 8.615 -3.857 -10.443 1.00 0.00 O ATOM 477 CG2 THR A 30 10.023 -4.347 -12.330 1.00 0.00 C ATOM 0 H THR A 30 10.905 -3.573 -8.250 1.00 0.00 H new ATOM 0 HA THR A 30 10.568 -5.795 -10.146 1.00 0.00 H new ATOM 0 HB THR A 30 10.355 -2.846 -10.842 1.00 0.00 H new ATOM 0 HG1 THR A 30 8.078 -3.287 -11.032 1.00 0.00 H new ATOM 0 HG21 THR A 30 9.409 -3.702 -12.959 1.00 0.00 H new ATOM 0 HG22 THR A 30 11.056 -4.317 -12.678 1.00 0.00 H new ATOM 0 HG23 THR A 30 9.650 -5.370 -12.386 1.00 0.00 H new ATOM 485 N PRO A 31 12.984 -5.697 -10.630 1.00 0.00 N ATOM 486 CA PRO A 31 14.334 -5.656 -11.159 1.00 0.00 C ATOM 487 C PRO A 31 14.275 -5.194 -12.616 1.00 0.00 C ATOM 488 O PRO A 31 14.096 -6.005 -13.522 1.00 0.00 O ATOM 489 CB PRO A 31 14.853 -7.091 -11.046 1.00 0.00 C ATOM 490 CG PRO A 31 13.588 -7.950 -11.125 1.00 0.00 C ATOM 491 CD PRO A 31 12.498 -7.062 -10.526 1.00 0.00 C ATOM 0 HA PRO A 31 14.988 -4.967 -10.625 1.00 0.00 H new ATOM 0 HB2 PRO A 31 15.548 -7.329 -11.852 1.00 0.00 H new ATOM 0 HB3 PRO A 31 15.386 -7.250 -10.108 1.00 0.00 H new ATOM 0 HG2 PRO A 31 13.357 -8.226 -12.154 1.00 0.00 H new ATOM 0 HG3 PRO A 31 13.700 -8.878 -10.564 1.00 0.00 H new ATOM 0 HD2 PRO A 31 11.558 -7.183 -11.065 1.00 0.00 H new ATOM 0 HD3 PRO A 31 12.306 -7.329 -9.487 1.00 0.00 H new ATOM 499 N VAL A 32 14.423 -3.885 -12.843 1.00 0.00 N ATOM 500 CA VAL A 32 14.265 -3.313 -14.177 1.00 0.00 C ATOM 501 C VAL A 32 15.463 -3.590 -15.081 1.00 0.00 C ATOM 502 O VAL A 32 15.421 -3.271 -16.270 1.00 0.00 O ATOM 503 CB VAL A 32 13.972 -1.810 -14.086 1.00 0.00 C ATOM 504 CG1 VAL A 32 12.826 -1.557 -13.115 1.00 0.00 C ATOM 505 CG2 VAL A 32 15.194 -1.021 -13.605 1.00 0.00 C ATOM 0 H VAL A 32 14.652 -3.205 -12.118 1.00 0.00 H new ATOM 0 HA VAL A 32 13.411 -3.807 -14.640 1.00 0.00 H new ATOM 0 HB VAL A 32 13.706 -1.474 -15.088 1.00 0.00 H new ATOM 0 HG11 VAL A 32 12.627 -0.487 -13.058 1.00 0.00 H new ATOM 0 HG12 VAL A 32 11.932 -2.075 -13.464 1.00 0.00 H new ATOM 0 HG13 VAL A 32 13.098 -1.928 -12.127 1.00 0.00 H new ATOM 0 HG21 VAL A 32 14.946 0.039 -13.554 1.00 0.00 H new ATOM 0 HG22 VAL A 32 15.488 -1.373 -12.616 1.00 0.00 H new ATOM 0 HG23 VAL A 32 16.019 -1.167 -14.302 1.00 0.00 H new ATOM 515 N GLY A 33 16.529 -4.181 -14.538 1.00 0.00 N ATOM 516 CA GLY A 33 17.678 -4.557 -15.339 1.00 0.00 C ATOM 517 C GLY A 33 18.912 -4.820 -14.486 1.00 0.00 C ATOM 518 O GLY A 33 18.959 -4.442 -13.315 1.00 0.00 O ATOM 0 H GLY A 33 16.613 -4.406 -13.547 1.00 0.00 H new ATOM 0 HA2 GLY A 33 17.440 -5.451 -15.916 1.00 0.00 H new ATOM 0 HA3 GLY A 33 17.895 -3.764 -16.055 1.00 0.00 H new ATOM 522 N THR A 34 19.906 -5.469 -15.096 1.00 0.00 N ATOM 523 CA THR A 34 21.178 -5.776 -14.462 1.00 0.00 C ATOM 524 C THR A 34 22.333 -5.611 -15.437 1.00 0.00 C ATOM 525 O THR A 34 22.226 -6.009 -16.598 1.00 0.00 O ATOM 526 CB THR A 34 21.157 -7.180 -13.844 1.00 0.00 C ATOM 527 OG1 THR A 34 19.953 -7.388 -13.139 1.00 0.00 O ATOM 528 CG2 THR A 34 22.348 -7.365 -12.905 1.00 0.00 C ATOM 0 H THR A 34 19.843 -5.799 -16.059 1.00 0.00 H new ATOM 0 HA THR A 34 21.333 -5.062 -13.653 1.00 0.00 H new ATOM 0 HB THR A 34 21.225 -7.912 -14.649 1.00 0.00 H new ATOM 0 HG1 THR A 34 19.777 -8.349 -13.069 1.00 0.00 H new ATOM 0 HG21 THR A 34 22.320 -8.366 -12.474 1.00 0.00 H new ATOM 0 HG22 THR A 34 23.275 -7.237 -13.464 1.00 0.00 H new ATOM 0 HG23 THR A 34 22.300 -6.625 -12.106 1.00 0.00 H new ATOM 536 N VAL A 35 23.435 -5.022 -14.970 1.00 0.00 N ATOM 537 CA VAL A 35 24.606 -4.767 -15.802 1.00 0.00 C ATOM 538 C VAL A 35 25.894 -5.122 -15.060 1.00 0.00 C ATOM 539 O VAL A 35 25.882 -5.287 -13.840 1.00 0.00 O ATOM 540 CB VAL A 35 24.602 -3.321 -16.308 1.00 0.00 C ATOM 541 CG1 VAL A 35 23.241 -2.935 -16.893 1.00 0.00 C ATOM 542 CG2 VAL A 35 24.906 -2.356 -15.168 1.00 0.00 C ATOM 0 H VAL A 35 23.538 -4.709 -14.005 1.00 0.00 H new ATOM 0 HA VAL A 35 24.561 -5.415 -16.677 1.00 0.00 H new ATOM 0 HB VAL A 35 25.366 -3.256 -17.082 1.00 0.00 H new ATOM 0 HG11 VAL A 35 23.274 -1.903 -17.242 1.00 0.00 H new ATOM 0 HG12 VAL A 35 23.004 -3.593 -17.729 1.00 0.00 H new ATOM 0 HG13 VAL A 35 22.474 -3.034 -16.125 1.00 0.00 H new ATOM 0 HG21 VAL A 35 24.899 -1.333 -15.545 1.00 0.00 H new ATOM 0 HG22 VAL A 35 24.149 -2.461 -14.391 1.00 0.00 H new ATOM 0 HG23 VAL A 35 25.888 -2.582 -14.752 1.00 0.00 H new ATOM 552 N ASP A 36 27.003 -5.234 -15.793 1.00 0.00 N ATOM 553 CA ASP A 36 28.287 -5.625 -15.223 1.00 0.00 C ATOM 554 C ASP A 36 29.431 -4.665 -15.554 1.00 0.00 C ATOM 555 O ASP A 36 30.583 -4.928 -15.203 1.00 0.00 O ATOM 556 CB ASP A 36 28.628 -7.078 -15.583 1.00 0.00 C ATOM 557 CG ASP A 36 28.411 -7.399 -17.063 1.00 0.00 C ATOM 558 OD1 ASP A 36 28.228 -6.447 -17.855 1.00 0.00 O ATOM 559 OD2 ASP A 36 28.432 -8.606 -17.392 1.00 0.00 O ATOM 0 H ASP A 36 27.033 -5.056 -16.797 1.00 0.00 H new ATOM 0 HA ASP A 36 28.172 -5.560 -14.141 1.00 0.00 H new ATOM 0 HB2 ASP A 36 29.668 -7.275 -15.324 1.00 0.00 H new ATOM 0 HB3 ASP A 36 28.016 -7.748 -14.979 1.00 0.00 H new ATOM 564 N THR A 37 29.117 -3.553 -16.230 1.00 0.00 N ATOM 565 CA THR A 37 30.086 -2.506 -16.550 1.00 0.00 C ATOM 566 C THR A 37 29.522 -1.111 -16.316 1.00 0.00 C ATOM 567 O THR A 37 28.306 -0.922 -16.324 1.00 0.00 O ATOM 568 CB THR A 37 30.645 -2.650 -17.972 1.00 0.00 C ATOM 569 OG1 THR A 37 29.742 -2.075 -18.892 1.00 0.00 O ATOM 570 CG2 THR A 37 30.891 -4.111 -18.352 1.00 0.00 C ATOM 0 H THR A 37 28.176 -3.356 -16.571 1.00 0.00 H new ATOM 0 HA THR A 37 30.919 -2.638 -15.860 1.00 0.00 H new ATOM 0 HB THR A 37 31.604 -2.133 -18.002 1.00 0.00 H new ATOM 0 HG1 THR A 37 30.099 -2.165 -19.800 1.00 0.00 H new ATOM 0 HG21 THR A 37 31.286 -4.161 -19.367 1.00 0.00 H new ATOM 0 HG22 THR A 37 31.610 -4.551 -17.660 1.00 0.00 H new ATOM 0 HG23 THR A 37 29.953 -4.663 -18.300 1.00 0.00 H new ATOM 578 N VAL A 38 30.402 -0.126 -16.108 1.00 0.00 N ATOM 579 CA VAL A 38 29.955 1.235 -15.843 1.00 0.00 C ATOM 580 C VAL A 38 29.345 1.906 -17.069 1.00 0.00 C ATOM 581 O VAL A 38 28.541 2.821 -16.933 1.00 0.00 O ATOM 582 CB VAL A 38 31.059 2.090 -15.208 1.00 0.00 C ATOM 583 CG1 VAL A 38 31.921 1.269 -14.251 1.00 0.00 C ATOM 584 CG2 VAL A 38 31.963 2.734 -16.258 1.00 0.00 C ATOM 0 H VAL A 38 31.415 -0.248 -16.119 1.00 0.00 H new ATOM 0 HA VAL A 38 29.152 1.154 -15.110 1.00 0.00 H new ATOM 0 HB VAL A 38 30.549 2.877 -14.653 1.00 0.00 H new ATOM 0 HG11 VAL A 38 32.693 1.906 -13.819 1.00 0.00 H new ATOM 0 HG12 VAL A 38 31.296 0.865 -13.454 1.00 0.00 H new ATOM 0 HG13 VAL A 38 32.390 0.449 -14.796 1.00 0.00 H new ATOM 0 HG21 VAL A 38 32.730 3.330 -15.762 1.00 0.00 H new ATOM 0 HG22 VAL A 38 32.438 1.956 -16.856 1.00 0.00 H new ATOM 0 HG23 VAL A 38 31.367 3.376 -16.906 1.00 0.00 H new ATOM 594 N ALA A 39 29.724 1.455 -18.266 1.00 0.00 N ATOM 595 CA ALA A 39 29.171 2.000 -19.494 1.00 0.00 C ATOM 596 C ALA A 39 27.698 1.621 -19.613 1.00 0.00 C ATOM 597 O ALA A 39 26.892 2.411 -20.106 1.00 0.00 O ATOM 598 CB ALA A 39 29.969 1.464 -20.682 1.00 0.00 C ATOM 0 H ALA A 39 30.411 0.714 -18.405 1.00 0.00 H new ATOM 0 HA ALA A 39 29.241 3.088 -19.483 1.00 0.00 H new ATOM 0 HB1 ALA A 39 29.560 1.869 -21.608 1.00 0.00 H new ATOM 0 HB2 ALA A 39 31.012 1.764 -20.585 1.00 0.00 H new ATOM 0 HB3 ALA A 39 29.905 0.376 -20.702 1.00 0.00 H new ATOM 604 N GLY A 40 27.344 0.417 -19.162 1.00 0.00 N ATOM 605 CA GLY A 40 25.966 -0.036 -19.173 1.00 0.00 C ATOM 606 C GLY A 40 25.204 0.532 -17.977 1.00 0.00 C ATOM 607 O GLY A 40 23.995 0.743 -18.058 1.00 0.00 O ATOM 0 H GLY A 40 28.004 -0.262 -18.783 1.00 0.00 H new ATOM 0 HA2 GLY A 40 25.483 0.274 -20.100 1.00 0.00 H new ATOM 0 HA3 GLY A 40 25.935 -1.125 -19.147 1.00 0.00 H new ATOM 611 N ALA A 41 25.905 0.784 -16.868 1.00 0.00 N ATOM 612 CA ALA A 41 25.281 1.319 -15.667 1.00 0.00 C ATOM 613 C ALA A 41 24.948 2.798 -15.837 1.00 0.00 C ATOM 614 O ALA A 41 23.906 3.251 -15.366 1.00 0.00 O ATOM 615 CB ALA A 41 26.226 1.106 -14.489 1.00 0.00 C ATOM 0 H ALA A 41 26.909 0.623 -16.783 1.00 0.00 H new ATOM 0 HA ALA A 41 24.343 0.796 -15.481 1.00 0.00 H new ATOM 0 HB1 ALA A 41 25.771 1.502 -13.581 1.00 0.00 H new ATOM 0 HB2 ALA A 41 26.417 0.040 -14.364 1.00 0.00 H new ATOM 0 HB3 ALA A 41 27.167 1.623 -14.679 1.00 0.00 H new ATOM 621 N LEU A 42 25.824 3.553 -16.506 1.00 0.00 N ATOM 622 CA LEU A 42 25.570 4.963 -16.772 1.00 0.00 C ATOM 623 C LEU A 42 24.476 5.104 -17.826 1.00 0.00 C ATOM 624 O LEU A 42 23.729 6.079 -17.817 1.00 0.00 O ATOM 625 CB LEU A 42 26.859 5.638 -17.249 1.00 0.00 C ATOM 626 CG LEU A 42 27.864 5.813 -16.106 1.00 0.00 C ATOM 627 CD1 LEU A 42 29.195 6.295 -16.677 1.00 0.00 C ATOM 628 CD2 LEU A 42 27.360 6.840 -15.090 1.00 0.00 C ATOM 0 H LEU A 42 26.712 3.208 -16.871 1.00 0.00 H new ATOM 0 HA LEU A 42 25.236 5.449 -15.855 1.00 0.00 H new ATOM 0 HB2 LEU A 42 27.310 5.041 -18.042 1.00 0.00 H new ATOM 0 HB3 LEU A 42 26.623 6.612 -17.678 1.00 0.00 H new ATOM 0 HG LEU A 42 27.989 4.853 -15.604 1.00 0.00 H new ATOM 0 HD11 LEU A 42 29.914 6.421 -15.867 1.00 0.00 H new ATOM 0 HD12 LEU A 42 29.574 5.560 -17.387 1.00 0.00 H new ATOM 0 HD13 LEU A 42 29.049 7.249 -17.185 1.00 0.00 H new ATOM 0 HD21 LEU A 42 28.090 6.947 -14.288 1.00 0.00 H new ATOM 0 HD22 LEU A 42 27.220 7.802 -15.584 1.00 0.00 H new ATOM 0 HD23 LEU A 42 26.410 6.504 -14.673 1.00 0.00 H new ATOM 640 N ALA A 43 24.375 4.129 -18.741 1.00 0.00 N ATOM 641 CA ALA A 43 23.340 4.141 -19.762 1.00 0.00 C ATOM 642 C ALA A 43 21.974 3.804 -19.161 1.00 0.00 C ATOM 643 O ALA A 43 20.949 4.221 -19.694 1.00 0.00 O ATOM 644 CB ALA A 43 23.712 3.135 -20.850 1.00 0.00 C ATOM 0 H ALA A 43 25.002 3.326 -18.787 1.00 0.00 H new ATOM 0 HA ALA A 43 23.270 5.140 -20.193 1.00 0.00 H new ATOM 0 HB1 ALA A 43 22.943 3.134 -21.623 1.00 0.00 H new ATOM 0 HB2 ALA A 43 24.669 3.413 -21.291 1.00 0.00 H new ATOM 0 HB3 ALA A 43 23.789 2.139 -20.414 1.00 0.00 H new ATOM 650 N ARG A 44 21.959 3.054 -18.054 1.00 0.00 N ATOM 651 CA ARG A 44 20.721 2.673 -17.385 1.00 0.00 C ATOM 652 C ARG A 44 20.247 3.741 -16.406 1.00 0.00 C ATOM 653 O ARG A 44 19.058 4.054 -16.372 1.00 0.00 O ATOM 654 CB ARG A 44 20.925 1.338 -16.663 1.00 0.00 C ATOM 655 CG ARG A 44 20.839 0.151 -17.628 1.00 0.00 C ATOM 656 CD ARG A 44 19.431 0.049 -18.214 1.00 0.00 C ATOM 657 NE ARG A 44 19.231 -1.245 -18.877 1.00 0.00 N ATOM 658 CZ ARG A 44 18.209 -2.068 -18.628 1.00 0.00 C ATOM 659 NH1 ARG A 44 17.267 -1.739 -17.743 1.00 0.00 N ATOM 660 NH2 ARG A 44 18.122 -3.230 -19.267 1.00 0.00 N ATOM 0 H ARG A 44 22.802 2.698 -17.603 1.00 0.00 H new ATOM 0 HA ARG A 44 19.944 2.569 -18.143 1.00 0.00 H new ATOM 0 HB2 ARG A 44 21.897 1.336 -16.170 1.00 0.00 H new ATOM 0 HB3 ARG A 44 20.172 1.228 -15.883 1.00 0.00 H new ATOM 0 HG2 ARG A 44 21.567 0.272 -18.430 1.00 0.00 H new ATOM 0 HG3 ARG A 44 21.091 -0.771 -17.105 1.00 0.00 H new ATOM 0 HD2 ARG A 44 18.693 0.174 -17.421 1.00 0.00 H new ATOM 0 HD3 ARG A 44 19.271 0.857 -18.928 1.00 0.00 H new ATOM 0 HE ARG A 44 19.917 -1.535 -19.574 1.00 0.00 H new ATOM 0 HH11 ARG A 44 17.322 -0.849 -17.247 1.00 0.00 H new ATOM 0 HH12 ARG A 44 16.492 -2.377 -17.562 1.00 0.00 H new ATOM 0 HH21 ARG A 44 18.835 -3.493 -19.947 1.00 0.00 H new ATOM 0 HH22 ARG A 44 17.342 -3.859 -19.077 1.00 0.00 H new ATOM 674 N VAL A 45 21.159 4.305 -15.611 1.00 0.00 N ATOM 675 CA VAL A 45 20.785 5.293 -14.604 1.00 0.00 C ATOM 676 C VAL A 45 20.316 6.609 -15.232 1.00 0.00 C ATOM 677 O VAL A 45 19.497 7.316 -14.643 1.00 0.00 O ATOM 678 CB VAL A 45 21.945 5.509 -13.625 1.00 0.00 C ATOM 679 CG1 VAL A 45 23.054 6.351 -14.258 1.00 0.00 C ATOM 680 CG2 VAL A 45 21.456 6.228 -12.372 1.00 0.00 C ATOM 0 H VAL A 45 22.156 4.094 -15.647 1.00 0.00 H new ATOM 0 HA VAL A 45 19.933 4.903 -14.047 1.00 0.00 H new ATOM 0 HB VAL A 45 22.338 4.526 -13.367 1.00 0.00 H new ATOM 0 HG11 VAL A 45 23.863 6.487 -13.540 1.00 0.00 H new ATOM 0 HG12 VAL A 45 23.437 5.843 -15.143 1.00 0.00 H new ATOM 0 HG13 VAL A 45 22.654 7.324 -14.543 1.00 0.00 H new ATOM 0 HG21 VAL A 45 22.291 6.374 -11.687 1.00 0.00 H new ATOM 0 HG22 VAL A 45 21.039 7.197 -12.648 1.00 0.00 H new ATOM 0 HG23 VAL A 45 20.688 5.628 -11.885 1.00 0.00 H new ATOM 690 N GLU A 46 20.822 6.936 -16.423 1.00 0.00 N ATOM 691 CA GLU A 46 20.433 8.156 -17.121 1.00 0.00 C ATOM 692 C GLU A 46 19.095 7.989 -17.845 1.00 0.00 C ATOM 693 O GLU A 46 18.487 8.976 -18.250 1.00 0.00 O ATOM 694 CB GLU A 46 21.531 8.550 -18.111 1.00 0.00 C ATOM 695 CG GLU A 46 22.792 9.012 -17.377 1.00 0.00 C ATOM 696 CD GLU A 46 22.595 10.337 -16.639 1.00 0.00 C ATOM 697 OE1 GLU A 46 21.547 10.990 -16.862 1.00 0.00 O ATOM 698 OE2 GLU A 46 23.503 10.690 -15.855 1.00 0.00 O ATOM 0 H GLU A 46 21.505 6.368 -16.923 1.00 0.00 H new ATOM 0 HA GLU A 46 20.306 8.948 -16.383 1.00 0.00 H new ATOM 0 HB2 GLU A 46 21.769 7.701 -18.752 1.00 0.00 H new ATOM 0 HB3 GLU A 46 21.171 9.348 -18.760 1.00 0.00 H new ATOM 0 HG2 GLU A 46 23.093 8.245 -16.664 1.00 0.00 H new ATOM 0 HG3 GLU A 46 23.606 9.118 -18.094 1.00 0.00 H new ATOM 705 N ASP A 47 18.634 6.744 -18.012 1.00 0.00 N ATOM 706 CA ASP A 47 17.362 6.474 -18.672 1.00 0.00 C ATOM 707 C ASP A 47 16.223 6.952 -17.762 1.00 0.00 C ATOM 708 O ASP A 47 15.107 7.183 -18.228 1.00 0.00 O ATOM 709 CB ASP A 47 17.250 4.964 -18.915 1.00 0.00 C ATOM 710 CG ASP A 47 16.075 4.610 -19.827 1.00 0.00 C ATOM 711 OD1 ASP A 47 15.660 3.432 -19.786 1.00 0.00 O ATOM 712 OD2 ASP A 47 15.602 5.514 -20.553 1.00 0.00 O ATOM 0 H ASP A 47 19.128 5.909 -17.697 1.00 0.00 H new ATOM 0 HA ASP A 47 17.301 6.998 -19.626 1.00 0.00 H new ATOM 0 HB2 ASP A 47 18.176 4.600 -19.361 1.00 0.00 H new ATOM 0 HB3 ASP A 47 17.133 4.452 -17.960 1.00 0.00 H new ATOM 717 N GLY A 48 16.507 7.101 -16.465 1.00 0.00 N ATOM 718 CA GLY A 48 15.543 7.586 -15.492 1.00 0.00 C ATOM 719 C GLY A 48 14.451 6.554 -15.213 1.00 0.00 C ATOM 720 O GLY A 48 14.505 5.426 -15.706 1.00 0.00 O ATOM 0 H GLY A 48 17.420 6.885 -16.065 1.00 0.00 H new ATOM 0 HA2 GLY A 48 16.057 7.832 -14.563 1.00 0.00 H new ATOM 0 HA3 GLY A 48 15.088 8.506 -15.858 1.00 0.00 H new ATOM 724 N GLY A 49 13.460 6.950 -14.410 1.00 0.00 N ATOM 725 CA GLY A 49 12.348 6.087 -14.035 1.00 0.00 C ATOM 726 C GLY A 49 12.752 5.072 -12.967 1.00 0.00 C ATOM 727 O GLY A 49 11.911 4.311 -12.492 1.00 0.00 O ATOM 0 H GLY A 49 13.411 7.884 -14.002 1.00 0.00 H new ATOM 0 HA2 GLY A 49 11.524 6.697 -13.664 1.00 0.00 H new ATOM 0 HA3 GLY A 49 11.983 5.561 -14.917 1.00 0.00 H new ATOM 731 N ILE A 50 14.037 5.058 -12.588 1.00 0.00 N ATOM 732 CA ILE A 50 14.550 4.153 -11.570 1.00 0.00 C ATOM 733 C ILE A 50 14.462 4.825 -10.200 1.00 0.00 C ATOM 734 O ILE A 50 14.699 6.027 -10.081 1.00 0.00 O ATOM 735 CB ILE A 50 15.989 3.755 -11.917 1.00 0.00 C ATOM 736 CG1 ILE A 50 16.024 3.071 -13.293 1.00 0.00 C ATOM 737 CG2 ILE A 50 16.546 2.809 -10.851 1.00 0.00 C ATOM 738 CD1 ILE A 50 17.462 2.944 -13.804 1.00 0.00 C ATOM 0 H ILE A 50 14.745 5.677 -12.983 1.00 0.00 H new ATOM 0 HA ILE A 50 13.950 3.243 -11.537 1.00 0.00 H new ATOM 0 HB ILE A 50 16.606 4.653 -11.948 1.00 0.00 H new ATOM 0 HG12 ILE A 50 15.570 2.083 -13.224 1.00 0.00 H new ATOM 0 HG13 ILE A 50 15.430 3.645 -14.004 1.00 0.00 H new ATOM 0 HG21 ILE A 50 17.569 2.533 -11.108 1.00 0.00 H new ATOM 0 HG22 ILE A 50 16.537 3.308 -9.882 1.00 0.00 H new ATOM 0 HG23 ILE A 50 15.929 1.912 -10.803 1.00 0.00 H new ATOM 0 HD11 ILE A 50 17.460 2.457 -14.779 1.00 0.00 H new ATOM 0 HD12 ILE A 50 17.905 3.936 -13.895 1.00 0.00 H new ATOM 0 HD13 ILE A 50 18.046 2.349 -13.102 1.00 0.00 H new ATOM 750 N ASP A 51 14.124 4.054 -9.165 1.00 0.00 N ATOM 751 CA ASP A 51 13.929 4.582 -7.821 1.00 0.00 C ATOM 752 C ASP A 51 15.184 4.393 -6.971 1.00 0.00 C ATOM 753 O ASP A 51 15.430 5.187 -6.068 1.00 0.00 O ATOM 754 CB ASP A 51 12.750 3.854 -7.164 1.00 0.00 C ATOM 755 CG ASP A 51 11.466 3.942 -7.990 1.00 0.00 C ATOM 756 OD1 ASP A 51 11.361 4.880 -8.814 1.00 0.00 O ATOM 757 OD2 ASP A 51 10.603 3.063 -7.787 1.00 0.00 O ATOM 0 H ASP A 51 13.979 3.047 -9.239 1.00 0.00 H new ATOM 0 HA ASP A 51 13.722 5.650 -7.890 1.00 0.00 H new ATOM 0 HB2 ASP A 51 13.012 2.806 -7.018 1.00 0.00 H new ATOM 0 HB3 ASP A 51 12.571 4.279 -6.176 1.00 0.00 H new ATOM 762 N ALA A 52 15.975 3.351 -7.249 1.00 0.00 N ATOM 763 CA ALA A 52 17.203 3.069 -6.518 1.00 0.00 C ATOM 764 C ALA A 52 18.087 2.110 -7.321 1.00 0.00 C ATOM 765 O ALA A 52 17.660 1.576 -8.343 1.00 0.00 O ATOM 766 CB ALA A 52 16.858 2.456 -5.159 1.00 0.00 C ATOM 0 H ALA A 52 15.776 2.680 -7.991 1.00 0.00 H new ATOM 0 HA ALA A 52 17.751 3.998 -6.364 1.00 0.00 H new ATOM 0 HB1 ALA A 52 17.776 2.245 -4.611 1.00 0.00 H new ATOM 0 HB2 ALA A 52 16.248 3.156 -4.588 1.00 0.00 H new ATOM 0 HB3 ALA A 52 16.303 1.530 -5.308 1.00 0.00 H new ATOM 772 N ALA A 53 19.320 1.889 -6.861 1.00 0.00 N ATOM 773 CA ALA A 53 20.229 0.977 -7.541 1.00 0.00 C ATOM 774 C ALA A 53 21.201 0.334 -6.554 1.00 0.00 C ATOM 775 O ALA A 53 21.304 0.759 -5.403 1.00 0.00 O ATOM 776 CB ALA A 53 20.986 1.738 -8.631 1.00 0.00 C ATOM 0 H ALA A 53 19.706 2.328 -6.025 1.00 0.00 H new ATOM 0 HA ALA A 53 19.650 0.175 -7.999 1.00 0.00 H new ATOM 0 HB1 ALA A 53 21.668 1.059 -9.143 1.00 0.00 H new ATOM 0 HB2 ALA A 53 20.276 2.148 -9.349 1.00 0.00 H new ATOM 0 HB3 ALA A 53 21.555 2.551 -8.179 1.00 0.00 H new ATOM 782 N ILE A 54 21.916 -0.696 -7.011 1.00 0.00 N ATOM 783 CA ILE A 54 22.903 -1.408 -6.206 1.00 0.00 C ATOM 784 C ILE A 54 24.204 -1.528 -7.001 1.00 0.00 C ATOM 785 O ILE A 54 24.165 -1.703 -8.218 1.00 0.00 O ATOM 786 CB ILE A 54 22.358 -2.782 -5.786 1.00 0.00 C ATOM 787 CG1 ILE A 54 20.925 -2.646 -5.246 1.00 0.00 C ATOM 788 CG2 ILE A 54 23.276 -3.392 -4.721 1.00 0.00 C ATOM 789 CD1 ILE A 54 20.371 -3.988 -4.757 1.00 0.00 C ATOM 0 H ILE A 54 21.823 -1.060 -7.959 1.00 0.00 H new ATOM 0 HA ILE A 54 23.110 -0.853 -5.291 1.00 0.00 H new ATOM 0 HB ILE A 54 22.334 -3.439 -6.655 1.00 0.00 H new ATOM 0 HG12 ILE A 54 20.912 -1.927 -4.427 1.00 0.00 H new ATOM 0 HG13 ILE A 54 20.278 -2.249 -6.028 1.00 0.00 H new ATOM 0 HG21 ILE A 54 22.890 -4.367 -4.423 1.00 0.00 H new ATOM 0 HG22 ILE A 54 24.280 -3.509 -5.130 1.00 0.00 H new ATOM 0 HG23 ILE A 54 23.312 -2.735 -3.852 1.00 0.00 H new ATOM 0 HD11 ILE A 54 19.357 -3.848 -4.383 1.00 0.00 H new ATOM 0 HD12 ILE A 54 20.359 -4.699 -5.583 1.00 0.00 H new ATOM 0 HD13 ILE A 54 21.003 -4.372 -3.956 1.00 0.00 H new ATOM 801 N LEU A 55 25.357 -1.429 -6.328 1.00 0.00 N ATOM 802 CA LEU A 55 26.650 -1.378 -7.000 1.00 0.00 C ATOM 803 C LEU A 55 27.687 -2.282 -6.334 1.00 0.00 C ATOM 804 O LEU A 55 27.928 -2.174 -5.133 1.00 0.00 O ATOM 805 CB LEU A 55 27.136 0.074 -7.021 1.00 0.00 C ATOM 806 CG LEU A 55 28.479 0.212 -7.754 1.00 0.00 C ATOM 807 CD1 LEU A 55 28.344 -0.204 -9.216 1.00 0.00 C ATOM 808 CD2 LEU A 55 28.932 1.666 -7.700 1.00 0.00 C ATOM 0 H LEU A 55 25.415 -1.383 -5.311 1.00 0.00 H new ATOM 0 HA LEU A 55 26.524 -1.749 -8.017 1.00 0.00 H new ATOM 0 HB2 LEU A 55 26.389 0.701 -7.508 1.00 0.00 H new ATOM 0 HB3 LEU A 55 27.240 0.438 -5.999 1.00 0.00 H new ATOM 0 HG LEU A 55 29.207 -0.436 -7.266 1.00 0.00 H new ATOM 0 HD11 LEU A 55 29.307 -0.098 -9.715 1.00 0.00 H new ATOM 0 HD12 LEU A 55 28.020 -1.243 -9.270 1.00 0.00 H new ATOM 0 HD13 LEU A 55 27.608 0.432 -9.709 1.00 0.00 H new ATOM 0 HD21 LEU A 55 29.885 1.770 -8.219 1.00 0.00 H new ATOM 0 HD22 LEU A 55 28.186 2.298 -8.182 1.00 0.00 H new ATOM 0 HD23 LEU A 55 29.050 1.972 -6.660 1.00 0.00 H new ATOM 820 N ASP A 56 28.301 -3.167 -7.118 1.00 0.00 N ATOM 821 CA ASP A 56 29.379 -4.023 -6.651 1.00 0.00 C ATOM 822 C ASP A 56 30.667 -3.201 -6.539 1.00 0.00 C ATOM 823 O ASP A 56 30.928 -2.342 -7.380 1.00 0.00 O ATOM 824 CB ASP A 56 29.525 -5.188 -7.632 1.00 0.00 C ATOM 825 CG ASP A 56 30.571 -6.222 -7.215 1.00 0.00 C ATOM 826 OD1 ASP A 56 31.160 -6.065 -6.123 1.00 0.00 O ATOM 827 OD2 ASP A 56 30.768 -7.167 -8.010 1.00 0.00 O ATOM 0 H ASP A 56 28.060 -3.307 -8.099 1.00 0.00 H new ATOM 0 HA ASP A 56 29.163 -4.428 -5.662 1.00 0.00 H new ATOM 0 HB2 ASP A 56 28.560 -5.684 -7.738 1.00 0.00 H new ATOM 0 HB3 ASP A 56 29.790 -4.793 -8.613 1.00 0.00 H new ATOM 832 N VAL A 57 31.473 -3.455 -5.504 1.00 0.00 N ATOM 833 CA VAL A 57 32.701 -2.704 -5.251 1.00 0.00 C ATOM 834 C VAL A 57 33.667 -2.869 -6.418 1.00 0.00 C ATOM 835 O VAL A 57 34.391 -1.931 -6.756 1.00 0.00 O ATOM 836 CB VAL A 57 33.342 -3.215 -3.959 1.00 0.00 C ATOM 837 CG1 VAL A 57 34.688 -2.543 -3.705 1.00 0.00 C ATOM 838 CG2 VAL A 57 32.427 -2.919 -2.771 1.00 0.00 C ATOM 0 H VAL A 57 31.290 -4.188 -4.819 1.00 0.00 H new ATOM 0 HA VAL A 57 32.466 -1.645 -5.146 1.00 0.00 H new ATOM 0 HB VAL A 57 33.492 -4.289 -4.069 1.00 0.00 H new ATOM 0 HG11 VAL A 57 35.118 -2.927 -2.780 1.00 0.00 H new ATOM 0 HG12 VAL A 57 35.363 -2.755 -4.534 1.00 0.00 H new ATOM 0 HG13 VAL A 57 34.546 -1.466 -3.619 1.00 0.00 H new ATOM 0 HG21 VAL A 57 32.890 -3.286 -1.855 1.00 0.00 H new ATOM 0 HG22 VAL A 57 32.269 -1.843 -2.692 1.00 0.00 H new ATOM 0 HG23 VAL A 57 31.468 -3.417 -2.917 1.00 0.00 H new ATOM 848 N ASN A 58 33.680 -4.053 -7.036 1.00 0.00 N ATOM 849 CA ASN A 58 34.541 -4.323 -8.175 1.00 0.00 C ATOM 850 C ASN A 58 33.721 -5.003 -9.269 1.00 0.00 C ATOM 851 O ASN A 58 33.188 -6.094 -9.065 1.00 0.00 O ATOM 852 CB ASN A 58 35.713 -5.216 -7.747 1.00 0.00 C ATOM 853 CG ASN A 58 36.555 -4.578 -6.650 1.00 0.00 C ATOM 854 OD1 ASN A 58 36.930 -3.414 -6.742 1.00 0.00 O ATOM 855 ND2 ASN A 58 36.855 -5.340 -5.600 1.00 0.00 N ATOM 0 H ASN A 58 33.096 -4.842 -6.758 1.00 0.00 H new ATOM 0 HA ASN A 58 34.947 -3.388 -8.560 1.00 0.00 H new ATOM 0 HB2 ASN A 58 35.328 -6.173 -7.396 1.00 0.00 H new ATOM 0 HB3 ASN A 58 36.343 -5.423 -8.612 1.00 0.00 H new ATOM 0 HD21 ASN A 58 37.415 -4.959 -4.837 1.00 0.00 H new ATOM 0 HD22 ASN A 58 36.525 -6.304 -5.559 1.00 0.00 H new ATOM 862 N LEU A 59 33.623 -4.354 -10.431 1.00 0.00 N ATOM 863 CA LEU A 59 32.864 -4.882 -11.552 1.00 0.00 C ATOM 864 C LEU A 59 33.704 -5.898 -12.317 1.00 0.00 C ATOM 865 O LEU A 59 34.807 -6.254 -11.896 1.00 0.00 O ATOM 866 CB LEU A 59 32.423 -3.723 -12.455 1.00 0.00 C ATOM 867 CG LEU A 59 31.051 -3.180 -12.037 1.00 0.00 C ATOM 868 CD1 LEU A 59 30.988 -2.870 -10.543 1.00 0.00 C ATOM 869 CD2 LEU A 59 30.770 -1.892 -12.806 1.00 0.00 C ATOM 0 H LEU A 59 34.067 -3.454 -10.615 1.00 0.00 H new ATOM 0 HA LEU A 59 31.973 -5.395 -11.190 1.00 0.00 H new ATOM 0 HB2 LEU A 59 33.162 -2.923 -12.410 1.00 0.00 H new ATOM 0 HB3 LEU A 59 32.382 -4.061 -13.490 1.00 0.00 H new ATOM 0 HG LEU A 59 30.310 -3.947 -12.261 1.00 0.00 H new ATOM 0 HD11 LEU A 59 29.998 -2.488 -10.292 1.00 0.00 H new ATOM 0 HD12 LEU A 59 31.181 -3.780 -9.974 1.00 0.00 H new ATOM 0 HD13 LEU A 59 31.740 -2.121 -10.295 1.00 0.00 H new ATOM 0 HD21 LEU A 59 29.796 -1.499 -12.514 1.00 0.00 H new ATOM 0 HD22 LEU A 59 31.541 -1.156 -12.577 1.00 0.00 H new ATOM 0 HD23 LEU A 59 30.772 -2.099 -13.876 1.00 0.00 H new ATOM 881 N ARG A 60 33.173 -6.361 -13.448 1.00 0.00 N ATOM 882 CA ARG A 60 33.807 -7.392 -14.254 1.00 0.00 C ATOM 883 C ARG A 60 35.242 -7.003 -14.595 1.00 0.00 C ATOM 884 O ARG A 60 35.529 -5.841 -14.878 1.00 0.00 O ATOM 885 CB ARG A 60 32.960 -7.605 -15.507 1.00 0.00 C ATOM 886 CG ARG A 60 33.374 -8.879 -16.240 1.00 0.00 C ATOM 887 CD ARG A 60 32.253 -9.281 -17.193 1.00 0.00 C ATOM 888 NE ARG A 60 32.605 -10.495 -17.940 1.00 0.00 N ATOM 889 CZ ARG A 60 32.464 -11.738 -17.466 1.00 0.00 C ATOM 890 NH1 ARG A 60 31.993 -11.951 -16.240 1.00 0.00 N ATOM 891 NH2 ARG A 60 32.797 -12.776 -18.223 1.00 0.00 N ATOM 0 H ARG A 60 32.287 -6.027 -13.829 1.00 0.00 H new ATOM 0 HA ARG A 60 33.864 -8.328 -13.698 1.00 0.00 H new ATOM 0 HB2 ARG A 60 31.907 -7.666 -15.232 1.00 0.00 H new ATOM 0 HB3 ARG A 60 33.067 -6.748 -16.172 1.00 0.00 H new ATOM 0 HG2 ARG A 60 34.299 -8.713 -16.793 1.00 0.00 H new ATOM 0 HG3 ARG A 60 33.568 -9.679 -15.526 1.00 0.00 H new ATOM 0 HD2 ARG A 60 31.335 -9.450 -16.629 1.00 0.00 H new ATOM 0 HD3 ARG A 60 32.054 -8.467 -17.889 1.00 0.00 H new ATOM 0 HE ARG A 60 32.981 -10.383 -18.881 1.00 0.00 H new ATOM 0 HH11 ARG A 60 31.734 -11.161 -15.649 1.00 0.00 H new ATOM 0 HH12 ARG A 60 31.891 -12.904 -15.891 1.00 0.00 H new ATOM 0 HH21 ARG A 60 33.160 -12.625 -19.164 1.00 0.00 H new ATOM 0 HH22 ARG A 60 32.690 -13.725 -17.863 1.00 0.00 H new ATOM 905 N GLY A 61 36.141 -7.988 -14.566 1.00 0.00 N ATOM 906 CA GLY A 61 37.570 -7.757 -14.726 1.00 0.00 C ATOM 907 C GLY A 61 38.238 -7.482 -13.376 1.00 0.00 C ATOM 908 O GLY A 61 39.460 -7.344 -13.305 1.00 0.00 O ATOM 0 H GLY A 61 35.894 -8.968 -14.430 1.00 0.00 H new ATOM 0 HA2 GLY A 61 38.032 -8.626 -15.194 1.00 0.00 H new ATOM 0 HA3 GLY A 61 37.732 -6.912 -15.395 1.00 0.00 H new ATOM 912 N GLY A 62 37.440 -7.399 -12.306 1.00 0.00 N ATOM 913 CA GLY A 62 37.936 -7.209 -10.949 1.00 0.00 C ATOM 914 C GLY A 62 38.354 -5.765 -10.676 1.00 0.00 C ATOM 915 O GLY A 62 38.865 -5.471 -9.595 1.00 0.00 O ATOM 0 H GLY A 62 36.424 -7.463 -12.364 1.00 0.00 H new ATOM 0 HA2 GLY A 62 37.162 -7.500 -10.239 1.00 0.00 H new ATOM 0 HA3 GLY A 62 38.788 -7.868 -10.781 1.00 0.00 H new ATOM 919 N GLU A 63 38.144 -4.862 -11.638 1.00 0.00 N ATOM 920 CA GLU A 63 38.534 -3.465 -11.489 1.00 0.00 C ATOM 921 C GLU A 63 37.538 -2.715 -10.597 1.00 0.00 C ATOM 922 O GLU A 63 36.336 -2.977 -10.643 1.00 0.00 O ATOM 923 CB GLU A 63 38.636 -2.820 -12.874 1.00 0.00 C ATOM 924 CG GLU A 63 39.070 -1.355 -12.760 1.00 0.00 C ATOM 925 CD GLU A 63 39.277 -0.711 -14.130 1.00 0.00 C ATOM 926 OE1 GLU A 63 39.145 -1.430 -15.144 1.00 0.00 O ATOM 927 OE2 GLU A 63 39.571 0.509 -14.150 1.00 0.00 O ATOM 0 H GLU A 63 37.703 -5.080 -12.532 1.00 0.00 H new ATOM 0 HA GLU A 63 39.508 -3.410 -11.003 1.00 0.00 H new ATOM 0 HB2 GLU A 63 39.352 -3.370 -13.485 1.00 0.00 H new ATOM 0 HB3 GLU A 63 37.673 -2.880 -13.380 1.00 0.00 H new ATOM 0 HG2 GLU A 63 38.316 -0.795 -12.207 1.00 0.00 H new ATOM 0 HG3 GLU A 63 39.996 -1.295 -12.187 1.00 0.00 H new ATOM 934 N LYS A 64 38.048 -1.782 -9.784 1.00 0.00 N ATOM 935 CA LYS A 64 37.226 -0.960 -8.906 1.00 0.00 C ATOM 936 C LYS A 64 36.411 0.034 -9.723 1.00 0.00 C ATOM 937 O LYS A 64 36.904 0.572 -10.716 1.00 0.00 O ATOM 938 CB LYS A 64 38.137 -0.237 -7.906 1.00 0.00 C ATOM 939 CG LYS A 64 37.329 0.682 -6.994 1.00 0.00 C ATOM 940 CD LYS A 64 38.273 1.387 -6.022 1.00 0.00 C ATOM 941 CE LYS A 64 37.488 2.367 -5.146 1.00 0.00 C ATOM 942 NZ LYS A 64 38.390 3.106 -4.242 1.00 0.00 N ATOM 0 H LYS A 64 39.046 -1.580 -9.721 1.00 0.00 H new ATOM 0 HA LYS A 64 36.525 -1.590 -8.358 1.00 0.00 H new ATOM 0 HB2 LYS A 64 38.676 -0.969 -7.305 1.00 0.00 H new ATOM 0 HB3 LYS A 64 38.884 0.345 -8.445 1.00 0.00 H new ATOM 0 HG2 LYS A 64 36.786 1.417 -7.588 1.00 0.00 H new ATOM 0 HG3 LYS A 64 36.586 0.105 -6.443 1.00 0.00 H new ATOM 0 HD2 LYS A 64 38.779 0.652 -5.396 1.00 0.00 H new ATOM 0 HD3 LYS A 64 39.046 1.920 -6.575 1.00 0.00 H new ATOM 0 HE2 LYS A 64 36.944 3.070 -5.777 1.00 0.00 H new ATOM 0 HE3 LYS A 64 36.746 1.824 -4.561 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 37.828 3.701 -3.601 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 38.952 2.431 -3.685 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 39.027 3.707 -4.803 1.00 0.00 H new ATOM 956 N SER A 65 35.166 0.288 -9.310 1.00 0.00 N ATOM 957 CA SER A 65 34.286 1.193 -10.029 1.00 0.00 C ATOM 958 C SER A 65 33.382 1.959 -9.071 1.00 0.00 C ATOM 959 O SER A 65 32.723 1.365 -8.220 1.00 0.00 O ATOM 960 CB SER A 65 33.444 0.401 -11.027 1.00 0.00 C ATOM 961 OG SER A 65 34.269 -0.190 -12.008 1.00 0.00 O ATOM 0 H SER A 65 34.750 -0.126 -8.476 1.00 0.00 H new ATOM 0 HA SER A 65 34.899 1.919 -10.563 1.00 0.00 H new ATOM 0 HB2 SER A 65 32.880 -0.371 -10.504 1.00 0.00 H new ATOM 0 HB3 SER A 65 32.717 1.060 -11.503 1.00 0.00 H new ATOM 0 HG SER A 65 33.716 -0.695 -12.639 1.00 0.00 H new ATOM 967 N THR A 66 33.356 3.286 -9.219 1.00 0.00 N ATOM 968 CA THR A 66 32.461 4.169 -8.479 1.00 0.00 C ATOM 969 C THR A 66 31.829 5.313 -9.300 1.00 0.00 C ATOM 970 O THR A 66 31.246 6.216 -8.700 1.00 0.00 O ATOM 971 CB THR A 66 33.157 4.731 -7.229 1.00 0.00 C ATOM 972 OG1 THR A 66 33.922 5.863 -7.587 1.00 0.00 O ATOM 973 CG2 THR A 66 34.070 3.704 -6.566 1.00 0.00 C ATOM 0 H THR A 66 33.967 3.782 -9.868 1.00 0.00 H new ATOM 0 HA THR A 66 31.625 3.531 -8.192 1.00 0.00 H new ATOM 0 HB THR A 66 32.379 4.999 -6.514 1.00 0.00 H new ATOM 0 HG1 THR A 66 34.365 6.224 -6.791 1.00 0.00 H new ATOM 0 HG21 THR A 66 34.539 4.147 -5.688 1.00 0.00 H new ATOM 0 HG22 THR A 66 33.483 2.836 -6.265 1.00 0.00 H new ATOM 0 HG23 THR A 66 34.841 3.394 -7.271 1.00 0.00 H new ATOM 981 N PRO A 67 31.915 5.322 -10.646 1.00 0.00 N ATOM 982 CA PRO A 67 31.486 6.466 -11.435 1.00 0.00 C ATOM 983 C PRO A 67 29.974 6.646 -11.363 1.00 0.00 C ATOM 984 O PRO A 67 29.469 7.744 -11.604 1.00 0.00 O ATOM 985 CB PRO A 67 31.933 6.167 -12.865 1.00 0.00 C ATOM 986 CG PRO A 67 31.975 4.646 -12.919 1.00 0.00 C ATOM 987 CD PRO A 67 32.402 4.264 -11.508 1.00 0.00 C ATOM 0 HA PRO A 67 31.920 7.394 -11.063 1.00 0.00 H new ATOM 0 HB2 PRO A 67 31.235 6.575 -13.596 1.00 0.00 H new ATOM 0 HB3 PRO A 67 32.909 6.602 -13.079 1.00 0.00 H new ATOM 0 HG2 PRO A 67 31.003 4.224 -13.174 1.00 0.00 H new ATOM 0 HG3 PRO A 67 32.684 4.288 -13.666 1.00 0.00 H new ATOM 0 HD2 PRO A 67 31.981 3.301 -11.220 1.00 0.00 H new ATOM 0 HD3 PRO A 67 33.486 4.172 -11.439 1.00 0.00 H new ATOM 995 N VAL A 68 29.240 5.575 -11.031 1.00 0.00 N ATOM 996 CA VAL A 68 27.790 5.637 -10.952 1.00 0.00 C ATOM 997 C VAL A 68 27.284 6.022 -9.569 1.00 0.00 C ATOM 998 O VAL A 68 26.358 6.816 -9.464 1.00 0.00 O ATOM 999 CB VAL A 68 27.162 4.333 -11.452 1.00 0.00 C ATOM 1000 CG1 VAL A 68 27.887 3.845 -12.702 1.00 0.00 C ATOM 1001 CG2 VAL A 68 27.219 3.231 -10.400 1.00 0.00 C ATOM 0 H VAL A 68 29.635 4.660 -10.815 1.00 0.00 H new ATOM 0 HA VAL A 68 27.470 6.442 -11.614 1.00 0.00 H new ATOM 0 HB VAL A 68 26.117 4.549 -11.675 1.00 0.00 H new ATOM 0 HG11 VAL A 68 27.431 2.917 -13.048 1.00 0.00 H new ATOM 0 HG12 VAL A 68 27.812 4.600 -13.484 1.00 0.00 H new ATOM 0 HG13 VAL A 68 28.937 3.668 -12.468 1.00 0.00 H new ATOM 0 HG21 VAL A 68 26.763 2.325 -10.798 1.00 0.00 H new ATOM 0 HG22 VAL A 68 28.258 3.030 -10.140 1.00 0.00 H new ATOM 0 HG23 VAL A 68 26.677 3.550 -9.510 1.00 0.00 H new ATOM 1011 N ALA A 69 27.879 5.479 -8.505 1.00 0.00 N ATOM 1012 CA ALA A 69 27.395 5.730 -7.154 1.00 0.00 C ATOM 1013 C ALA A 69 27.648 7.182 -6.758 1.00 0.00 C ATOM 1014 O ALA A 69 26.932 7.726 -5.920 1.00 0.00 O ATOM 1015 CB ALA A 69 28.087 4.773 -6.191 1.00 0.00 C ATOM 0 H ALA A 69 28.693 4.866 -8.556 1.00 0.00 H new ATOM 0 HA ALA A 69 26.319 5.559 -7.113 1.00 0.00 H new ATOM 0 HB1 ALA A 69 27.730 4.955 -5.177 1.00 0.00 H new ATOM 0 HB2 ALA A 69 27.863 3.745 -6.476 1.00 0.00 H new ATOM 0 HB3 ALA A 69 29.164 4.933 -6.230 1.00 0.00 H new ATOM 1021 N GLU A 70 28.661 7.814 -7.359 1.00 0.00 N ATOM 1022 CA GLU A 70 28.889 9.236 -7.159 1.00 0.00 C ATOM 1023 C GLU A 70 27.783 10.033 -7.849 1.00 0.00 C ATOM 1024 O GLU A 70 27.415 11.113 -7.394 1.00 0.00 O ATOM 1025 CB GLU A 70 30.264 9.625 -7.708 1.00 0.00 C ATOM 1026 CG GLU A 70 31.391 8.993 -6.885 1.00 0.00 C ATOM 1027 CD GLU A 70 31.515 9.598 -5.486 1.00 0.00 C ATOM 1028 OE1 GLU A 70 30.813 10.598 -5.204 1.00 0.00 O ATOM 1029 OE2 GLU A 70 32.320 9.056 -4.697 1.00 0.00 O ATOM 0 H GLU A 70 29.329 7.361 -7.983 1.00 0.00 H new ATOM 0 HA GLU A 70 28.869 9.463 -6.093 1.00 0.00 H new ATOM 0 HB2 GLU A 70 30.347 9.306 -8.747 1.00 0.00 H new ATOM 0 HB3 GLU A 70 30.368 10.710 -7.698 1.00 0.00 H new ATOM 0 HG2 GLU A 70 31.214 7.921 -6.798 1.00 0.00 H new ATOM 0 HG3 GLU A 70 32.335 9.118 -7.415 1.00 0.00 H new ATOM 1036 N ALA A 71 27.249 9.495 -8.953 1.00 0.00 N ATOM 1037 CA ALA A 71 26.141 10.119 -9.652 1.00 0.00 C ATOM 1038 C ALA A 71 24.839 9.887 -8.889 1.00 0.00 C ATOM 1039 O ALA A 71 23.941 10.722 -8.949 1.00 0.00 O ATOM 1040 CB ALA A 71 26.042 9.562 -11.075 1.00 0.00 C ATOM 0 H ALA A 71 27.575 8.625 -9.375 1.00 0.00 H new ATOM 0 HA ALA A 71 26.316 11.193 -9.711 1.00 0.00 H new ATOM 0 HB1 ALA A 71 25.208 10.035 -11.594 1.00 0.00 H new ATOM 0 HB2 ALA A 71 26.968 9.769 -11.612 1.00 0.00 H new ATOM 0 HB3 ALA A 71 25.880 8.485 -11.034 1.00 0.00 H new ATOM 1046 N LEU A 72 24.713 8.763 -8.168 1.00 0.00 N ATOM 1047 CA LEU A 72 23.515 8.511 -7.379 1.00 0.00 C ATOM 1048 C LEU A 72 23.432 9.504 -6.222 1.00 0.00 C ATOM 1049 O LEU A 72 22.339 9.896 -5.823 1.00 0.00 O ATOM 1050 CB LEU A 72 23.502 7.072 -6.849 1.00 0.00 C ATOM 1051 CG LEU A 72 23.573 6.031 -7.971 1.00 0.00 C ATOM 1052 CD1 LEU A 72 23.297 4.645 -7.410 1.00 0.00 C ATOM 1053 CD2 LEU A 72 22.543 6.291 -9.059 1.00 0.00 C ATOM 0 H LEU A 72 25.419 8.028 -8.120 1.00 0.00 H new ATOM 0 HA LEU A 72 22.645 8.643 -8.022 1.00 0.00 H new ATOM 0 HB2 LEU A 72 24.345 6.930 -6.173 1.00 0.00 H new ATOM 0 HB3 LEU A 72 22.595 6.911 -6.266 1.00 0.00 H new ATOM 0 HG LEU A 72 24.574 6.099 -8.397 1.00 0.00 H new ATOM 0 HD11 LEU A 72 23.349 3.910 -8.213 1.00 0.00 H new ATOM 0 HD12 LEU A 72 24.041 4.405 -6.650 1.00 0.00 H new ATOM 0 HD13 LEU A 72 22.303 4.625 -6.964 1.00 0.00 H new ATOM 0 HD21 LEU A 72 22.631 5.528 -9.833 1.00 0.00 H new ATOM 0 HD22 LEU A 72 21.542 6.257 -8.628 1.00 0.00 H new ATOM 0 HD23 LEU A 72 22.717 7.274 -9.497 1.00 0.00 H new ATOM 1065 N ALA A 73 24.586 9.916 -5.686 1.00 0.00 N ATOM 1066 CA ALA A 73 24.626 10.885 -4.602 1.00 0.00 C ATOM 1067 C ALA A 73 24.269 12.280 -5.110 1.00 0.00 C ATOM 1068 O ALA A 73 23.694 13.082 -4.375 1.00 0.00 O ATOM 1069 CB ALA A 73 26.021 10.872 -3.978 1.00 0.00 C ATOM 0 H ALA A 73 25.503 9.589 -5.991 1.00 0.00 H new ATOM 0 HA ALA A 73 23.890 10.615 -3.845 1.00 0.00 H new ATOM 0 HB1 ALA A 73 26.062 11.595 -3.164 1.00 0.00 H new ATOM 0 HB2 ALA A 73 26.237 9.876 -3.590 1.00 0.00 H new ATOM 0 HB3 ALA A 73 26.760 11.135 -4.734 1.00 0.00 H new ATOM 1075 N ALA A 74 24.608 12.580 -6.372 1.00 0.00 N ATOM 1076 CA ALA A 74 24.304 13.872 -6.973 1.00 0.00 C ATOM 1077 C ALA A 74 22.865 13.912 -7.491 1.00 0.00 C ATOM 1078 O ALA A 74 22.247 14.975 -7.525 1.00 0.00 O ATOM 1079 CB ALA A 74 25.291 14.129 -8.113 1.00 0.00 C ATOM 0 H ALA A 74 25.096 11.936 -6.994 1.00 0.00 H new ATOM 0 HA ALA A 74 24.402 14.652 -6.217 1.00 0.00 H new ATOM 0 HB1 ALA A 74 25.074 15.094 -8.572 1.00 0.00 H new ATOM 0 HB2 ALA A 74 26.308 14.135 -7.720 1.00 0.00 H new ATOM 0 HB3 ALA A 74 25.196 13.342 -8.861 1.00 0.00 H new ATOM 1085 N ARG A 75 22.334 12.753 -7.897 1.00 0.00 N ATOM 1086 CA ARG A 75 20.969 12.627 -8.401 1.00 0.00 C ATOM 1087 C ARG A 75 19.990 12.325 -7.264 1.00 0.00 C ATOM 1088 O ARG A 75 18.805 12.107 -7.512 1.00 0.00 O ATOM 1089 CB ARG A 75 20.931 11.548 -9.487 1.00 0.00 C ATOM 1090 CG ARG A 75 21.785 11.983 -10.685 1.00 0.00 C ATOM 1091 CD ARG A 75 22.100 10.794 -11.600 1.00 0.00 C ATOM 1092 NE ARG A 75 20.895 10.257 -12.237 1.00 0.00 N ATOM 1093 CZ ARG A 75 20.333 10.778 -13.334 1.00 0.00 C ATOM 1094 NH1 ARG A 75 20.850 11.863 -13.905 1.00 0.00 N ATOM 1095 NH2 ARG A 75 19.253 10.211 -13.862 1.00 0.00 N ATOM 0 H ARG A 75 22.847 11.871 -7.883 1.00 0.00 H new ATOM 0 HA ARG A 75 20.655 13.574 -8.841 1.00 0.00 H new ATOM 0 HB2 ARG A 75 21.303 10.604 -9.088 1.00 0.00 H new ATOM 0 HB3 ARG A 75 19.903 11.376 -9.805 1.00 0.00 H new ATOM 0 HG2 ARG A 75 21.258 12.752 -11.251 1.00 0.00 H new ATOM 0 HG3 ARG A 75 22.714 12.429 -10.330 1.00 0.00 H new ATOM 0 HD2 ARG A 75 22.808 11.105 -12.368 1.00 0.00 H new ATOM 0 HD3 ARG A 75 22.584 10.008 -11.020 1.00 0.00 H new ATOM 0 HE ARG A 75 20.458 9.436 -11.819 1.00 0.00 H new ATOM 0 HH11 ARG A 75 21.680 12.303 -13.507 1.00 0.00 H new ATOM 0 HH12 ARG A 75 20.417 12.255 -14.741 1.00 0.00 H new ATOM 0 HH21 ARG A 75 18.852 9.378 -13.431 1.00 0.00 H new ATOM 0 HH22 ARG A 75 18.825 10.609 -14.698 1.00 0.00 H new ATOM 1109 N ASP A 76 20.491 12.316 -6.025 1.00 0.00 N ATOM 1110 CA ASP A 76 19.706 12.064 -4.822 1.00 0.00 C ATOM 1111 C ASP A 76 18.972 10.715 -4.897 1.00 0.00 C ATOM 1112 O ASP A 76 17.909 10.542 -4.299 1.00 0.00 O ATOM 1113 CB ASP A 76 18.762 13.245 -4.562 1.00 0.00 C ATOM 1114 CG ASP A 76 18.002 13.114 -3.243 1.00 0.00 C ATOM 1115 OD1 ASP A 76 18.537 12.452 -2.326 1.00 0.00 O ATOM 1116 OD2 ASP A 76 16.889 13.684 -3.165 1.00 0.00 O ATOM 0 H ASP A 76 21.477 12.488 -5.831 1.00 0.00 H new ATOM 0 HA ASP A 76 20.379 11.985 -3.968 1.00 0.00 H new ATOM 0 HB2 ASP A 76 19.338 14.170 -4.554 1.00 0.00 H new ATOM 0 HB3 ASP A 76 18.048 13.321 -5.382 1.00 0.00 H new ATOM 1121 N ILE A 77 19.533 9.752 -5.635 1.00 0.00 N ATOM 1122 CA ILE A 77 18.974 8.412 -5.724 1.00 0.00 C ATOM 1123 C ILE A 77 19.563 7.546 -4.606 1.00 0.00 C ATOM 1124 O ILE A 77 20.777 7.555 -4.410 1.00 0.00 O ATOM 1125 CB ILE A 77 19.290 7.799 -7.097 1.00 0.00 C ATOM 1126 CG1 ILE A 77 18.961 8.795 -8.215 1.00 0.00 C ATOM 1127 CG2 ILE A 77 18.493 6.500 -7.259 1.00 0.00 C ATOM 1128 CD1 ILE A 77 19.175 8.181 -9.600 1.00 0.00 C ATOM 0 H ILE A 77 20.383 9.885 -6.183 1.00 0.00 H new ATOM 0 HA ILE A 77 17.891 8.460 -5.610 1.00 0.00 H new ATOM 0 HB ILE A 77 20.354 7.571 -7.163 1.00 0.00 H new ATOM 0 HG12 ILE A 77 17.926 9.122 -8.118 1.00 0.00 H new ATOM 0 HG13 ILE A 77 19.587 9.681 -8.109 1.00 0.00 H new ATOM 0 HG21 ILE A 77 18.711 6.058 -8.231 1.00 0.00 H new ATOM 0 HG22 ILE A 77 18.773 5.801 -6.471 1.00 0.00 H new ATOM 0 HG23 ILE A 77 17.427 6.716 -7.190 1.00 0.00 H new ATOM 0 HD11 ILE A 77 18.931 8.917 -10.366 1.00 0.00 H new ATOM 0 HD12 ILE A 77 20.216 7.878 -9.706 1.00 0.00 H new ATOM 0 HD13 ILE A 77 18.530 7.310 -9.716 1.00 0.00 H new ATOM 1140 N PRO A 78 18.730 6.800 -3.868 1.00 0.00 N ATOM 1141 CA PRO A 78 19.196 5.857 -2.866 1.00 0.00 C ATOM 1142 C PRO A 78 20.055 4.770 -3.512 1.00 0.00 C ATOM 1143 O PRO A 78 19.836 4.411 -4.669 1.00 0.00 O ATOM 1144 CB PRO A 78 17.935 5.259 -2.239 1.00 0.00 C ATOM 1145 CG PRO A 78 16.806 6.213 -2.632 1.00 0.00 C ATOM 1146 CD PRO A 78 17.291 6.829 -3.939 1.00 0.00 C ATOM 0 HA PRO A 78 19.820 6.341 -2.115 1.00 0.00 H new ATOM 0 HB2 PRO A 78 17.748 4.252 -2.612 1.00 0.00 H new ATOM 0 HB3 PRO A 78 18.030 5.185 -1.156 1.00 0.00 H new ATOM 0 HG2 PRO A 78 15.863 5.683 -2.765 1.00 0.00 H new ATOM 0 HG3 PRO A 78 16.640 6.973 -1.869 1.00 0.00 H new ATOM 0 HD2 PRO A 78 16.929 6.263 -4.798 1.00 0.00 H new ATOM 0 HD3 PRO A 78 16.924 7.849 -4.052 1.00 0.00 H new ATOM 1154 N PHE A 79 21.030 4.242 -2.768 1.00 0.00 N ATOM 1155 CA PHE A 79 21.931 3.240 -3.318 1.00 0.00 C ATOM 1156 C PHE A 79 22.455 2.308 -2.231 1.00 0.00 C ATOM 1157 O PHE A 79 22.543 2.690 -1.063 1.00 0.00 O ATOM 1158 CB PHE A 79 23.088 3.937 -4.043 1.00 0.00 C ATOM 1159 CG PHE A 79 23.944 4.816 -3.161 1.00 0.00 C ATOM 1160 CD1 PHE A 79 23.622 6.170 -2.989 1.00 0.00 C ATOM 1161 CD2 PHE A 79 25.064 4.276 -2.517 1.00 0.00 C ATOM 1162 CE1 PHE A 79 24.425 6.984 -2.179 1.00 0.00 C ATOM 1163 CE2 PHE A 79 25.867 5.088 -1.709 1.00 0.00 C ATOM 1164 CZ PHE A 79 25.551 6.443 -1.544 1.00 0.00 C ATOM 0 H PHE A 79 21.211 4.491 -1.795 1.00 0.00 H new ATOM 0 HA PHE A 79 21.379 2.627 -4.030 1.00 0.00 H new ATOM 0 HB2 PHE A 79 23.722 3.178 -4.502 1.00 0.00 H new ATOM 0 HB3 PHE A 79 22.680 4.543 -4.852 1.00 0.00 H new ATOM 0 HD1 PHE A 79 22.755 6.585 -3.481 1.00 0.00 H new ATOM 0 HD2 PHE A 79 25.308 3.232 -2.644 1.00 0.00 H new ATOM 0 HE1 PHE A 79 24.177 8.026 -2.044 1.00 0.00 H new ATOM 0 HE2 PHE A 79 26.730 4.670 -1.212 1.00 0.00 H new ATOM 0 HZ PHE A 79 26.176 7.071 -0.927 1.00 0.00 H new ATOM 1174 N VAL A 80 22.808 1.083 -2.628 1.00 0.00 N ATOM 1175 CA VAL A 80 23.437 0.099 -1.754 1.00 0.00 C ATOM 1176 C VAL A 80 24.668 -0.465 -2.454 1.00 0.00 C ATOM 1177 O VAL A 80 24.697 -0.546 -3.680 1.00 0.00 O ATOM 1178 CB VAL A 80 22.460 -1.037 -1.417 1.00 0.00 C ATOM 1179 CG1 VAL A 80 23.097 -2.039 -0.455 1.00 0.00 C ATOM 1180 CG2 VAL A 80 21.198 -0.532 -0.733 1.00 0.00 C ATOM 0 H VAL A 80 22.661 0.745 -3.579 1.00 0.00 H new ATOM 0 HA VAL A 80 23.726 0.583 -0.821 1.00 0.00 H new ATOM 0 HB VAL A 80 22.211 -1.499 -2.372 1.00 0.00 H new ATOM 0 HG11 VAL A 80 22.384 -2.833 -0.232 1.00 0.00 H new ATOM 0 HG12 VAL A 80 23.987 -2.469 -0.914 1.00 0.00 H new ATOM 0 HG13 VAL A 80 23.374 -1.531 0.469 1.00 0.00 H new ATOM 0 HG21 VAL A 80 20.540 -1.374 -0.516 1.00 0.00 H new ATOM 0 HG22 VAL A 80 21.464 -0.030 0.197 1.00 0.00 H new ATOM 0 HG23 VAL A 80 20.684 0.170 -1.390 1.00 0.00 H new ATOM 1190 N PHE A 81 25.681 -0.860 -1.686 1.00 0.00 N ATOM 1191 CA PHE A 81 26.822 -1.564 -2.250 1.00 0.00 C ATOM 1192 C PHE A 81 26.717 -3.081 -2.157 1.00 0.00 C ATOM 1193 O PHE A 81 25.964 -3.603 -1.336 1.00 0.00 O ATOM 1194 CB PHE A 81 28.142 -1.018 -1.715 1.00 0.00 C ATOM 1195 CG PHE A 81 28.593 0.238 -2.427 1.00 0.00 C ATOM 1196 CD1 PHE A 81 29.467 0.145 -3.520 1.00 0.00 C ATOM 1197 CD2 PHE A 81 28.135 1.491 -1.996 1.00 0.00 C ATOM 1198 CE1 PHE A 81 29.898 1.309 -4.171 1.00 0.00 C ATOM 1199 CE2 PHE A 81 28.558 2.652 -2.657 1.00 0.00 C ATOM 1200 CZ PHE A 81 29.443 2.563 -3.739 1.00 0.00 C ATOM 0 H PHE A 81 25.732 -0.704 -0.679 1.00 0.00 H new ATOM 0 HA PHE A 81 26.806 -1.358 -3.320 1.00 0.00 H new ATOM 0 HB2 PHE A 81 28.037 -0.808 -0.651 1.00 0.00 H new ATOM 0 HB3 PHE A 81 28.912 -1.783 -1.815 1.00 0.00 H new ATOM 0 HD1 PHE A 81 29.807 -0.822 -3.859 1.00 0.00 H new ATOM 0 HD2 PHE A 81 27.458 1.561 -1.157 1.00 0.00 H new ATOM 0 HE1 PHE A 81 30.580 1.240 -5.005 1.00 0.00 H new ATOM 0 HE2 PHE A 81 28.201 3.618 -2.331 1.00 0.00 H new ATOM 0 HZ PHE A 81 29.775 3.460 -4.240 1.00 0.00 H new ATOM 1210 N ALA A 82 27.470 -3.792 -2.990 1.00 0.00 N ATOM 1211 CA ALA A 82 27.502 -5.241 -2.971 1.00 0.00 C ATOM 1212 C ALA A 82 28.944 -5.720 -2.852 1.00 0.00 C ATOM 1213 O ALA A 82 29.842 -5.158 -3.478 1.00 0.00 O ATOM 1214 CB ALA A 82 26.820 -5.793 -4.225 1.00 0.00 C ATOM 0 H ALA A 82 28.075 -3.374 -3.697 1.00 0.00 H new ATOM 0 HA ALA A 82 26.953 -5.613 -2.106 1.00 0.00 H new ATOM 0 HB1 ALA A 82 26.848 -6.882 -4.204 1.00 0.00 H new ATOM 0 HB2 ALA A 82 25.784 -5.457 -4.253 1.00 0.00 H new ATOM 0 HB3 ALA A 82 27.343 -5.434 -5.111 1.00 0.00 H new ATOM 1220 N THR A 83 29.161 -6.759 -2.048 1.00 0.00 N ATOM 1221 CA THR A 83 30.489 -7.326 -1.822 1.00 0.00 C ATOM 1222 C THR A 83 30.492 -8.850 -1.795 1.00 0.00 C ATOM 1223 O THR A 83 29.440 -9.478 -1.902 1.00 0.00 O ATOM 1224 CB THR A 83 31.163 -6.725 -0.583 1.00 0.00 C ATOM 1225 OG1 THR A 83 30.931 -7.555 0.528 1.00 0.00 O ATOM 1226 CG2 THR A 83 30.669 -5.318 -0.256 1.00 0.00 C ATOM 0 H THR A 83 28.419 -7.233 -1.533 1.00 0.00 H new ATOM 0 HA THR A 83 31.090 -7.043 -2.686 1.00 0.00 H new ATOM 0 HB THR A 83 32.227 -6.655 -0.808 1.00 0.00 H new ATOM 0 HG1 THR A 83 31.364 -7.171 1.319 1.00 0.00 H new ATOM 0 HG21 THR A 83 31.184 -4.948 0.631 1.00 0.00 H new ATOM 0 HG22 THR A 83 30.874 -4.656 -1.097 1.00 0.00 H new ATOM 0 HG23 THR A 83 29.596 -5.344 -0.068 1.00 0.00 H new ATOM 1234 N GLY A 84 31.676 -9.449 -1.652 1.00 0.00 N ATOM 1235 CA GLY A 84 31.812 -10.896 -1.572 1.00 0.00 C ATOM 1236 C GLY A 84 32.983 -11.269 -0.670 1.00 0.00 C ATOM 1237 O GLY A 84 33.560 -10.410 -0.007 1.00 0.00 O ATOM 0 H GLY A 84 32.560 -8.944 -1.589 1.00 0.00 H new ATOM 0 HA2 GLY A 84 30.892 -11.334 -1.184 1.00 0.00 H new ATOM 0 HA3 GLY A 84 31.966 -11.309 -2.569 1.00 0.00 H new ATOM 1241 N GLY A 85 33.336 -12.559 -0.651 1.00 0.00 N ATOM 1242 CA GLY A 85 34.395 -13.078 0.206 1.00 0.00 C ATOM 1243 C GLY A 85 35.780 -12.562 -0.192 1.00 0.00 C ATOM 1244 O GLY A 85 36.777 -12.917 0.440 1.00 0.00 O ATOM 0 H GLY A 85 32.892 -13.270 -1.232 1.00 0.00 H new ATOM 0 HA2 GLY A 85 34.191 -12.799 1.240 1.00 0.00 H new ATOM 0 HA3 GLY A 85 34.391 -14.167 0.163 1.00 0.00 H new ATOM 1248 N SER A 86 35.850 -11.729 -1.236 1.00 0.00 N ATOM 1249 CA SER A 86 37.100 -11.148 -1.704 1.00 0.00 C ATOM 1250 C SER A 86 36.893 -9.703 -2.159 1.00 0.00 C ATOM 1251 O SER A 86 37.810 -9.087 -2.700 1.00 0.00 O ATOM 1252 CB SER A 86 37.667 -12.003 -2.838 1.00 0.00 C ATOM 1253 OG SER A 86 36.763 -12.020 -3.922 1.00 0.00 O ATOM 0 H SER A 86 35.035 -11.442 -1.778 1.00 0.00 H new ATOM 0 HA SER A 86 37.815 -11.133 -0.881 1.00 0.00 H new ATOM 0 HB2 SER A 86 38.629 -11.604 -3.161 1.00 0.00 H new ATOM 0 HB3 SER A 86 37.846 -13.019 -2.486 1.00 0.00 H new ATOM 0 HG SER A 86 37.131 -12.567 -4.647 1.00 0.00 H new ATOM 1259 N ASP A 87 35.688 -9.165 -1.939 1.00 0.00 N ATOM 1260 CA ASP A 87 35.323 -7.820 -2.362 1.00 0.00 C ATOM 1261 C ASP A 87 34.768 -6.960 -1.225 1.00 0.00 C ATOM 1262 O ASP A 87 34.349 -5.827 -1.457 1.00 0.00 O ATOM 1263 CB ASP A 87 34.352 -7.885 -3.546 1.00 0.00 C ATOM 1264 CG ASP A 87 35.025 -8.350 -4.838 1.00 0.00 C ATOM 1265 OD1 ASP A 87 36.217 -8.022 -5.024 1.00 0.00 O ATOM 1266 OD2 ASP A 87 34.334 -9.030 -5.628 1.00 0.00 O ATOM 0 H ASP A 87 34.937 -9.660 -1.458 1.00 0.00 H new ATOM 0 HA ASP A 87 36.239 -7.324 -2.683 1.00 0.00 H new ATOM 0 HB2 ASP A 87 33.534 -8.564 -3.303 1.00 0.00 H new ATOM 0 HB3 ASP A 87 33.913 -6.900 -3.704 1.00 0.00 H new ATOM 1271 N ASP A 88 34.762 -7.494 0.001 1.00 0.00 N ATOM 1272 CA ASP A 88 34.277 -6.775 1.175 1.00 0.00 C ATOM 1273 C ASP A 88 35.198 -5.621 1.586 1.00 0.00 C ATOM 1274 O ASP A 88 34.970 -4.972 2.607 1.00 0.00 O ATOM 1275 CB ASP A 88 33.997 -7.739 2.338 1.00 0.00 C ATOM 1276 CG ASP A 88 35.163 -8.689 2.624 1.00 0.00 C ATOM 1277 OD1 ASP A 88 34.927 -9.648 3.396 1.00 0.00 O ATOM 1278 OD2 ASP A 88 36.263 -8.459 2.076 1.00 0.00 O ATOM 0 H ASP A 88 35.094 -8.437 0.203 1.00 0.00 H new ATOM 0 HA ASP A 88 33.330 -6.312 0.897 1.00 0.00 H new ATOM 0 HB2 ASP A 88 33.778 -7.162 3.236 1.00 0.00 H new ATOM 0 HB3 ASP A 88 33.106 -8.325 2.110 1.00 0.00 H new ATOM 1283 N SER A 89 36.231 -5.368 0.783 1.00 0.00 N ATOM 1284 CA SER A 89 37.157 -4.260 0.977 1.00 0.00 C ATOM 1285 C SER A 89 36.554 -2.962 0.443 1.00 0.00 C ATOM 1286 O SER A 89 37.260 -2.141 -0.145 1.00 0.00 O ATOM 1287 CB SER A 89 38.482 -4.584 0.285 1.00 0.00 C ATOM 1288 OG SER A 89 38.277 -4.727 -1.109 1.00 0.00 O ATOM 0 H SER A 89 36.449 -5.939 -0.034 1.00 0.00 H new ATOM 0 HA SER A 89 37.344 -4.120 2.042 1.00 0.00 H new ATOM 0 HB2 SER A 89 39.205 -3.791 0.475 1.00 0.00 H new ATOM 0 HB3 SER A 89 38.901 -5.503 0.696 1.00 0.00 H new ATOM 0 HG SER A 89 39.130 -4.933 -1.546 1.00 0.00 H new ATOM 1294 N VAL A 90 35.244 -2.770 0.641 1.00 0.00 N ATOM 1295 CA VAL A 90 34.535 -1.593 0.155 1.00 0.00 C ATOM 1296 C VAL A 90 35.224 -0.332 0.681 1.00 0.00 C ATOM 1297 O VAL A 90 35.735 -0.306 1.799 1.00 0.00 O ATOM 1298 CB VAL A 90 33.060 -1.670 0.579 1.00 0.00 C ATOM 1299 CG1 VAL A 90 32.908 -1.968 2.071 1.00 0.00 C ATOM 1300 CG2 VAL A 90 32.338 -0.361 0.258 1.00 0.00 C ATOM 0 H VAL A 90 34.651 -3.430 1.144 1.00 0.00 H new ATOM 0 HA VAL A 90 34.561 -1.555 -0.934 1.00 0.00 H new ATOM 0 HB VAL A 90 32.613 -2.489 0.015 1.00 0.00 H new ATOM 0 HG11 VAL A 90 31.849 -2.014 2.327 1.00 0.00 H new ATOM 0 HG12 VAL A 90 33.378 -2.924 2.301 1.00 0.00 H new ATOM 0 HG13 VAL A 90 33.388 -1.179 2.650 1.00 0.00 H new ATOM 0 HG21 VAL A 90 31.295 -0.436 0.566 1.00 0.00 H new ATOM 0 HG22 VAL A 90 32.816 0.459 0.793 1.00 0.00 H new ATOM 0 HG23 VAL A 90 32.387 -0.172 -0.814 1.00 0.00 H new ATOM 1310 N ASP A 91 35.234 0.714 -0.150 1.00 0.00 N ATOM 1311 CA ASP A 91 35.985 1.935 0.111 1.00 0.00 C ATOM 1312 C ASP A 91 35.323 2.687 1.267 1.00 0.00 C ATOM 1313 O ASP A 91 34.102 2.651 1.422 1.00 0.00 O ATOM 1314 CB ASP A 91 35.947 2.794 -1.158 1.00 0.00 C ATOM 1315 CG ASP A 91 37.039 3.861 -1.172 1.00 0.00 C ATOM 1316 OD1 ASP A 91 37.123 4.571 -2.197 1.00 0.00 O ATOM 1317 OD2 ASP A 91 37.774 3.956 -0.162 1.00 0.00 O ATOM 0 H ASP A 91 34.716 0.733 -1.028 1.00 0.00 H new ATOM 0 HA ASP A 91 37.017 1.708 0.378 1.00 0.00 H new ATOM 0 HB2 ASP A 91 36.059 2.152 -2.032 1.00 0.00 H new ATOM 0 HB3 ASP A 91 34.972 3.275 -1.239 1.00 0.00 H new ATOM 1322 N SER A 92 36.133 3.373 2.081 1.00 0.00 N ATOM 1323 CA SER A 92 35.637 4.154 3.213 1.00 0.00 C ATOM 1324 C SER A 92 34.771 5.314 2.725 1.00 0.00 C ATOM 1325 O SER A 92 34.072 5.944 3.517 1.00 0.00 O ATOM 1326 CB SER A 92 36.821 4.662 4.032 1.00 0.00 C ATOM 1327 OG SER A 92 37.595 5.552 3.257 1.00 0.00 O ATOM 0 H SER A 92 37.147 3.401 1.972 1.00 0.00 H new ATOM 0 HA SER A 92 35.015 3.521 3.846 1.00 0.00 H new ATOM 0 HB2 SER A 92 36.464 5.165 4.931 1.00 0.00 H new ATOM 0 HB3 SER A 92 37.435 3.823 4.359 1.00 0.00 H new ATOM 0 HG SER A 92 38.352 5.876 3.789 1.00 0.00 H new ATOM 1333 N ARG A 93 34.819 5.592 1.419 1.00 0.00 N ATOM 1334 CA ARG A 93 33.976 6.588 0.772 1.00 0.00 C ATOM 1335 C ARG A 93 32.499 6.187 0.862 1.00 0.00 C ATOM 1336 O ARG A 93 31.621 7.025 0.652 1.00 0.00 O ATOM 1337 CB ARG A 93 34.445 6.711 -0.685 1.00 0.00 C ATOM 1338 CG ARG A 93 33.511 7.550 -1.562 1.00 0.00 C ATOM 1339 CD ARG A 93 33.425 9.000 -1.087 1.00 0.00 C ATOM 1340 NE ARG A 93 32.553 9.774 -1.983 1.00 0.00 N ATOM 1341 CZ ARG A 93 31.764 10.779 -1.590 1.00 0.00 C ATOM 1342 NH1 ARG A 93 31.740 11.173 -0.319 1.00 0.00 N ATOM 1343 NH2 ARG A 93 30.992 11.396 -2.482 1.00 0.00 N ATOM 0 H ARG A 93 35.456 5.121 0.776 1.00 0.00 H new ATOM 0 HA ARG A 93 34.064 7.554 1.270 1.00 0.00 H new ATOM 0 HB2 ARG A 93 35.440 7.155 -0.701 1.00 0.00 H new ATOM 0 HB3 ARG A 93 34.534 5.713 -1.115 1.00 0.00 H new ATOM 0 HG2 ARG A 93 33.865 7.527 -2.593 1.00 0.00 H new ATOM 0 HG3 ARG A 93 32.515 7.108 -1.557 1.00 0.00 H new ATOM 0 HD2 ARG A 93 33.037 9.035 -0.069 1.00 0.00 H new ATOM 0 HD3 ARG A 93 34.421 9.443 -1.064 1.00 0.00 H new ATOM 0 HE ARG A 93 32.550 9.527 -2.973 1.00 0.00 H new ATOM 0 HH11 ARG A 93 32.329 10.706 0.371 1.00 0.00 H new ATOM 0 HH12 ARG A 93 31.133 11.941 -0.035 1.00 0.00 H new ATOM 0 HH21 ARG A 93 31.005 11.101 -3.458 1.00 0.00 H new ATOM 0 HH22 ARG A 93 30.388 12.164 -2.189 1.00 0.00 H new ATOM 1357 N PHE A 94 32.222 4.915 1.168 1.00 0.00 N ATOM 1358 CA PHE A 94 30.857 4.402 1.165 1.00 0.00 C ATOM 1359 C PHE A 94 30.570 3.521 2.384 1.00 0.00 C ATOM 1360 O PHE A 94 29.519 2.889 2.442 1.00 0.00 O ATOM 1361 CB PHE A 94 30.627 3.616 -0.125 1.00 0.00 C ATOM 1362 CG PHE A 94 30.925 4.402 -1.383 1.00 0.00 C ATOM 1363 CD1 PHE A 94 30.054 5.420 -1.805 1.00 0.00 C ATOM 1364 CD2 PHE A 94 32.079 4.113 -2.129 1.00 0.00 C ATOM 1365 CE1 PHE A 94 30.331 6.142 -2.971 1.00 0.00 C ATOM 1366 CE2 PHE A 94 32.354 4.838 -3.297 1.00 0.00 C ATOM 1367 CZ PHE A 94 31.479 5.850 -3.720 1.00 0.00 C ATOM 0 H PHE A 94 32.929 4.225 1.421 1.00 0.00 H new ATOM 0 HA PHE A 94 30.171 5.248 1.218 1.00 0.00 H new ATOM 0 HB2 PHE A 94 31.251 2.722 -0.110 1.00 0.00 H new ATOM 0 HB3 PHE A 94 29.590 3.281 -0.155 1.00 0.00 H new ATOM 0 HD1 PHE A 94 29.169 5.646 -1.229 1.00 0.00 H new ATOM 0 HD2 PHE A 94 32.753 3.334 -1.804 1.00 0.00 H new ATOM 0 HE1 PHE A 94 29.660 6.924 -3.294 1.00 0.00 H new ATOM 0 HE2 PHE A 94 33.241 4.617 -3.872 1.00 0.00 H new ATOM 0 HZ PHE A 94 31.690 6.404 -4.623 1.00 0.00 H new ATOM 1377 N ARG A 95 31.486 3.465 3.359 1.00 0.00 N ATOM 1378 CA ARG A 95 31.282 2.652 4.553 1.00 0.00 C ATOM 1379 C ARG A 95 30.212 3.244 5.468 1.00 0.00 C ATOM 1380 O ARG A 95 29.769 2.579 6.404 1.00 0.00 O ATOM 1381 CB ARG A 95 32.607 2.467 5.296 1.00 0.00 C ATOM 1382 CG ARG A 95 33.444 1.410 4.578 1.00 0.00 C ATOM 1383 CD ARG A 95 34.750 1.162 5.330 1.00 0.00 C ATOM 1384 NE ARG A 95 35.607 0.228 4.587 1.00 0.00 N ATOM 1385 CZ ARG A 95 36.329 -0.746 5.151 1.00 0.00 C ATOM 1386 NH1 ARG A 95 36.326 -0.920 6.470 1.00 0.00 N ATOM 1387 NH2 ARG A 95 37.062 -1.547 4.386 1.00 0.00 N ATOM 0 H ARG A 95 32.370 3.973 3.340 1.00 0.00 H new ATOM 0 HA ARG A 95 30.920 1.674 4.237 1.00 0.00 H new ATOM 0 HB2 ARG A 95 33.150 3.411 5.336 1.00 0.00 H new ATOM 0 HB3 ARG A 95 32.420 2.162 6.326 1.00 0.00 H new ATOM 0 HG2 ARG A 95 32.879 0.481 4.501 1.00 0.00 H new ATOM 0 HG3 ARG A 95 33.659 1.737 3.561 1.00 0.00 H new ATOM 0 HD2 ARG A 95 35.275 2.106 5.478 1.00 0.00 H new ATOM 0 HD3 ARG A 95 34.535 0.758 6.319 1.00 0.00 H new ATOM 0 HE ARG A 95 35.654 0.329 3.573 1.00 0.00 H new ATOM 0 HH11 ARG A 95 35.768 -0.306 7.064 1.00 0.00 H new ATOM 0 HH12 ARG A 95 36.881 -1.667 6.887 1.00 0.00 H new ATOM 0 HH21 ARG A 95 37.072 -1.417 3.374 1.00 0.00 H new ATOM 0 HH22 ARG A 95 37.615 -2.292 4.810 1.00 0.00 H new ATOM 1401 N ASP A 96 29.792 4.485 5.199 1.00 0.00 N ATOM 1402 CA ASP A 96 28.674 5.105 5.898 1.00 0.00 C ATOM 1403 C ASP A 96 27.337 4.830 5.200 1.00 0.00 C ATOM 1404 O ASP A 96 26.291 5.314 5.636 1.00 0.00 O ATOM 1405 CB ASP A 96 28.913 6.606 6.111 1.00 0.00 C ATOM 1406 CG ASP A 96 29.358 7.344 4.844 1.00 0.00 C ATOM 1407 OD1 ASP A 96 29.672 8.548 4.975 1.00 0.00 O ATOM 1408 OD2 ASP A 96 29.381 6.714 3.763 1.00 0.00 O ATOM 0 H ASP A 96 30.220 5.082 4.491 1.00 0.00 H new ATOM 0 HA ASP A 96 28.611 4.643 6.883 1.00 0.00 H new ATOM 0 HB2 ASP A 96 27.996 7.062 6.483 1.00 0.00 H new ATOM 0 HB3 ASP A 96 29.671 6.738 6.883 1.00 0.00 H new ATOM 1413 N ARG A 97 27.377 4.053 4.113 1.00 0.00 N ATOM 1414 CA ARG A 97 26.204 3.697 3.324 1.00 0.00 C ATOM 1415 C ARG A 97 25.890 2.218 3.552 1.00 0.00 C ATOM 1416 O ARG A 97 26.768 1.465 3.976 1.00 0.00 O ATOM 1417 CB ARG A 97 26.501 3.970 1.843 1.00 0.00 C ATOM 1418 CG ARG A 97 27.216 5.313 1.652 1.00 0.00 C ATOM 1419 CD ARG A 97 26.379 6.475 2.191 1.00 0.00 C ATOM 1420 NE ARG A 97 27.163 7.715 2.197 1.00 0.00 N ATOM 1421 CZ ARG A 97 26.738 8.887 1.716 1.00 0.00 C ATOM 1422 NH1 ARG A 97 25.525 9.006 1.179 1.00 0.00 N ATOM 1423 NH2 ARG A 97 27.535 9.951 1.771 1.00 0.00 N ATOM 0 H ARG A 97 28.242 3.649 3.755 1.00 0.00 H new ATOM 0 HA ARG A 97 25.340 4.291 3.623 1.00 0.00 H new ATOM 0 HB2 ARG A 97 27.119 3.167 1.441 1.00 0.00 H new ATOM 0 HB3 ARG A 97 25.569 3.969 1.278 1.00 0.00 H new ATOM 0 HG2 ARG A 97 28.179 5.290 2.162 1.00 0.00 H new ATOM 0 HG3 ARG A 97 27.420 5.471 0.593 1.00 0.00 H new ATOM 0 HD2 ARG A 97 25.488 6.604 1.577 1.00 0.00 H new ATOM 0 HD3 ARG A 97 26.039 6.248 3.202 1.00 0.00 H new ATOM 0 HE ARG A 97 28.100 7.680 2.597 1.00 0.00 H new ATOM 0 HH11 ARG A 97 24.907 8.196 1.131 1.00 0.00 H new ATOM 0 HH12 ARG A 97 25.214 9.907 0.816 1.00 0.00 H new ATOM 0 HH21 ARG A 97 28.466 9.870 2.179 1.00 0.00 H new ATOM 0 HH22 ARG A 97 27.215 10.848 1.405 1.00 0.00 H new ATOM 1437 N PRO A 98 24.652 1.780 3.278 1.00 0.00 N ATOM 1438 CA PRO A 98 24.261 0.391 3.419 1.00 0.00 C ATOM 1439 C PRO A 98 25.013 -0.466 2.405 1.00 0.00 C ATOM 1440 O PRO A 98 25.359 0.010 1.324 1.00 0.00 O ATOM 1441 CB PRO A 98 22.755 0.353 3.177 1.00 0.00 C ATOM 1442 CG PRO A 98 22.483 1.602 2.341 1.00 0.00 C ATOM 1443 CD PRO A 98 23.549 2.593 2.806 1.00 0.00 C ATOM 0 HA PRO A 98 24.501 -0.007 4.405 1.00 0.00 H new ATOM 0 HB2 PRO A 98 22.458 -0.553 2.649 1.00 0.00 H new ATOM 0 HB3 PRO A 98 22.200 0.372 4.115 1.00 0.00 H new ATOM 0 HG2 PRO A 98 22.568 1.395 1.274 1.00 0.00 H new ATOM 0 HG3 PRO A 98 21.478 1.987 2.512 1.00 0.00 H new ATOM 0 HD2 PRO A 98 23.862 3.244 1.990 1.00 0.00 H new ATOM 0 HD3 PRO A 98 23.168 3.236 3.599 1.00 0.00 H new ATOM 1451 N VAL A 99 25.265 -1.726 2.754 1.00 0.00 N ATOM 1452 CA VAL A 99 26.001 -2.629 1.885 1.00 0.00 C ATOM 1453 C VAL A 99 25.602 -4.072 2.158 1.00 0.00 C ATOM 1454 O VAL A 99 25.560 -4.513 3.305 1.00 0.00 O ATOM 1455 CB VAL A 99 27.507 -2.408 2.092 1.00 0.00 C ATOM 1456 CG1 VAL A 99 27.908 -2.543 3.563 1.00 0.00 C ATOM 1457 CG2 VAL A 99 28.317 -3.413 1.281 1.00 0.00 C ATOM 0 H VAL A 99 24.967 -2.142 3.637 1.00 0.00 H new ATOM 0 HA VAL A 99 25.759 -2.420 0.843 1.00 0.00 H new ATOM 0 HB VAL A 99 27.720 -1.393 1.757 1.00 0.00 H new ATOM 0 HG11 VAL A 99 28.981 -2.379 3.664 1.00 0.00 H new ATOM 0 HG12 VAL A 99 27.370 -1.803 4.156 1.00 0.00 H new ATOM 0 HG13 VAL A 99 27.659 -3.543 3.918 1.00 0.00 H new ATOM 0 HG21 VAL A 99 29.381 -3.238 1.443 1.00 0.00 H new ATOM 0 HG22 VAL A 99 28.063 -4.425 1.598 1.00 0.00 H new ATOM 0 HG23 VAL A 99 28.087 -3.296 0.222 1.00 0.00 H new ATOM 1467 N LEU A 100 25.309 -4.797 1.077 1.00 0.00 N ATOM 1468 CA LEU A 100 25.109 -6.239 1.112 1.00 0.00 C ATOM 1469 C LEU A 100 26.422 -6.932 0.735 1.00 0.00 C ATOM 1470 O LEU A 100 27.251 -6.354 0.036 1.00 0.00 O ATOM 1471 CB LEU A 100 23.977 -6.625 0.157 1.00 0.00 C ATOM 1472 CG LEU A 100 22.649 -5.965 0.557 1.00 0.00 C ATOM 1473 CD1 LEU A 100 21.592 -6.289 -0.493 1.00 0.00 C ATOM 1474 CD2 LEU A 100 22.172 -6.501 1.909 1.00 0.00 C ATOM 0 H LEU A 100 25.204 -4.392 0.147 1.00 0.00 H new ATOM 0 HA LEU A 100 24.823 -6.559 2.114 1.00 0.00 H new ATOM 0 HB2 LEU A 100 24.240 -6.328 -0.858 1.00 0.00 H new ATOM 0 HB3 LEU A 100 23.858 -7.709 0.152 1.00 0.00 H new ATOM 0 HG LEU A 100 22.801 -4.888 0.628 1.00 0.00 H new ATOM 0 HD11 LEU A 100 20.647 -5.823 -0.214 1.00 0.00 H new ATOM 0 HD12 LEU A 100 21.913 -5.907 -1.462 1.00 0.00 H new ATOM 0 HD13 LEU A 100 21.459 -7.369 -0.555 1.00 0.00 H new ATOM 0 HD21 LEU A 100 21.230 -6.023 2.178 1.00 0.00 H new ATOM 0 HD22 LEU A 100 22.026 -7.579 1.842 1.00 0.00 H new ATOM 0 HD23 LEU A 100 22.920 -6.283 2.671 1.00 0.00 H new ATOM 1486 N GLN A 101 26.611 -8.168 1.195 1.00 0.00 N ATOM 1487 CA GLN A 101 27.849 -8.906 0.963 1.00 0.00 C ATOM 1488 C GLN A 101 27.553 -10.380 0.664 1.00 0.00 C ATOM 1489 O GLN A 101 26.745 -10.677 -0.218 1.00 0.00 O ATOM 1490 CB GLN A 101 28.811 -8.690 2.141 1.00 0.00 C ATOM 1491 CG GLN A 101 28.199 -8.990 3.513 1.00 0.00 C ATOM 1492 CD GLN A 101 27.190 -7.931 3.947 1.00 0.00 C ATOM 1493 OE1 GLN A 101 26.093 -8.262 4.390 1.00 0.00 O ATOM 1494 NE2 GLN A 101 27.548 -6.655 3.821 1.00 0.00 N ATOM 0 H GLN A 101 25.915 -8.682 1.735 1.00 0.00 H new ATOM 0 HA GLN A 101 28.353 -8.523 0.076 1.00 0.00 H new ATOM 0 HB2 GLN A 101 29.688 -9.322 2.000 1.00 0.00 H new ATOM 0 HB3 GLN A 101 29.158 -7.657 2.128 1.00 0.00 H new ATOM 0 HG2 GLN A 101 27.709 -9.963 3.484 1.00 0.00 H new ATOM 0 HG3 GLN A 101 28.994 -9.055 4.256 1.00 0.00 H new ATOM 0 HE21 GLN A 101 28.468 -6.418 3.449 1.00 0.00 H new ATOM 0 HE22 GLN A 101 26.903 -5.915 4.096 1.00 0.00 H new ATOM 1503 N LYS A 102 28.198 -11.299 1.394 1.00 0.00 N ATOM 1504 CA LYS A 102 27.925 -12.732 1.309 1.00 0.00 C ATOM 1505 C LYS A 102 26.419 -13.004 1.432 1.00 0.00 C ATOM 1506 O LYS A 102 25.673 -12.119 1.845 1.00 0.00 O ATOM 1507 CB LYS A 102 28.763 -13.475 2.369 1.00 0.00 C ATOM 1508 CG LYS A 102 28.762 -12.811 3.753 1.00 0.00 C ATOM 1509 CD LYS A 102 27.371 -12.795 4.392 1.00 0.00 C ATOM 1510 CE LYS A 102 27.437 -12.266 5.825 1.00 0.00 C ATOM 1511 NZ LYS A 102 28.296 -13.110 6.681 1.00 0.00 N ATOM 0 H LYS A 102 28.929 -11.063 2.065 1.00 0.00 H new ATOM 0 HA LYS A 102 28.222 -13.113 0.332 1.00 0.00 H new ATOM 0 HB2 LYS A 102 28.385 -14.493 2.467 1.00 0.00 H new ATOM 0 HB3 LYS A 102 29.791 -13.550 2.015 1.00 0.00 H new ATOM 0 HG2 LYS A 102 29.453 -13.341 4.408 1.00 0.00 H new ATOM 0 HG3 LYS A 102 29.129 -11.789 3.663 1.00 0.00 H new ATOM 0 HD2 LYS A 102 26.701 -12.171 3.800 1.00 0.00 H new ATOM 0 HD3 LYS A 102 26.954 -13.802 4.390 1.00 0.00 H new ATOM 0 HE2 LYS A 102 27.820 -11.246 5.819 1.00 0.00 H new ATOM 0 HE3 LYS A 102 26.432 -12.226 6.245 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 28.050 -12.956 7.680 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 28.150 -14.111 6.439 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 29.293 -12.858 6.528 1.00 0.00 H new ATOM 1525 N PRO A 103 25.955 -14.214 1.080 1.00 0.00 N ATOM 1526 CA PRO A 103 24.538 -14.534 1.031 1.00 0.00 C ATOM 1527 C PRO A 103 23.796 -14.052 2.276 1.00 0.00 C ATOM 1528 O PRO A 103 24.319 -14.114 3.389 1.00 0.00 O ATOM 1529 CB PRO A 103 24.464 -16.050 0.854 1.00 0.00 C ATOM 1530 CG PRO A 103 25.763 -16.375 0.118 1.00 0.00 C ATOM 1531 CD PRO A 103 26.756 -15.352 0.666 1.00 0.00 C ATOM 0 HA PRO A 103 24.043 -14.021 0.207 1.00 0.00 H new ATOM 0 HB2 PRO A 103 24.404 -16.566 1.812 1.00 0.00 H new ATOM 0 HB3 PRO A 103 23.588 -16.346 0.277 1.00 0.00 H new ATOM 0 HG2 PRO A 103 26.090 -17.396 0.315 1.00 0.00 H new ATOM 0 HG3 PRO A 103 25.646 -16.281 -0.962 1.00 0.00 H new ATOM 0 HD2 PRO A 103 27.318 -15.762 1.505 1.00 0.00 H new ATOM 0 HD3 PRO A 103 27.482 -15.064 -0.094 1.00 0.00 H new ATOM 1539 N PHE A 104 22.572 -13.566 2.067 1.00 0.00 N ATOM 1540 CA PHE A 104 21.784 -12.871 3.076 1.00 0.00 C ATOM 1541 C PHE A 104 20.337 -13.337 3.168 1.00 0.00 C ATOM 1542 O PHE A 104 19.771 -13.823 2.192 1.00 0.00 O ATOM 1543 CB PHE A 104 21.908 -11.358 2.886 1.00 0.00 C ATOM 1544 CG PHE A 104 22.070 -10.953 1.436 1.00 0.00 C ATOM 1545 CD1 PHE A 104 20.996 -11.084 0.543 1.00 0.00 C ATOM 1546 CD2 PHE A 104 23.301 -10.457 0.981 1.00 0.00 C ATOM 1547 CE1 PHE A 104 21.159 -10.741 -0.806 1.00 0.00 C ATOM 1548 CE2 PHE A 104 23.464 -10.121 -0.369 1.00 0.00 C ATOM 1549 CZ PHE A 104 22.393 -10.265 -1.264 1.00 0.00 C ATOM 0 H PHE A 104 22.093 -13.648 1.170 1.00 0.00 H new ATOM 0 HA PHE A 104 22.205 -13.135 4.046 1.00 0.00 H new ATOM 0 HB2 PHE A 104 21.022 -10.873 3.296 1.00 0.00 H new ATOM 0 HB3 PHE A 104 22.763 -10.995 3.456 1.00 0.00 H new ATOM 0 HD1 PHE A 104 20.043 -11.449 0.895 1.00 0.00 H new ATOM 0 HD2 PHE A 104 24.122 -10.334 1.671 1.00 0.00 H new ATOM 0 HE1 PHE A 104 20.332 -10.844 -1.493 1.00 0.00 H new ATOM 0 HE2 PHE A 104 24.415 -9.751 -0.721 1.00 0.00 H new ATOM 0 HZ PHE A 104 22.521 -10.009 -2.305 1.00 0.00 H new ATOM 1559 N THR A 105 19.745 -13.185 4.354 1.00 0.00 N ATOM 1560 CA THR A 105 18.356 -13.554 4.593 1.00 0.00 C ATOM 1561 C THR A 105 17.369 -12.553 4.008 1.00 0.00 C ATOM 1562 O THR A 105 17.759 -11.478 3.551 1.00 0.00 O ATOM 1563 CB THR A 105 18.099 -13.805 6.083 1.00 0.00 C ATOM 1564 OG1 THR A 105 17.755 -12.589 6.704 1.00 0.00 O ATOM 1565 CG2 THR A 105 19.324 -14.391 6.784 1.00 0.00 C ATOM 0 H THR A 105 20.218 -12.803 5.173 1.00 0.00 H new ATOM 0 HA THR A 105 18.184 -14.490 4.062 1.00 0.00 H new ATOM 0 HB THR A 105 17.286 -14.527 6.164 1.00 0.00 H new ATOM 0 HG1 THR A 105 17.588 -12.744 7.657 1.00 0.00 H new ATOM 0 HG21 THR A 105 19.097 -14.553 7.838 1.00 0.00 H new ATOM 0 HG22 THR A 105 19.589 -15.341 6.320 1.00 0.00 H new ATOM 0 HG23 THR A 105 20.160 -13.698 6.695 1.00 0.00 H new ATOM 1573 N MET A 106 16.083 -12.910 4.022 1.00 0.00 N ATOM 1574 CA MET A 106 15.029 -12.028 3.553 1.00 0.00 C ATOM 1575 C MET A 106 15.019 -10.762 4.419 1.00 0.00 C ATOM 1576 O MET A 106 14.675 -9.679 3.949 1.00 0.00 O ATOM 1577 CB MET A 106 13.702 -12.793 3.657 1.00 0.00 C ATOM 1578 CG MET A 106 12.656 -12.341 2.634 1.00 0.00 C ATOM 1579 SD MET A 106 12.113 -10.618 2.762 1.00 0.00 S ATOM 1580 CE MET A 106 13.111 -9.903 1.432 1.00 0.00 C ATOM 0 H MET A 106 15.751 -13.814 4.358 1.00 0.00 H new ATOM 0 HA MET A 106 15.186 -11.724 2.518 1.00 0.00 H new ATOM 0 HB2 MET A 106 13.894 -13.858 3.523 1.00 0.00 H new ATOM 0 HB3 MET A 106 13.296 -12.666 4.661 1.00 0.00 H new ATOM 0 HG2 MET A 106 13.062 -12.500 1.635 1.00 0.00 H new ATOM 0 HG3 MET A 106 11.782 -12.985 2.729 1.00 0.00 H new ATOM 0 HE1 MET A 106 13.236 -8.834 1.605 1.00 0.00 H new ATOM 0 HE2 MET A 106 14.089 -10.384 1.412 1.00 0.00 H new ATOM 0 HE3 MET A 106 12.610 -10.059 0.477 1.00 0.00 H new ATOM 1590 N ASP A 107 15.405 -10.896 5.692 1.00 0.00 N ATOM 1591 CA ASP A 107 15.503 -9.766 6.606 1.00 0.00 C ATOM 1592 C ASP A 107 16.808 -8.991 6.418 1.00 0.00 C ATOM 1593 O ASP A 107 16.897 -7.827 6.807 1.00 0.00 O ATOM 1594 CB ASP A 107 15.354 -10.246 8.049 1.00 0.00 C ATOM 1595 CG ASP A 107 13.953 -10.774 8.350 1.00 0.00 C ATOM 1596 OD1 ASP A 107 13.082 -10.673 7.457 1.00 0.00 O ATOM 1597 OD2 ASP A 107 13.769 -11.279 9.483 1.00 0.00 O ATOM 0 H ASP A 107 15.657 -11.791 6.112 1.00 0.00 H new ATOM 0 HA ASP A 107 14.690 -9.077 6.377 1.00 0.00 H new ATOM 0 HB2 ASP A 107 16.084 -11.032 8.244 1.00 0.00 H new ATOM 0 HB3 ASP A 107 15.582 -9.424 8.727 1.00 0.00 H new ATOM 1602 N GLY A 108 17.819 -9.632 5.824 1.00 0.00 N ATOM 1603 CA GLY A 108 19.118 -9.011 5.610 1.00 0.00 C ATOM 1604 C GLY A 108 19.031 -7.931 4.536 1.00 0.00 C ATOM 1605 O GLY A 108 19.615 -6.857 4.687 1.00 0.00 O ATOM 0 H GLY A 108 17.755 -10.591 5.482 1.00 0.00 H new ATOM 0 HA2 GLY A 108 19.476 -8.575 6.543 1.00 0.00 H new ATOM 0 HA3 GLY A 108 19.844 -9.768 5.313 1.00 0.00 H new ATOM 1609 N VAL A 109 18.304 -8.207 3.453 1.00 0.00 N ATOM 1610 CA VAL A 109 18.108 -7.218 2.401 1.00 0.00 C ATOM 1611 C VAL A 109 17.095 -6.167 2.828 1.00 0.00 C ATOM 1612 O VAL A 109 17.146 -5.031 2.368 1.00 0.00 O ATOM 1613 CB VAL A 109 17.677 -7.908 1.100 1.00 0.00 C ATOM 1614 CG1 VAL A 109 18.629 -9.052 0.766 1.00 0.00 C ATOM 1615 CG2 VAL A 109 16.257 -8.461 1.225 1.00 0.00 C ATOM 0 H VAL A 109 17.845 -9.102 3.285 1.00 0.00 H new ATOM 0 HA VAL A 109 19.055 -6.708 2.221 1.00 0.00 H new ATOM 0 HB VAL A 109 17.704 -7.165 0.303 1.00 0.00 H new ATOM 0 HG11 VAL A 109 18.311 -9.532 -0.159 1.00 0.00 H new ATOM 0 HG12 VAL A 109 19.639 -8.661 0.643 1.00 0.00 H new ATOM 0 HG13 VAL A 109 18.619 -9.782 1.575 1.00 0.00 H new ATOM 0 HG21 VAL A 109 15.972 -8.946 0.291 1.00 0.00 H new ATOM 0 HG22 VAL A 109 16.219 -9.187 2.037 1.00 0.00 H new ATOM 0 HG23 VAL A 109 15.566 -7.645 1.436 1.00 0.00 H new ATOM 1625 N ALA A 110 16.170 -6.542 3.719 1.00 0.00 N ATOM 1626 CA ALA A 110 15.201 -5.601 4.251 1.00 0.00 C ATOM 1627 C ALA A 110 15.895 -4.614 5.183 1.00 0.00 C ATOM 1628 O ALA A 110 15.419 -3.496 5.369 1.00 0.00 O ATOM 1629 CB ALA A 110 14.105 -6.366 4.991 1.00 0.00 C ATOM 0 H ALA A 110 16.079 -7.491 4.081 1.00 0.00 H new ATOM 0 HA ALA A 110 14.747 -5.039 3.434 1.00 0.00 H new ATOM 0 HB1 ALA A 110 13.376 -5.661 5.391 1.00 0.00 H new ATOM 0 HB2 ALA A 110 13.609 -7.049 4.301 1.00 0.00 H new ATOM 0 HB3 ALA A 110 14.547 -6.935 5.809 1.00 0.00 H new ATOM 1635 N LYS A 111 17.029 -5.021 5.766 1.00 0.00 N ATOM 1636 CA LYS A 111 17.811 -4.164 6.647 1.00 0.00 C ATOM 1637 C LYS A 111 18.503 -3.073 5.843 1.00 0.00 C ATOM 1638 O LYS A 111 18.570 -1.925 6.284 1.00 0.00 O ATOM 1639 CB LYS A 111 18.828 -5.035 7.384 1.00 0.00 C ATOM 1640 CG LYS A 111 19.615 -4.202 8.393 1.00 0.00 C ATOM 1641 CD LYS A 111 20.601 -5.107 9.127 1.00 0.00 C ATOM 1642 CE LYS A 111 19.858 -6.082 10.043 1.00 0.00 C ATOM 1643 NZ LYS A 111 20.802 -6.935 10.786 1.00 0.00 N ATOM 0 H LYS A 111 17.424 -5.952 5.637 1.00 0.00 H new ATOM 0 HA LYS A 111 17.162 -3.673 7.372 1.00 0.00 H new ATOM 0 HB2 LYS A 111 18.315 -5.848 7.897 1.00 0.00 H new ATOM 0 HB3 LYS A 111 19.512 -5.491 6.668 1.00 0.00 H new ATOM 0 HG2 LYS A 111 20.149 -3.400 7.883 1.00 0.00 H new ATOM 0 HG3 LYS A 111 18.935 -3.732 9.104 1.00 0.00 H new ATOM 0 HD2 LYS A 111 21.200 -5.662 8.405 1.00 0.00 H new ATOM 0 HD3 LYS A 111 21.291 -4.501 9.715 1.00 0.00 H new ATOM 0 HE2 LYS A 111 19.237 -5.525 10.744 1.00 0.00 H new ATOM 0 HE3 LYS A 111 19.189 -6.705 9.450 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 20.272 -7.587 11.399 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 21.378 -7.482 10.115 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 21.423 -6.339 11.369 1.00 0.00 H new ATOM 1657 N ALA A 112 19.018 -3.424 4.660 1.00 0.00 N ATOM 1658 CA ALA A 112 19.684 -2.465 3.796 1.00 0.00 C ATOM 1659 C ALA A 112 18.670 -1.528 3.137 1.00 0.00 C ATOM 1660 O ALA A 112 18.903 -0.324 3.049 1.00 0.00 O ATOM 1661 CB ALA A 112 20.485 -3.221 2.741 1.00 0.00 C ATOM 0 H ALA A 112 18.982 -4.372 4.285 1.00 0.00 H new ATOM 0 HA ALA A 112 20.358 -1.850 4.393 1.00 0.00 H new ATOM 0 HB1 ALA A 112 20.989 -2.509 2.087 1.00 0.00 H new ATOM 0 HB2 ALA A 112 21.227 -3.852 3.230 1.00 0.00 H new ATOM 0 HB3 ALA A 112 19.813 -3.843 2.150 1.00 0.00 H new ATOM 1667 N LEU A 113 17.544 -2.074 2.675 1.00 0.00 N ATOM 1668 CA LEU A 113 16.530 -1.268 2.009 1.00 0.00 C ATOM 1669 C LEU A 113 15.835 -0.346 3.010 1.00 0.00 C ATOM 1670 O LEU A 113 15.308 0.695 2.622 1.00 0.00 O ATOM 1671 CB LEU A 113 15.508 -2.186 1.332 1.00 0.00 C ATOM 1672 CG LEU A 113 16.123 -2.944 0.149 1.00 0.00 C ATOM 1673 CD1 LEU A 113 15.110 -3.963 -0.365 1.00 0.00 C ATOM 1674 CD2 LEU A 113 16.475 -1.991 -0.992 1.00 0.00 C ATOM 0 H LEU A 113 17.316 -3.065 2.751 1.00 0.00 H new ATOM 0 HA LEU A 113 17.011 -0.648 1.252 1.00 0.00 H new ATOM 0 HB2 LEU A 113 15.121 -2.899 2.060 1.00 0.00 H new ATOM 0 HB3 LEU A 113 14.661 -1.594 0.984 1.00 0.00 H new ATOM 0 HG LEU A 113 17.034 -3.436 0.490 1.00 0.00 H new ATOM 0 HD11 LEU A 113 15.537 -4.508 -1.207 1.00 0.00 H new ATOM 0 HD12 LEU A 113 14.862 -4.663 0.432 1.00 0.00 H new ATOM 0 HD13 LEU A 113 14.206 -3.446 -0.688 1.00 0.00 H new ATOM 0 HD21 LEU A 113 16.909 -2.556 -1.817 1.00 0.00 H new ATOM 0 HD22 LEU A 113 15.573 -1.484 -1.334 1.00 0.00 H new ATOM 0 HD23 LEU A 113 17.195 -1.252 -0.640 1.00 0.00 H new ATOM 1686 N ALA A 114 15.829 -0.713 4.295 1.00 0.00 N ATOM 1687 CA ALA A 114 15.288 0.150 5.330 1.00 0.00 C ATOM 1688 C ALA A 114 16.272 1.271 5.646 1.00 0.00 C ATOM 1689 O ALA A 114 15.860 2.358 6.052 1.00 0.00 O ATOM 1690 CB ALA A 114 15.004 -0.678 6.584 1.00 0.00 C ATOM 0 H ALA A 114 16.194 -1.603 4.635 1.00 0.00 H new ATOM 0 HA ALA A 114 14.358 0.597 4.979 1.00 0.00 H new ATOM 0 HB1 ALA A 114 14.598 -0.032 7.362 1.00 0.00 H new ATOM 0 HB2 ALA A 114 14.282 -1.460 6.348 1.00 0.00 H new ATOM 0 HB3 ALA A 114 15.929 -1.133 6.937 1.00 0.00 H new ATOM 1696 N ALA A 115 17.568 1.019 5.463 1.00 0.00 N ATOM 1697 CA ALA A 115 18.593 2.021 5.708 1.00 0.00 C ATOM 1698 C ALA A 115 18.560 3.106 4.627 1.00 0.00 C ATOM 1699 O ALA A 115 19.147 4.174 4.802 1.00 0.00 O ATOM 1700 CB ALA A 115 19.959 1.339 5.763 1.00 0.00 C ATOM 0 H ALA A 115 17.930 0.121 5.143 1.00 0.00 H new ATOM 0 HA ALA A 115 18.402 2.508 6.664 1.00 0.00 H new ATOM 0 HB1 ALA A 115 20.731 2.086 5.946 1.00 0.00 H new ATOM 0 HB2 ALA A 115 19.967 0.604 6.568 1.00 0.00 H new ATOM 0 HB3 ALA A 115 20.155 0.840 4.814 1.00 0.00 H new ATOM 1706 N LEU A 116 17.878 2.836 3.510 1.00 0.00 N ATOM 1707 CA LEU A 116 17.666 3.846 2.481 1.00 0.00 C ATOM 1708 C LEU A 116 16.623 4.874 2.926 1.00 0.00 C ATOM 1709 O LEU A 116 16.542 5.955 2.344 1.00 0.00 O ATOM 1710 CB LEU A 116 17.210 3.175 1.178 1.00 0.00 C ATOM 1711 CG LEU A 116 18.230 2.157 0.658 1.00 0.00 C ATOM 1712 CD1 LEU A 116 17.689 1.520 -0.620 1.00 0.00 C ATOM 1713 CD2 LEU A 116 19.566 2.828 0.351 1.00 0.00 C ATOM 0 H LEU A 116 17.466 1.927 3.300 1.00 0.00 H new ATOM 0 HA LEU A 116 18.610 4.365 2.313 1.00 0.00 H new ATOM 0 HB2 LEU A 116 16.255 2.676 1.344 1.00 0.00 H new ATOM 0 HB3 LEU A 116 17.043 3.939 0.418 1.00 0.00 H new ATOM 0 HG LEU A 116 18.389 1.401 1.427 1.00 0.00 H new ATOM 0 HD11 LEU A 116 18.409 0.794 -0.997 1.00 0.00 H new ATOM 0 HD12 LEU A 116 16.746 1.018 -0.405 1.00 0.00 H new ATOM 0 HD13 LEU A 116 17.526 2.293 -1.371 1.00 0.00 H new ATOM 0 HD21 LEU A 116 20.272 2.083 -0.016 1.00 0.00 H new ATOM 0 HD22 LEU A 116 19.421 3.596 -0.409 1.00 0.00 H new ATOM 0 HD23 LEU A 116 19.961 3.285 1.258 1.00 0.00 H new ATOM 1725 N LEU A 117 15.823 4.544 3.950 1.00 0.00 N ATOM 1726 CA LEU A 117 14.737 5.404 4.405 1.00 0.00 C ATOM 1727 C LEU A 117 14.993 5.930 5.818 1.00 0.00 C ATOM 1728 O LEU A 117 14.346 6.892 6.242 1.00 0.00 O ATOM 1729 CB LEU A 117 13.424 4.609 4.383 1.00 0.00 C ATOM 1730 CG LEU A 117 12.761 4.600 3.002 1.00 0.00 C ATOM 1731 CD1 LEU A 117 13.531 3.744 1.997 1.00 0.00 C ATOM 1732 CD2 LEU A 117 11.355 4.022 3.136 1.00 0.00 C ATOM 0 H LEU A 117 15.915 3.677 4.479 1.00 0.00 H new ATOM 0 HA LEU A 117 14.673 6.261 3.734 1.00 0.00 H new ATOM 0 HB2 LEU A 117 13.620 3.583 4.694 1.00 0.00 H new ATOM 0 HB3 LEU A 117 12.733 5.036 5.110 1.00 0.00 H new ATOM 0 HG LEU A 117 12.744 5.627 2.637 1.00 0.00 H new ATOM 0 HD11 LEU A 117 13.023 3.769 1.033 1.00 0.00 H new ATOM 0 HD12 LEU A 117 14.542 4.136 1.884 1.00 0.00 H new ATOM 0 HD13 LEU A 117 13.579 2.716 2.356 1.00 0.00 H new ATOM 0 HD21 LEU A 117 10.872 4.010 2.159 1.00 0.00 H new ATOM 0 HD22 LEU A 117 11.415 3.005 3.524 1.00 0.00 H new ATOM 0 HD23 LEU A 117 10.772 4.638 3.821 1.00 0.00 H new ATOM 1744 N VAL A 118 15.926 5.315 6.552 1.00 0.00 N ATOM 1745 CA VAL A 118 16.221 5.698 7.928 1.00 0.00 C ATOM 1746 C VAL A 118 16.870 7.079 8.021 1.00 0.00 C ATOM 1747 O VAL A 118 17.640 7.423 7.096 1.00 0.00 O ATOM 1748 CB VAL A 118 17.051 4.608 8.607 1.00 0.00 C ATOM 1749 CG1 VAL A 118 18.507 4.685 8.169 1.00 0.00 C ATOM 1750 CG2 VAL A 118 16.987 4.764 10.127 1.00 0.00 C ATOM 0 H VAL A 118 16.494 4.541 6.207 1.00 0.00 H new ATOM 0 HA VAL A 118 15.278 5.787 8.468 1.00 0.00 H new ATOM 0 HB VAL A 118 16.637 3.643 8.315 1.00 0.00 H new ATOM 0 HG11 VAL A 118 19.078 3.900 8.665 1.00 0.00 H new ATOM 0 HG12 VAL A 118 18.570 4.552 7.089 1.00 0.00 H new ATOM 0 HG13 VAL A 118 18.917 5.658 8.439 1.00 0.00 H new ATOM 0 HG21 VAL A 118 17.582 3.982 10.598 1.00 0.00 H new ATOM 0 HG22 VAL A 118 17.381 5.740 10.410 1.00 0.00 H new ATOM 0 HG23 VAL A 118 15.952 4.681 10.458 1.00 0.00 H new TER 1760 VAL A 118