USER MOD reduce.3.24.130724 H: found=0, std=0, add=792, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 792 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 29 CYS SG : rot -46:sc= 0.32 USER MOD Set 1.2: A 32 CYS SG : rot 74:sc= -0.117 USER MOD Set 2.1: A 7 THR OG1 : rot -45:sc= 1.01 USER MOD Set 2.2: A 10 SER OG : rot 180:sc= 1.37 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 GLN : amide:sc= 0.579 K(o=0.58,f=-0.078) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot -76:sc= 1.29 USER MOD Single : A 16 SER OG : rot 138:sc= 1.21 USER MOD Single : A 33 LYS NZ :NH3+ -168:sc= 0.796 (180deg=0.689) USER MOD Single : A 34 MET CE :methyl 176:sc= 0 (180deg=-0.0162) USER MOD Single : A 44 GLN : amide:sc= 0.354 X(o=0.35,f=0) USER MOD Single : A 46 MET CE :methyl 179:sc= 0 (180deg=-0.0013) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 LYS NZ :NH3+ 171:sc= 3.58 (180deg=3.5) USER MOD Single : A 54 LYS NZ :NH3+ 151:sc= 1.28 (180deg=1.17) USER MOD Single : A 60 ASN : amide:sc= 0.69 K(o=0.69,f=-5!) USER MOD Single : A 61 GLN : amide:sc= -0.748 X(o=-0.75,f=-0.99) USER MOD Single : A 63 THR OG1 : rot 62:sc= 0.762 USER MOD Single : A 66 LYS NZ :NH3+ -162:sc= 1.84 (180deg=1.38) USER MOD Single : A 67 TYR OH : rot -124:sc= 1.36 USER MOD Single : A 70 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 74 THR OG1 : rot 105:sc= 1.25 USER MOD Single : A 79 LYS NZ :NH3+ -156:sc= 1.97 (180deg=1.12) USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 LYS NZ :NH3+ 161:sc= 1.22 (180deg=1.11) USER MOD Single : A 97 GLN : amide:sc= 0.327 K(o=0.33,f=-0.57) USER MOD Single : A 101 ASN : amide:sc= 0.846 K(o=0.85,f=-0.026) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 HIS : no HD1:sc=-0.00538 X(o=-0.0054,f=-0.28) USER MOD ----------------------------------------------------------------- ATOM 30 N ILE A 3 -1.155 -4.802 -3.661 1.00 0.00 N ATOM 31 CA ILE A 3 -2.590 -4.947 -3.858 1.00 0.00 C ATOM 32 C ILE A 3 -3.090 -6.060 -2.928 1.00 0.00 C ATOM 33 O ILE A 3 -2.366 -7.009 -2.609 1.00 0.00 O ATOM 34 CB ILE A 3 -2.831 -5.231 -5.363 1.00 0.00 C ATOM 35 CG1 ILE A 3 -2.443 -3.965 -6.159 1.00 0.00 C ATOM 36 CG2 ILE A 3 -4.272 -5.659 -5.687 1.00 0.00 C ATOM 37 CD1 ILE A 3 -2.501 -4.110 -7.678 1.00 0.00 C ATOM 0 HA ILE A 3 -3.151 -4.048 -3.603 1.00 0.00 H new ATOM 0 HB ILE A 3 -2.210 -6.079 -5.650 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -3.105 -3.151 -5.862 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -1.432 -3.673 -5.876 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -4.366 -5.840 -6.758 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -4.512 -6.572 -5.142 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -4.962 -4.868 -5.391 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -2.211 -3.168 -8.145 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -1.817 -4.897 -7.995 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -3.516 -4.368 -7.980 1.00 0.00 H new ATOM 49 N VAL A 4 -4.344 -5.940 -2.505 1.00 0.00 N ATOM 50 CA VAL A 4 -5.001 -6.814 -1.542 1.00 0.00 C ATOM 51 C VAL A 4 -5.976 -7.704 -2.322 1.00 0.00 C ATOM 52 O VAL A 4 -6.371 -7.380 -3.442 1.00 0.00 O ATOM 53 CB VAL A 4 -5.692 -5.936 -0.471 1.00 0.00 C ATOM 54 CG1 VAL A 4 -6.272 -6.748 0.699 1.00 0.00 C ATOM 55 CG2 VAL A 4 -4.735 -4.885 0.126 1.00 0.00 C ATOM 0 H VAL A 4 -4.957 -5.197 -2.840 1.00 0.00 H new ATOM 0 HA VAL A 4 -4.303 -7.463 -1.014 1.00 0.00 H new ATOM 0 HB VAL A 4 -6.505 -5.448 -1.009 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -6.742 -6.072 1.413 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -7.015 -7.450 0.321 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -5.471 -7.298 1.193 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -5.265 -4.293 0.872 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -3.889 -5.388 0.595 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -4.374 -4.230 -0.667 1.00 0.00 H new ATOM 65 N LYS A 5 -6.394 -8.825 -1.742 1.00 0.00 N ATOM 66 CA LYS A 5 -7.380 -9.737 -2.321 1.00 0.00 C ATOM 67 C LYS A 5 -8.513 -9.845 -1.307 1.00 0.00 C ATOM 68 O LYS A 5 -8.242 -9.905 -0.105 1.00 0.00 O ATOM 69 CB LYS A 5 -6.762 -11.124 -2.591 1.00 0.00 C ATOM 70 CG LYS A 5 -6.026 -11.290 -3.935 1.00 0.00 C ATOM 71 CD LYS A 5 -4.780 -10.419 -4.181 1.00 0.00 C ATOM 72 CE LYS A 5 -3.710 -10.485 -3.078 1.00 0.00 C ATOM 73 NZ LYS A 5 -3.036 -11.806 -2.999 1.00 0.00 N ATOM 0 H LYS A 5 -6.049 -9.134 -0.833 1.00 0.00 H new ATOM 0 HA LYS A 5 -7.739 -9.362 -3.280 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -6.062 -11.350 -1.787 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -7.556 -11.869 -2.541 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -5.729 -12.335 -4.028 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -6.739 -11.089 -4.735 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -4.326 -10.720 -5.125 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -5.097 -9.383 -4.296 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -2.962 -9.713 -3.259 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -4.173 -10.262 -2.117 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -2.327 -11.789 -2.239 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -3.741 -12.544 -2.798 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -2.568 -12.012 -3.905 1.00 0.00 H new ATOM 87 N ALA A 6 -9.758 -9.880 -1.777 1.00 0.00 N ATOM 88 CA ALA A 6 -10.941 -10.001 -0.940 1.00 0.00 C ATOM 89 C ALA A 6 -11.931 -10.994 -1.552 1.00 0.00 C ATOM 90 O ALA A 6 -11.763 -11.445 -2.688 1.00 0.00 O ATOM 91 CB ALA A 6 -11.575 -8.615 -0.757 1.00 0.00 C ATOM 0 H ALA A 6 -9.973 -9.824 -2.772 1.00 0.00 H new ATOM 0 HA ALA A 6 -10.659 -10.387 0.040 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -12.462 -8.701 -0.130 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -10.858 -7.947 -0.281 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -11.856 -8.212 -1.730 1.00 0.00 H new ATOM 97 N THR A 7 -12.978 -11.307 -0.795 1.00 0.00 N ATOM 98 CA THR A 7 -14.069 -12.196 -1.176 1.00 0.00 C ATOM 99 C THR A 7 -15.387 -11.470 -0.893 1.00 0.00 C ATOM 100 O THR A 7 -15.364 -10.414 -0.262 1.00 0.00 O ATOM 101 CB THR A 7 -13.971 -13.519 -0.386 1.00 0.00 C ATOM 102 OG1 THR A 7 -14.120 -13.302 1.008 1.00 0.00 O ATOM 103 CG2 THR A 7 -12.661 -14.274 -0.637 1.00 0.00 C ATOM 0 H THR A 7 -13.094 -10.929 0.145 1.00 0.00 H new ATOM 0 HA THR A 7 -14.015 -12.447 -2.235 1.00 0.00 H new ATOM 0 HB THR A 7 -14.791 -14.137 -0.753 1.00 0.00 H new ATOM 0 HG1 THR A 7 -13.573 -12.535 1.280 1.00 0.00 H new ATOM 0 HG21 THR A 7 -12.654 -15.194 -0.053 1.00 0.00 H new ATOM 0 HG22 THR A 7 -12.578 -14.516 -1.697 1.00 0.00 H new ATOM 0 HG23 THR A 7 -11.818 -13.649 -0.340 1.00 0.00 H new ATOM 111 N ASP A 8 -16.540 -12.025 -1.278 1.00 0.00 N ATOM 112 CA ASP A 8 -17.838 -11.437 -0.919 1.00 0.00 C ATOM 113 C ASP A 8 -17.950 -11.186 0.593 1.00 0.00 C ATOM 114 O ASP A 8 -18.525 -10.181 1.015 1.00 0.00 O ATOM 115 CB ASP A 8 -19.000 -12.321 -1.399 1.00 0.00 C ATOM 116 CG ASP A 8 -20.303 -12.010 -0.638 1.00 0.00 C ATOM 117 OD1 ASP A 8 -20.998 -11.024 -0.979 1.00 0.00 O ATOM 118 OD2 ASP A 8 -20.614 -12.774 0.306 1.00 0.00 O ATOM 0 H ASP A 8 -16.603 -12.877 -1.836 1.00 0.00 H new ATOM 0 HA ASP A 8 -17.902 -10.474 -1.426 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -19.157 -12.168 -2.467 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -18.740 -13.371 -1.262 1.00 0.00 H new ATOM 123 N GLN A 9 -17.367 -12.072 1.408 1.00 0.00 N ATOM 124 CA GLN A 9 -17.444 -11.980 2.859 1.00 0.00 C ATOM 125 C GLN A 9 -16.522 -10.891 3.425 1.00 0.00 C ATOM 126 O GLN A 9 -16.859 -10.292 4.449 1.00 0.00 O ATOM 127 CB GLN A 9 -17.118 -13.343 3.486 1.00 0.00 C ATOM 128 CG GLN A 9 -18.177 -14.422 3.189 1.00 0.00 C ATOM 129 CD GLN A 9 -17.965 -15.155 1.860 1.00 0.00 C ATOM 130 OE1 GLN A 9 -17.065 -15.982 1.730 1.00 0.00 O ATOM 131 NE2 GLN A 9 -18.778 -14.901 0.847 1.00 0.00 N ATOM 0 H GLN A 9 -16.829 -12.872 1.074 1.00 0.00 H new ATOM 0 HA GLN A 9 -18.464 -11.695 3.118 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -16.150 -13.683 3.116 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -17.023 -13.225 4.565 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -18.174 -15.152 3.999 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -19.163 -13.957 3.182 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -19.526 -14.215 0.953 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -18.657 -15.391 -0.039 1.00 0.00 H new ATOM 140 N SER A 10 -15.383 -10.619 2.783 1.00 0.00 N ATOM 141 CA SER A 10 -14.328 -9.765 3.333 1.00 0.00 C ATOM 142 C SER A 10 -14.162 -8.430 2.614 1.00 0.00 C ATOM 143 O SER A 10 -13.584 -7.501 3.183 1.00 0.00 O ATOM 144 CB SER A 10 -13.019 -10.562 3.368 1.00 0.00 C ATOM 145 OG SER A 10 -12.714 -11.137 2.104 1.00 0.00 O ATOM 0 H SER A 10 -15.165 -10.989 1.858 1.00 0.00 H new ATOM 0 HA SER A 10 -14.625 -9.486 4.344 1.00 0.00 H new ATOM 0 HB2 SER A 10 -12.204 -9.907 3.675 1.00 0.00 H new ATOM 0 HB3 SER A 10 -13.094 -11.350 4.117 1.00 0.00 H new ATOM 0 HG SER A 10 -11.872 -11.635 2.166 1.00 0.00 H new ATOM 151 N PHE A 11 -14.734 -8.280 1.418 1.00 0.00 N ATOM 152 CA PHE A 11 -14.781 -7.027 0.675 1.00 0.00 C ATOM 153 C PHE A 11 -15.313 -5.906 1.564 1.00 0.00 C ATOM 154 O PHE A 11 -14.788 -4.795 1.535 1.00 0.00 O ATOM 155 CB PHE A 11 -15.669 -7.237 -0.561 1.00 0.00 C ATOM 156 CG PHE A 11 -15.797 -6.058 -1.506 1.00 0.00 C ATOM 157 CD1 PHE A 11 -16.678 -4.998 -1.216 1.00 0.00 C ATOM 158 CD2 PHE A 11 -15.088 -6.060 -2.721 1.00 0.00 C ATOM 159 CE1 PHE A 11 -16.836 -3.943 -2.131 1.00 0.00 C ATOM 160 CE2 PHE A 11 -15.270 -5.020 -3.645 1.00 0.00 C ATOM 161 CZ PHE A 11 -16.141 -3.957 -3.351 1.00 0.00 C ATOM 0 H PHE A 11 -15.189 -9.051 0.929 1.00 0.00 H new ATOM 0 HA PHE A 11 -13.782 -6.734 0.353 1.00 0.00 H new ATOM 0 HB2 PHE A 11 -15.277 -8.085 -1.123 1.00 0.00 H new ATOM 0 HB3 PHE A 11 -16.667 -7.513 -0.222 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -17.233 -4.996 -0.289 1.00 0.00 H new ATOM 0 HD2 PHE A 11 -14.402 -6.864 -2.943 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -17.494 -3.119 -1.895 1.00 0.00 H new ATOM 0 HE2 PHE A 11 -14.739 -5.036 -4.585 1.00 0.00 H new ATOM 0 HZ PHE A 11 -16.275 -3.154 -4.061 1.00 0.00 H new ATOM 171 N SER A 12 -16.316 -6.198 2.393 1.00 0.00 N ATOM 172 CA SER A 12 -16.978 -5.189 3.202 1.00 0.00 C ATOM 173 C SER A 12 -16.116 -4.732 4.381 1.00 0.00 C ATOM 174 O SER A 12 -16.309 -3.621 4.873 1.00 0.00 O ATOM 175 CB SER A 12 -18.328 -5.730 3.687 1.00 0.00 C ATOM 176 OG SER A 12 -19.053 -6.315 2.613 1.00 0.00 O ATOM 0 H SER A 12 -16.687 -7.140 2.518 1.00 0.00 H new ATOM 0 HA SER A 12 -17.141 -4.309 2.579 1.00 0.00 H new ATOM 0 HB2 SER A 12 -18.168 -6.471 4.470 1.00 0.00 H new ATOM 0 HB3 SER A 12 -18.911 -4.922 4.128 1.00 0.00 H new ATOM 0 HG SER A 12 -19.910 -6.655 2.944 1.00 0.00 H new ATOM 182 N ALA A 13 -15.157 -5.548 4.833 1.00 0.00 N ATOM 183 CA ALA A 13 -14.163 -5.111 5.792 1.00 0.00 C ATOM 184 C ALA A 13 -13.121 -4.260 5.065 1.00 0.00 C ATOM 185 O ALA A 13 -12.790 -3.162 5.509 1.00 0.00 O ATOM 186 CB ALA A 13 -13.510 -6.323 6.468 1.00 0.00 C ATOM 0 H ALA A 13 -15.057 -6.520 4.541 1.00 0.00 H new ATOM 0 HA ALA A 13 -14.634 -4.512 6.571 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -12.765 -5.981 7.186 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -14.272 -6.906 6.985 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -13.028 -6.945 5.713 1.00 0.00 H new ATOM 192 N GLU A 14 -12.617 -4.757 3.930 1.00 0.00 N ATOM 193 CA GLU A 14 -11.484 -4.157 3.241 1.00 0.00 C ATOM 194 C GLU A 14 -11.824 -2.785 2.673 1.00 0.00 C ATOM 195 O GLU A 14 -10.979 -1.889 2.715 1.00 0.00 O ATOM 196 CB GLU A 14 -10.986 -5.086 2.122 1.00 0.00 C ATOM 197 CG GLU A 14 -10.284 -6.332 2.682 1.00 0.00 C ATOM 198 CD GLU A 14 -8.985 -6.037 3.460 1.00 0.00 C ATOM 199 OE1 GLU A 14 -8.427 -4.923 3.339 1.00 0.00 O ATOM 200 OE2 GLU A 14 -8.520 -6.929 4.207 1.00 0.00 O ATOM 0 H GLU A 14 -12.988 -5.587 3.468 1.00 0.00 H new ATOM 0 HA GLU A 14 -10.690 -4.021 3.976 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -11.829 -5.392 1.502 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -10.297 -4.540 1.477 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -10.975 -6.859 3.340 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -10.054 -7.006 1.857 1.00 0.00 H new ATOM 207 N THR A 15 -13.047 -2.589 2.182 1.00 0.00 N ATOM 208 CA THR A 15 -13.452 -1.338 1.557 1.00 0.00 C ATOM 209 C THR A 15 -13.879 -0.277 2.585 1.00 0.00 C ATOM 210 O THR A 15 -14.345 0.797 2.196 1.00 0.00 O ATOM 211 CB THR A 15 -14.508 -1.611 0.474 1.00 0.00 C ATOM 212 OG1 THR A 15 -15.617 -2.334 0.972 1.00 0.00 O ATOM 213 CG2 THR A 15 -13.893 -2.388 -0.700 1.00 0.00 C ATOM 0 H THR A 15 -13.782 -3.295 2.208 1.00 0.00 H new ATOM 0 HA THR A 15 -12.586 -0.900 1.061 1.00 0.00 H new ATOM 0 HB THR A 15 -14.860 -0.637 0.135 1.00 0.00 H new ATOM 0 HG1 THR A 15 -15.370 -3.276 1.083 1.00 0.00 H new ATOM 0 HG21 THR A 15 -14.657 -2.571 -1.455 1.00 0.00 H new ATOM 0 HG22 THR A 15 -13.083 -1.805 -1.137 1.00 0.00 H new ATOM 0 HG23 THR A 15 -13.502 -3.340 -0.341 1.00 0.00 H new ATOM 221 N SER A 16 -13.686 -0.541 3.884 1.00 0.00 N ATOM 222 CA SER A 16 -14.247 0.266 4.965 1.00 0.00 C ATOM 223 C SER A 16 -13.162 0.831 5.890 1.00 0.00 C ATOM 224 O SER A 16 -13.369 0.950 7.100 1.00 0.00 O ATOM 225 CB SER A 16 -15.313 -0.552 5.706 1.00 0.00 C ATOM 226 OG SER A 16 -16.319 -0.987 4.811 1.00 0.00 O ATOM 0 H SER A 16 -13.130 -1.330 4.213 1.00 0.00 H new ATOM 0 HA SER A 16 -14.733 1.145 4.541 1.00 0.00 H new ATOM 0 HB2 SER A 16 -14.849 -1.413 6.186 1.00 0.00 H new ATOM 0 HB3 SER A 16 -15.758 0.052 6.496 1.00 0.00 H new ATOM 0 HG SER A 16 -16.560 -1.915 5.015 1.00 0.00 H new ATOM 232 N GLU A 17 -11.993 1.171 5.330 1.00 0.00 N ATOM 233 CA GLU A 17 -10.842 1.648 6.107 1.00 0.00 C ATOM 234 C GLU A 17 -10.152 2.870 5.482 1.00 0.00 C ATOM 235 O GLU A 17 -9.142 3.343 6.012 1.00 0.00 O ATOM 236 CB GLU A 17 -9.820 0.509 6.282 1.00 0.00 C ATOM 237 CG GLU A 17 -10.370 -0.742 6.979 1.00 0.00 C ATOM 238 CD GLU A 17 -9.255 -1.766 7.256 1.00 0.00 C ATOM 239 OE1 GLU A 17 -8.495 -2.104 6.320 1.00 0.00 O ATOM 240 OE2 GLU A 17 -9.133 -2.241 8.409 1.00 0.00 O ATOM 0 H GLU A 17 -11.819 1.123 4.326 1.00 0.00 H new ATOM 0 HA GLU A 17 -11.229 1.965 7.075 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -9.441 0.225 5.300 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -8.972 0.884 6.855 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -10.846 -0.458 7.917 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -11.139 -1.199 6.356 1.00 0.00 H new ATOM 247 N GLY A 18 -10.655 3.390 4.362 1.00 0.00 N ATOM 248 CA GLY A 18 -9.976 4.432 3.605 1.00 0.00 C ATOM 249 C GLY A 18 -10.640 4.626 2.265 1.00 0.00 C ATOM 250 O GLY A 18 -11.762 4.164 2.050 1.00 0.00 O ATOM 0 H GLY A 18 -11.545 3.098 3.957 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -9.993 5.367 4.165 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -8.929 4.164 3.464 1.00 0.00 H new ATOM 254 N VAL A 19 -9.952 5.329 1.374 1.00 0.00 N ATOM 255 CA VAL A 19 -10.327 5.401 -0.023 1.00 0.00 C ATOM 256 C VAL A 19 -9.824 4.082 -0.619 1.00 0.00 C ATOM 257 O VAL A 19 -8.689 3.675 -0.347 1.00 0.00 O ATOM 258 CB VAL A 19 -9.676 6.634 -0.686 1.00 0.00 C ATOM 259 CG1 VAL A 19 -10.553 7.120 -1.853 1.00 0.00 C ATOM 260 CG2 VAL A 19 -9.449 7.820 0.270 1.00 0.00 C ATOM 0 H VAL A 19 -9.116 5.865 1.606 1.00 0.00 H new ATOM 0 HA VAL A 19 -11.399 5.520 -0.178 1.00 0.00 H new ATOM 0 HB VAL A 19 -8.695 6.300 -1.025 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -10.090 7.990 -2.318 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -10.651 6.324 -2.591 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -11.540 7.391 -1.478 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -8.988 8.644 -0.275 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -10.405 8.146 0.679 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -8.792 7.511 1.083 1.00 0.00 H new ATOM 270 N VAL A 20 -10.647 3.387 -1.397 1.00 0.00 N ATOM 271 CA VAL A 20 -10.326 2.061 -1.901 1.00 0.00 C ATOM 272 C VAL A 20 -10.801 1.981 -3.348 1.00 0.00 C ATOM 273 O VAL A 20 -11.831 2.557 -3.700 1.00 0.00 O ATOM 274 CB VAL A 20 -10.961 0.970 -1.001 1.00 0.00 C ATOM 275 CG1 VAL A 20 -10.487 -0.432 -1.417 1.00 0.00 C ATOM 276 CG2 VAL A 20 -10.636 1.175 0.491 1.00 0.00 C ATOM 0 H VAL A 20 -11.559 3.731 -1.696 1.00 0.00 H new ATOM 0 HA VAL A 20 -9.251 1.883 -1.876 1.00 0.00 H new ATOM 0 HB VAL A 20 -12.039 1.057 -1.137 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -10.947 -1.179 -0.770 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -10.775 -0.621 -2.451 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -9.402 -0.491 -1.325 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -11.104 0.384 1.077 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -9.556 1.143 0.636 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -11.017 2.143 0.817 1.00 0.00 H new ATOM 286 N LEU A 21 -10.071 1.242 -4.179 1.00 0.00 N ATOM 287 CA LEU A 21 -10.471 0.878 -5.529 1.00 0.00 C ATOM 288 C LEU A 21 -10.449 -0.645 -5.572 1.00 0.00 C ATOM 289 O LEU A 21 -9.520 -1.258 -5.047 1.00 0.00 O ATOM 290 CB LEU A 21 -9.525 1.557 -6.536 1.00 0.00 C ATOM 291 CG LEU A 21 -9.787 1.243 -8.023 1.00 0.00 C ATOM 292 CD1 LEU A 21 -9.310 2.419 -8.888 1.00 0.00 C ATOM 293 CD2 LEU A 21 -9.039 -0.013 -8.496 1.00 0.00 C ATOM 0 H LEU A 21 -9.157 0.870 -3.920 1.00 0.00 H new ATOM 0 HA LEU A 21 -11.470 1.219 -5.801 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -9.590 2.636 -6.396 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -8.502 1.265 -6.298 1.00 0.00 H new ATOM 0 HG LEU A 21 -10.859 1.075 -8.126 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -9.495 2.196 -9.939 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -9.853 3.321 -8.607 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -8.242 2.575 -8.733 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -9.256 -0.191 -9.549 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -7.966 0.132 -8.366 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -9.363 -0.872 -7.908 1.00 0.00 H new ATOM 305 N ALA A 22 -11.468 -1.266 -6.160 1.00 0.00 N ATOM 306 CA ALA A 22 -11.616 -2.712 -6.167 1.00 0.00 C ATOM 307 C ALA A 22 -11.866 -3.170 -7.593 1.00 0.00 C ATOM 308 O ALA A 22 -12.821 -2.730 -8.231 1.00 0.00 O ATOM 309 CB ALA A 22 -12.742 -3.138 -5.223 1.00 0.00 C ATOM 0 H ALA A 22 -12.217 -0.774 -6.647 1.00 0.00 H new ATOM 0 HA ALA A 22 -10.704 -3.186 -5.805 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -12.840 -4.223 -5.240 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -12.511 -2.810 -4.210 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -13.679 -2.684 -5.546 1.00 0.00 H new ATOM 315 N ASP A 23 -10.981 -4.036 -8.076 1.00 0.00 N ATOM 316 CA ASP A 23 -10.983 -4.582 -9.422 1.00 0.00 C ATOM 317 C ASP A 23 -11.684 -5.938 -9.396 1.00 0.00 C ATOM 318 O ASP A 23 -11.147 -6.939 -8.906 1.00 0.00 O ATOM 319 CB ASP A 23 -9.545 -4.688 -9.938 1.00 0.00 C ATOM 320 CG ASP A 23 -9.449 -5.436 -11.277 1.00 0.00 C ATOM 321 OD1 ASP A 23 -10.339 -5.269 -12.139 1.00 0.00 O ATOM 322 OD2 ASP A 23 -8.440 -6.153 -11.469 1.00 0.00 O ATOM 0 H ASP A 23 -10.209 -4.390 -7.511 1.00 0.00 H new ATOM 0 HA ASP A 23 -11.525 -3.927 -10.105 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -9.131 -3.687 -10.055 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -8.934 -5.201 -9.195 1.00 0.00 H new ATOM 327 N PHE A 24 -12.930 -5.926 -9.858 1.00 0.00 N ATOM 328 CA PHE A 24 -13.743 -7.091 -10.136 1.00 0.00 C ATOM 329 C PHE A 24 -13.223 -7.657 -11.452 1.00 0.00 C ATOM 330 O PHE A 24 -13.294 -6.977 -12.484 1.00 0.00 O ATOM 331 CB PHE A 24 -15.219 -6.677 -10.259 1.00 0.00 C ATOM 332 CG PHE A 24 -15.869 -6.243 -8.956 1.00 0.00 C ATOM 333 CD1 PHE A 24 -15.510 -5.025 -8.348 1.00 0.00 C ATOM 334 CD2 PHE A 24 -16.835 -7.064 -8.342 1.00 0.00 C ATOM 335 CE1 PHE A 24 -16.072 -4.659 -7.115 1.00 0.00 C ATOM 336 CE2 PHE A 24 -17.412 -6.684 -7.118 1.00 0.00 C ATOM 337 CZ PHE A 24 -17.026 -5.485 -6.501 1.00 0.00 C ATOM 0 H PHE A 24 -13.420 -5.054 -10.057 1.00 0.00 H new ATOM 0 HA PHE A 24 -13.683 -7.834 -9.341 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -15.294 -5.860 -10.976 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -15.784 -7.514 -10.669 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -14.800 -4.370 -8.832 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -17.133 -7.989 -8.813 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -15.769 -3.739 -6.637 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -18.153 -7.316 -6.652 1.00 0.00 H new ATOM 0 HZ PHE A 24 -17.462 -5.198 -5.555 1.00 0.00 H new ATOM 347 N TRP A 25 -12.694 -8.882 -11.417 1.00 0.00 N ATOM 348 CA TRP A 25 -11.961 -9.478 -12.530 1.00 0.00 C ATOM 349 C TRP A 25 -12.203 -10.988 -12.597 1.00 0.00 C ATOM 350 O TRP A 25 -12.913 -11.538 -11.754 1.00 0.00 O ATOM 351 CB TRP A 25 -10.461 -9.172 -12.360 1.00 0.00 C ATOM 352 CG TRP A 25 -9.721 -9.992 -11.344 1.00 0.00 C ATOM 353 CD1 TRP A 25 -9.900 -9.936 -10.007 1.00 0.00 C ATOM 354 CD2 TRP A 25 -8.695 -11.011 -11.559 1.00 0.00 C ATOM 355 NE1 TRP A 25 -9.094 -10.864 -9.382 1.00 0.00 N ATOM 356 CE2 TRP A 25 -8.311 -11.542 -10.290 1.00 0.00 C ATOM 357 CE3 TRP A 25 -8.040 -11.537 -12.695 1.00 0.00 C ATOM 358 CZ2 TRP A 25 -7.331 -12.536 -10.156 1.00 0.00 C ATOM 359 CZ3 TRP A 25 -7.051 -12.531 -12.571 1.00 0.00 C ATOM 360 CH2 TRP A 25 -6.699 -13.036 -11.306 1.00 0.00 C ATOM 0 H TRP A 25 -12.765 -9.493 -10.604 1.00 0.00 H new ATOM 0 HA TRP A 25 -12.316 -9.049 -13.467 1.00 0.00 H new ATOM 0 HB2 TRP A 25 -9.974 -9.305 -13.326 1.00 0.00 H new ATOM 0 HB3 TRP A 25 -10.356 -8.121 -12.092 1.00 0.00 H new ATOM 0 HD1 TRP A 25 -10.576 -9.263 -9.501 1.00 0.00 H new ATOM 0 HE1 TRP A 25 -9.079 -11.028 -8.375 1.00 0.00 H new ATOM 0 HE3 TRP A 25 -8.303 -11.170 -13.676 1.00 0.00 H new ATOM 0 HZ2 TRP A 25 -7.065 -12.913 -9.179 1.00 0.00 H new ATOM 0 HZ3 TRP A 25 -6.558 -12.909 -13.455 1.00 0.00 H new ATOM 0 HH2 TRP A 25 -5.946 -13.805 -11.220 1.00 0.00 H new ATOM 371 N ALA A 26 -11.606 -11.653 -13.590 1.00 0.00 N ATOM 372 CA ALA A 26 -11.496 -13.105 -13.695 1.00 0.00 C ATOM 373 C ALA A 26 -10.318 -13.401 -14.638 1.00 0.00 C ATOM 374 O ALA A 26 -10.063 -12.602 -15.546 1.00 0.00 O ATOM 375 CB ALA A 26 -12.788 -13.720 -14.246 1.00 0.00 C ATOM 0 H ALA A 26 -11.168 -11.170 -14.375 1.00 0.00 H new ATOM 0 HA ALA A 26 -11.330 -13.543 -12.711 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -12.676 -14.802 -14.313 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -13.617 -13.481 -13.580 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -12.990 -13.314 -15.237 1.00 0.00 H new ATOM 381 N PRO A 27 -9.605 -14.529 -14.480 1.00 0.00 N ATOM 382 CA PRO A 27 -8.352 -14.779 -15.191 1.00 0.00 C ATOM 383 C PRO A 27 -8.548 -15.120 -16.672 1.00 0.00 C ATOM 384 O PRO A 27 -7.603 -15.005 -17.453 1.00 0.00 O ATOM 385 CB PRO A 27 -7.684 -15.928 -14.429 1.00 0.00 C ATOM 386 CG PRO A 27 -8.864 -16.700 -13.839 1.00 0.00 C ATOM 387 CD PRO A 27 -9.888 -15.604 -13.542 1.00 0.00 C ATOM 0 HA PRO A 27 -7.736 -13.880 -15.210 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -7.086 -16.554 -15.091 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -7.017 -15.559 -13.650 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -9.255 -17.436 -14.542 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -8.580 -17.241 -12.936 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -10.905 -15.975 -13.669 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -9.801 -15.257 -12.512 1.00 0.00 H new ATOM 395 N TRP A 28 -9.751 -15.529 -17.088 1.00 0.00 N ATOM 396 CA TRP A 28 -10.042 -15.809 -18.490 1.00 0.00 C ATOM 397 C TRP A 28 -10.301 -14.531 -19.303 1.00 0.00 C ATOM 398 O TRP A 28 -10.353 -14.600 -20.532 1.00 0.00 O ATOM 399 CB TRP A 28 -11.200 -16.816 -18.587 1.00 0.00 C ATOM 400 CG TRP A 28 -12.422 -16.604 -17.735 1.00 0.00 C ATOM 401 CD1 TRP A 28 -13.014 -15.423 -17.439 1.00 0.00 C ATOM 402 CD2 TRP A 28 -13.244 -17.623 -17.083 1.00 0.00 C ATOM 403 NE1 TRP A 28 -14.138 -15.640 -16.669 1.00 0.00 N ATOM 404 CE2 TRP A 28 -14.327 -16.979 -16.412 1.00 0.00 C ATOM 405 CE3 TRP A 28 -13.186 -19.031 -16.997 1.00 0.00 C ATOM 406 CZ2 TRP A 28 -15.300 -17.695 -15.697 1.00 0.00 C ATOM 407 CZ3 TRP A 28 -14.155 -19.761 -16.282 1.00 0.00 C ATOM 408 CH2 TRP A 28 -15.212 -19.095 -15.634 1.00 0.00 C ATOM 0 H TRP A 28 -10.544 -15.673 -16.463 1.00 0.00 H new ATOM 0 HA TRP A 28 -9.158 -16.260 -18.941 1.00 0.00 H new ATOM 0 HB2 TRP A 28 -11.525 -16.845 -19.627 1.00 0.00 H new ATOM 0 HB3 TRP A 28 -10.800 -17.802 -18.350 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -12.659 -14.454 -17.758 1.00 0.00 H new ATOM 0 HE1 TRP A 28 -14.753 -14.900 -16.332 1.00 0.00 H new ATOM 0 HE3 TRP A 28 -12.383 -19.559 -17.489 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 -16.107 -17.175 -15.201 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 -14.087 -20.838 -16.231 1.00 0.00 H new ATOM 0 HH2 TRP A 28 -15.954 -19.660 -15.089 1.00 0.00 H new ATOM 419 N CYS A 29 -10.463 -13.369 -18.655 1.00 0.00 N ATOM 420 CA CYS A 29 -10.707 -12.112 -19.345 1.00 0.00 C ATOM 421 C CYS A 29 -9.351 -11.518 -19.740 1.00 0.00 C ATOM 422 O CYS A 29 -8.530 -11.215 -18.870 1.00 0.00 O ATOM 423 CB CYS A 29 -11.503 -11.176 -18.424 1.00 0.00 C ATOM 424 SG CYS A 29 -11.803 -9.578 -19.231 1.00 0.00 S ATOM 0 H CYS A 29 -10.427 -13.283 -17.639 1.00 0.00 H new ATOM 0 HA CYS A 29 -11.299 -12.259 -20.249 1.00 0.00 H new ATOM 0 HB2 CYS A 29 -12.454 -11.640 -18.161 1.00 0.00 H new ATOM 0 HB3 CYS A 29 -10.956 -11.022 -17.494 1.00 0.00 H new ATOM 0 HG CYS A 29 -10.702 -9.153 -19.776 1.00 0.00 H new ATOM 430 N GLY A 30 -9.121 -11.331 -21.042 1.00 0.00 N ATOM 431 CA GLY A 30 -7.926 -10.675 -21.565 1.00 0.00 C ATOM 432 C GLY A 30 -7.759 -9.265 -20.991 1.00 0.00 C ATOM 433 O GLY A 30 -6.756 -9.015 -20.326 1.00 0.00 O ATOM 0 H GLY A 30 -9.769 -11.635 -21.769 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -7.047 -11.273 -21.324 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -7.986 -10.621 -22.652 1.00 0.00 H new ATOM 437 N PRO A 31 -8.733 -8.352 -21.165 1.00 0.00 N ATOM 438 CA PRO A 31 -8.692 -7.009 -20.594 1.00 0.00 C ATOM 439 C PRO A 31 -8.371 -6.943 -19.093 1.00 0.00 C ATOM 440 O PRO A 31 -7.644 -6.038 -18.684 1.00 0.00 O ATOM 441 CB PRO A 31 -10.043 -6.383 -20.942 1.00 0.00 C ATOM 442 CG PRO A 31 -10.375 -7.034 -22.282 1.00 0.00 C ATOM 443 CD PRO A 31 -9.831 -8.452 -22.118 1.00 0.00 C ATOM 0 HA PRO A 31 -7.857 -6.453 -21.020 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -10.798 -6.602 -20.187 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -9.978 -5.298 -21.023 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -11.447 -7.033 -22.477 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -9.900 -6.513 -23.113 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -10.605 -9.127 -21.753 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -9.485 -8.850 -23.072 1.00 0.00 H new ATOM 451 N CYS A 32 -8.837 -7.892 -18.268 1.00 0.00 N ATOM 452 CA CYS A 32 -8.437 -7.960 -16.858 1.00 0.00 C ATOM 453 C CYS A 32 -6.921 -8.127 -16.717 1.00 0.00 C ATOM 454 O CYS A 32 -6.284 -7.431 -15.927 1.00 0.00 O ATOM 455 CB CYS A 32 -9.134 -9.119 -16.133 1.00 0.00 C ATOM 456 SG CYS A 32 -10.910 -8.803 -15.942 1.00 0.00 S ATOM 0 H CYS A 32 -9.490 -8.621 -18.554 1.00 0.00 H new ATOM 0 HA CYS A 32 -8.740 -7.018 -16.401 1.00 0.00 H new ATOM 0 HB2 CYS A 32 -8.985 -10.043 -16.692 1.00 0.00 H new ATOM 0 HB3 CYS A 32 -8.680 -9.263 -15.152 1.00 0.00 H new ATOM 0 HG CYS A 32 -11.505 -8.961 -17.087 1.00 0.00 H new ATOM 462 N LYS A 33 -6.320 -9.033 -17.489 1.00 0.00 N ATOM 463 CA LYS A 33 -4.873 -9.242 -17.457 1.00 0.00 C ATOM 464 C LYS A 33 -4.138 -8.053 -18.075 1.00 0.00 C ATOM 465 O LYS A 33 -3.034 -7.744 -17.634 1.00 0.00 O ATOM 466 CB LYS A 33 -4.519 -10.566 -18.150 1.00 0.00 C ATOM 467 CG LYS A 33 -5.041 -11.755 -17.322 1.00 0.00 C ATOM 468 CD LYS A 33 -4.827 -13.116 -17.990 1.00 0.00 C ATOM 469 CE LYS A 33 -5.672 -13.250 -19.265 1.00 0.00 C ATOM 470 NZ LYS A 33 -5.844 -14.669 -19.661 1.00 0.00 N ATOM 0 H LYS A 33 -6.815 -9.636 -18.146 1.00 0.00 H new ATOM 0 HA LYS A 33 -4.544 -9.311 -16.420 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -4.954 -10.590 -19.149 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -3.439 -10.644 -18.271 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -4.545 -11.755 -16.352 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -6.106 -11.616 -17.135 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -3.772 -13.241 -18.235 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -5.089 -13.911 -17.292 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -6.650 -12.796 -19.103 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -5.196 -12.700 -20.077 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -6.239 -14.716 -20.622 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -4.922 -15.149 -19.642 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -6.492 -15.139 -18.997 1.00 0.00 H new ATOM 484 N MET A 34 -4.738 -7.355 -19.045 1.00 0.00 N ATOM 485 CA MET A 34 -4.152 -6.153 -19.632 1.00 0.00 C ATOM 486 C MET A 34 -4.103 -5.013 -18.612 1.00 0.00 C ATOM 487 O MET A 34 -3.089 -4.322 -18.537 1.00 0.00 O ATOM 488 CB MET A 34 -4.935 -5.703 -20.873 1.00 0.00 C ATOM 489 CG MET A 34 -4.848 -6.717 -22.021 1.00 0.00 C ATOM 490 SD MET A 34 -5.997 -6.423 -23.398 1.00 0.00 S ATOM 491 CE MET A 34 -5.421 -4.806 -23.989 1.00 0.00 C ATOM 0 H MET A 34 -5.642 -7.610 -19.442 1.00 0.00 H new ATOM 0 HA MET A 34 -3.134 -6.402 -19.933 1.00 0.00 H new ATOM 0 HB2 MET A 34 -5.980 -5.552 -20.604 1.00 0.00 H new ATOM 0 HB3 MET A 34 -4.551 -4.741 -21.212 1.00 0.00 H new ATOM 0 HG2 MET A 34 -3.830 -6.715 -22.411 1.00 0.00 H new ATOM 0 HG3 MET A 34 -5.033 -7.713 -21.620 1.00 0.00 H new ATOM 0 HE1 MET A 34 -5.983 -4.522 -24.879 1.00 0.00 H new ATOM 0 HE2 MET A 34 -5.573 -4.059 -23.210 1.00 0.00 H new ATOM 0 HE3 MET A 34 -4.360 -4.865 -24.233 1.00 0.00 H new ATOM 501 N ILE A 35 -5.166 -4.798 -17.825 1.00 0.00 N ATOM 502 CA ILE A 35 -5.200 -3.707 -16.849 1.00 0.00 C ATOM 503 C ILE A 35 -4.410 -4.066 -15.579 1.00 0.00 C ATOM 504 O ILE A 35 -4.013 -3.168 -14.844 1.00 0.00 O ATOM 505 CB ILE A 35 -6.660 -3.246 -16.590 1.00 0.00 C ATOM 506 CG1 ILE A 35 -6.682 -1.803 -16.038 1.00 0.00 C ATOM 507 CG2 ILE A 35 -7.449 -4.225 -15.707 1.00 0.00 C ATOM 508 CD1 ILE A 35 -8.090 -1.255 -15.773 1.00 0.00 C ATOM 0 H ILE A 35 -6.012 -5.367 -17.847 1.00 0.00 H new ATOM 0 HA ILE A 35 -4.687 -2.840 -17.264 1.00 0.00 H new ATOM 0 HB ILE A 35 -7.177 -3.246 -17.549 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -6.111 -1.772 -15.110 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -6.176 -1.147 -16.746 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -8.462 -3.849 -15.562 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -7.490 -5.200 -16.192 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -6.955 -4.322 -14.740 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -8.018 -0.238 -15.387 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -8.660 -1.251 -16.702 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -8.594 -1.886 -15.041 1.00 0.00 H new ATOM 520 N ALA A 36 -4.135 -5.351 -15.315 1.00 0.00 N ATOM 521 CA ALA A 36 -3.414 -5.786 -14.118 1.00 0.00 C ATOM 522 C ALA A 36 -2.082 -5.041 -13.882 1.00 0.00 C ATOM 523 O ALA A 36 -1.931 -4.474 -12.797 1.00 0.00 O ATOM 524 CB ALA A 36 -3.240 -7.310 -14.117 1.00 0.00 C ATOM 0 H ALA A 36 -4.409 -6.118 -15.930 1.00 0.00 H new ATOM 0 HA ALA A 36 -4.034 -5.511 -13.265 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -2.702 -7.614 -13.219 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -4.219 -7.788 -14.132 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -2.675 -7.612 -14.999 1.00 0.00 H new ATOM 530 N PRO A 37 -1.138 -4.946 -14.841 1.00 0.00 N ATOM 531 CA PRO A 37 0.092 -4.188 -14.624 1.00 0.00 C ATOM 532 C PRO A 37 -0.178 -2.690 -14.443 1.00 0.00 C ATOM 533 O PRO A 37 0.551 -2.030 -13.705 1.00 0.00 O ATOM 534 CB PRO A 37 0.987 -4.472 -15.836 1.00 0.00 C ATOM 535 CG PRO A 37 0.003 -4.894 -16.925 1.00 0.00 C ATOM 536 CD PRO A 37 -1.087 -5.611 -16.134 1.00 0.00 C ATOM 0 HA PRO A 37 0.581 -4.496 -13.700 1.00 0.00 H new ATOM 0 HB2 PRO A 37 1.554 -3.589 -16.130 1.00 0.00 H new ATOM 0 HB3 PRO A 37 1.710 -5.259 -15.623 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -0.390 -4.036 -17.470 1.00 0.00 H new ATOM 0 HG3 PRO A 37 0.469 -5.551 -17.659 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -2.048 -5.547 -16.645 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -0.856 -6.670 -16.021 1.00 0.00 H new ATOM 544 N VAL A 38 -1.229 -2.146 -15.065 1.00 0.00 N ATOM 545 CA VAL A 38 -1.609 -0.751 -14.901 1.00 0.00 C ATOM 546 C VAL A 38 -2.035 -0.515 -13.447 1.00 0.00 C ATOM 547 O VAL A 38 -1.630 0.476 -12.840 1.00 0.00 O ATOM 548 CB VAL A 38 -2.722 -0.365 -15.901 1.00 0.00 C ATOM 549 CG1 VAL A 38 -2.873 1.155 -15.961 1.00 0.00 C ATOM 550 CG2 VAL A 38 -2.447 -0.860 -17.332 1.00 0.00 C ATOM 0 H VAL A 38 -1.837 -2.667 -15.696 1.00 0.00 H new ATOM 0 HA VAL A 38 -0.756 -0.109 -15.119 1.00 0.00 H new ATOM 0 HB VAL A 38 -3.630 -0.845 -15.536 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -3.660 1.415 -16.669 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -3.134 1.534 -14.973 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -1.933 1.602 -16.284 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -3.265 -0.557 -17.985 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -1.514 -0.427 -17.694 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -2.367 -1.947 -17.332 1.00 0.00 H new ATOM 560 N LEU A 39 -2.808 -1.436 -12.863 1.00 0.00 N ATOM 561 CA LEU A 39 -3.214 -1.370 -11.468 1.00 0.00 C ATOM 562 C LEU A 39 -2.017 -1.552 -10.542 1.00 0.00 C ATOM 563 O LEU A 39 -1.980 -0.911 -9.498 1.00 0.00 O ATOM 564 CB LEU A 39 -4.294 -2.420 -11.164 1.00 0.00 C ATOM 565 CG LEU A 39 -5.653 -2.092 -11.809 1.00 0.00 C ATOM 566 CD1 LEU A 39 -6.543 -3.336 -11.787 1.00 0.00 C ATOM 567 CD2 LEU A 39 -6.372 -0.943 -11.089 1.00 0.00 C ATOM 0 H LEU A 39 -3.169 -2.253 -13.355 1.00 0.00 H new ATOM 0 HA LEU A 39 -3.636 -0.381 -11.289 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -3.956 -3.394 -11.518 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -4.421 -2.500 -10.084 1.00 0.00 H new ATOM 0 HG LEU A 39 -5.462 -1.776 -12.835 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -7.505 -3.103 -12.244 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -6.061 -4.138 -12.345 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -6.698 -3.654 -10.756 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -7.326 -0.747 -11.579 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -6.548 -1.219 -10.049 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -5.754 -0.046 -11.127 1.00 0.00 H new ATOM 579 N GLU A 40 -1.028 -2.380 -10.897 1.00 0.00 N ATOM 580 CA GLU A 40 0.192 -2.506 -10.101 1.00 0.00 C ATOM 581 C GLU A 40 0.992 -1.200 -10.112 1.00 0.00 C ATOM 582 O GLU A 40 1.522 -0.793 -9.076 1.00 0.00 O ATOM 583 CB GLU A 40 1.051 -3.686 -10.583 1.00 0.00 C ATOM 584 CG GLU A 40 0.443 -5.039 -10.188 1.00 0.00 C ATOM 585 CD GLU A 40 1.325 -6.212 -10.654 1.00 0.00 C ATOM 586 OE1 GLU A 40 2.285 -6.578 -9.937 1.00 0.00 O ATOM 587 OE2 GLU A 40 1.058 -6.797 -11.726 1.00 0.00 O ATOM 0 H GLU A 40 -1.051 -2.970 -11.729 1.00 0.00 H new ATOM 0 HA GLU A 40 -0.102 -2.710 -9.071 1.00 0.00 H new ATOM 0 HB2 GLU A 40 1.157 -3.639 -11.667 1.00 0.00 H new ATOM 0 HB3 GLU A 40 2.052 -3.602 -10.161 1.00 0.00 H new ATOM 0 HG2 GLU A 40 0.321 -5.082 -9.106 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -0.551 -5.134 -10.625 1.00 0.00 H new ATOM 594 N GLU A 41 1.084 -0.517 -11.255 1.00 0.00 N ATOM 595 CA GLU A 41 1.714 0.796 -11.334 1.00 0.00 C ATOM 596 C GLU A 41 0.922 1.804 -10.499 1.00 0.00 C ATOM 597 O GLU A 41 1.510 2.575 -9.745 1.00 0.00 O ATOM 598 CB GLU A 41 1.845 1.264 -12.792 1.00 0.00 C ATOM 599 CG GLU A 41 2.966 0.521 -13.532 1.00 0.00 C ATOM 600 CD GLU A 41 3.153 1.062 -14.961 1.00 0.00 C ATOM 601 OE1 GLU A 41 2.470 0.589 -15.898 1.00 0.00 O ATOM 602 OE2 GLU A 41 4.007 1.954 -15.168 1.00 0.00 O ATOM 0 H GLU A 41 0.725 -0.859 -12.146 1.00 0.00 H new ATOM 0 HA GLU A 41 2.723 0.722 -10.927 1.00 0.00 H new ATOM 0 HB2 GLU A 41 0.900 1.105 -13.311 1.00 0.00 H new ATOM 0 HB3 GLU A 41 2.044 2.335 -12.813 1.00 0.00 H new ATOM 0 HG2 GLU A 41 3.899 0.623 -12.978 1.00 0.00 H new ATOM 0 HG3 GLU A 41 2.734 -0.543 -13.572 1.00 0.00 H new ATOM 609 N LEU A 42 -0.410 1.769 -10.580 1.00 0.00 N ATOM 610 CA LEU A 42 -1.271 2.648 -9.804 1.00 0.00 C ATOM 611 C LEU A 42 -1.100 2.391 -8.304 1.00 0.00 C ATOM 612 O LEU A 42 -1.065 3.336 -7.525 1.00 0.00 O ATOM 613 CB LEU A 42 -2.728 2.443 -10.237 1.00 0.00 C ATOM 614 CG LEU A 42 -3.697 3.481 -9.645 1.00 0.00 C ATOM 615 CD1 LEU A 42 -3.482 4.882 -10.231 1.00 0.00 C ATOM 616 CD2 LEU A 42 -5.128 3.015 -9.924 1.00 0.00 C ATOM 0 H LEU A 42 -0.918 1.127 -11.189 1.00 0.00 H new ATOM 0 HA LEU A 42 -0.989 3.684 -9.991 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -2.784 2.484 -11.325 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -3.050 1.445 -9.939 1.00 0.00 H new ATOM 0 HG LEU A 42 -3.511 3.555 -8.574 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -4.190 5.577 -9.781 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -2.465 5.212 -10.020 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -3.638 4.853 -11.309 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -5.833 3.737 -9.512 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -5.280 2.932 -11.000 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -5.291 2.043 -9.459 1.00 0.00 H new ATOM 628 N ASP A 43 -0.954 1.135 -7.881 1.00 0.00 N ATOM 629 CA ASP A 43 -0.736 0.778 -6.484 1.00 0.00 C ATOM 630 C ASP A 43 0.623 1.278 -6.001 1.00 0.00 C ATOM 631 O ASP A 43 0.728 1.803 -4.894 1.00 0.00 O ATOM 632 CB ASP A 43 -0.831 -0.735 -6.284 1.00 0.00 C ATOM 633 CG ASP A 43 -0.578 -1.090 -4.811 1.00 0.00 C ATOM 634 OD1 ASP A 43 -1.480 -0.858 -3.976 1.00 0.00 O ATOM 635 OD2 ASP A 43 0.513 -1.615 -4.506 1.00 0.00 O ATOM 0 H ASP A 43 -0.985 0.330 -8.507 1.00 0.00 H new ATOM 0 HA ASP A 43 -1.518 1.258 -5.896 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -1.817 -1.088 -6.587 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -0.102 -1.240 -6.918 1.00 0.00 H new ATOM 640 N GLN A 44 1.654 1.200 -6.844 1.00 0.00 N ATOM 641 CA GLN A 44 2.964 1.764 -6.536 1.00 0.00 C ATOM 642 C GLN A 44 2.913 3.298 -6.407 1.00 0.00 C ATOM 643 O GLN A 44 3.768 3.882 -5.741 1.00 0.00 O ATOM 644 CB GLN A 44 3.969 1.314 -7.605 1.00 0.00 C ATOM 645 CG GLN A 44 4.380 -0.154 -7.408 1.00 0.00 C ATOM 646 CD GLN A 44 5.097 -0.702 -8.640 1.00 0.00 C ATOM 647 OE1 GLN A 44 6.323 -0.701 -8.730 1.00 0.00 O ATOM 648 NE2 GLN A 44 4.341 -1.173 -9.617 1.00 0.00 N ATOM 0 H GLN A 44 1.602 0.745 -7.756 1.00 0.00 H new ATOM 0 HA GLN A 44 3.289 1.391 -5.565 1.00 0.00 H new ATOM 0 HB2 GLN A 44 3.530 1.441 -8.595 1.00 0.00 H new ATOM 0 HB3 GLN A 44 4.854 1.949 -7.565 1.00 0.00 H new ATOM 0 HG2 GLN A 44 5.032 -0.237 -6.539 1.00 0.00 H new ATOM 0 HG3 GLN A 44 3.495 -0.757 -7.202 1.00 0.00 H new ATOM 0 HE21 GLN A 44 3.325 -1.166 -9.525 1.00 0.00 H new ATOM 0 HE22 GLN A 44 4.774 -1.544 -10.463 1.00 0.00 H new ATOM 657 N GLU A 45 1.920 3.954 -7.013 1.00 0.00 N ATOM 658 CA GLU A 45 1.781 5.407 -7.048 1.00 0.00 C ATOM 659 C GLU A 45 0.827 5.932 -5.963 1.00 0.00 C ATOM 660 O GLU A 45 1.028 7.043 -5.469 1.00 0.00 O ATOM 661 CB GLU A 45 1.237 5.803 -8.428 1.00 0.00 C ATOM 662 CG GLU A 45 2.265 5.646 -9.560 1.00 0.00 C ATOM 663 CD GLU A 45 3.061 6.930 -9.829 1.00 0.00 C ATOM 664 OE1 GLU A 45 3.894 7.337 -8.988 1.00 0.00 O ATOM 665 OE2 GLU A 45 2.866 7.527 -10.914 1.00 0.00 O ATOM 0 H GLU A 45 1.169 3.471 -7.507 1.00 0.00 H new ATOM 0 HA GLU A 45 2.760 5.847 -6.860 1.00 0.00 H new ATOM 0 HB2 GLU A 45 0.363 5.192 -8.654 1.00 0.00 H new ATOM 0 HB3 GLU A 45 0.901 6.839 -8.394 1.00 0.00 H new ATOM 0 HG2 GLU A 45 2.957 4.843 -9.306 1.00 0.00 H new ATOM 0 HG3 GLU A 45 1.750 5.347 -10.473 1.00 0.00 H new ATOM 672 N MET A 46 -0.187 5.151 -5.576 1.00 0.00 N ATOM 673 CA MET A 46 -1.304 5.605 -4.742 1.00 0.00 C ATOM 674 C MET A 46 -1.579 4.699 -3.540 1.00 0.00 C ATOM 675 O MET A 46 -2.353 5.107 -2.681 1.00 0.00 O ATOM 676 CB MET A 46 -2.582 5.699 -5.600 1.00 0.00 C ATOM 677 CG MET A 46 -2.564 6.835 -6.628 1.00 0.00 C ATOM 678 SD MET A 46 -2.696 8.486 -5.886 1.00 0.00 S ATOM 679 CE MET A 46 -2.968 9.483 -7.373 1.00 0.00 C ATOM 0 H MET A 46 -0.255 4.168 -5.839 1.00 0.00 H new ATOM 0 HA MET A 46 -1.018 6.580 -4.348 1.00 0.00 H new ATOM 0 HB2 MET A 46 -2.726 4.753 -6.122 1.00 0.00 H new ATOM 0 HB3 MET A 46 -3.440 5.833 -4.941 1.00 0.00 H new ATOM 0 HG2 MET A 46 -1.641 6.778 -7.205 1.00 0.00 H new ATOM 0 HG3 MET A 46 -3.387 6.693 -7.328 1.00 0.00 H new ATOM 0 HE1 MET A 46 -3.089 10.529 -7.092 1.00 0.00 H new ATOM 0 HE2 MET A 46 -2.112 9.383 -8.040 1.00 0.00 H new ATOM 0 HE3 MET A 46 -3.868 9.138 -7.883 1.00 0.00 H new ATOM 689 N GLY A 47 -0.955 3.521 -3.440 1.00 0.00 N ATOM 690 CA GLY A 47 -1.266 2.460 -2.474 1.00 0.00 C ATOM 691 C GLY A 47 -1.405 2.902 -1.012 1.00 0.00 C ATOM 692 O GLY A 47 -2.154 2.297 -0.245 1.00 0.00 O ATOM 0 H GLY A 47 -0.184 3.269 -4.058 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -2.196 1.980 -2.778 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -0.484 1.703 -2.531 1.00 0.00 H new ATOM 696 N ASP A 48 -0.677 3.948 -0.614 1.00 0.00 N ATOM 697 CA ASP A 48 -0.688 4.490 0.742 1.00 0.00 C ATOM 698 C ASP A 48 -1.913 5.376 0.982 1.00 0.00 C ATOM 699 O ASP A 48 -2.510 5.345 2.058 1.00 0.00 O ATOM 700 CB ASP A 48 0.582 5.313 0.986 1.00 0.00 C ATOM 701 CG ASP A 48 0.562 5.967 2.378 1.00 0.00 C ATOM 702 OD1 ASP A 48 0.725 5.251 3.391 1.00 0.00 O ATOM 703 OD2 ASP A 48 0.414 7.207 2.466 1.00 0.00 O ATOM 0 H ASP A 48 -0.050 4.451 -1.242 1.00 0.00 H new ATOM 0 HA ASP A 48 -0.728 3.649 1.434 1.00 0.00 H new ATOM 0 HB2 ASP A 48 1.458 4.670 0.896 1.00 0.00 H new ATOM 0 HB3 ASP A 48 0.672 6.084 0.220 1.00 0.00 H new ATOM 708 N LYS A 49 -2.297 6.159 -0.031 1.00 0.00 N ATOM 709 CA LYS A 49 -3.421 7.084 0.016 1.00 0.00 C ATOM 710 C LYS A 49 -4.727 6.368 -0.321 1.00 0.00 C ATOM 711 O LYS A 49 -5.789 6.805 0.123 1.00 0.00 O ATOM 712 CB LYS A 49 -3.177 8.254 -0.954 1.00 0.00 C ATOM 713 CG LYS A 49 -1.934 9.076 -0.561 1.00 0.00 C ATOM 714 CD LYS A 49 -1.684 10.292 -1.466 1.00 0.00 C ATOM 715 CE LYS A 49 -1.322 9.880 -2.902 1.00 0.00 C ATOM 716 NZ LYS A 49 -0.956 11.046 -3.746 1.00 0.00 N ATOM 0 H LYS A 49 -1.816 6.163 -0.931 1.00 0.00 H new ATOM 0 HA LYS A 49 -3.507 7.478 1.029 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -3.052 7.867 -1.965 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -4.052 8.903 -0.967 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -2.046 9.417 0.468 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -1.058 8.428 -0.588 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -2.575 10.920 -1.483 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -0.878 10.895 -1.048 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -0.490 9.176 -2.877 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -2.167 9.359 -3.352 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -0.720 10.720 -4.705 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -1.758 11.706 -3.793 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -0.133 11.529 -3.332 1.00 0.00 H new ATOM 730 N LEU A 50 -4.662 5.277 -1.088 1.00 0.00 N ATOM 731 CA LEU A 50 -5.807 4.513 -1.548 1.00 0.00 C ATOM 732 C LEU A 50 -5.402 3.049 -1.675 1.00 0.00 C ATOM 733 O LEU A 50 -4.449 2.718 -2.378 1.00 0.00 O ATOM 734 CB LEU A 50 -6.347 5.112 -2.862 1.00 0.00 C ATOM 735 CG LEU A 50 -7.204 4.153 -3.725 1.00 0.00 C ATOM 736 CD1 LEU A 50 -8.530 4.802 -4.126 1.00 0.00 C ATOM 737 CD2 LEU A 50 -6.438 3.710 -4.974 1.00 0.00 C ATOM 0 H LEU A 50 -3.775 4.894 -1.414 1.00 0.00 H new ATOM 0 HA LEU A 50 -6.625 4.566 -0.830 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -6.945 5.991 -2.622 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -5.502 5.455 -3.460 1.00 0.00 H new ATOM 0 HG LEU A 50 -7.422 3.274 -3.118 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -9.109 4.104 -4.731 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -9.094 5.060 -3.230 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -8.333 5.705 -4.703 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -7.061 3.037 -5.563 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -6.181 4.584 -5.572 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -5.526 3.193 -4.677 1.00 0.00 H new ATOM 749 N LYS A 51 -6.142 2.174 -0.995 1.00 0.00 N ATOM 750 CA LYS A 51 -5.950 0.724 -1.063 1.00 0.00 C ATOM 751 C LYS A 51 -6.445 0.234 -2.425 1.00 0.00 C ATOM 752 O LYS A 51 -7.435 0.764 -2.934 1.00 0.00 O ATOM 753 CB LYS A 51 -6.737 0.093 0.098 1.00 0.00 C ATOM 754 CG LYS A 51 -6.559 -1.427 0.244 1.00 0.00 C ATOM 755 CD LYS A 51 -7.555 -2.033 1.245 1.00 0.00 C ATOM 756 CE LYS A 51 -7.393 -1.501 2.678 1.00 0.00 C ATOM 757 NZ LYS A 51 -8.327 -2.192 3.591 1.00 0.00 N ATOM 0 H LYS A 51 -6.901 2.454 -0.374 1.00 0.00 H new ATOM 0 HA LYS A 51 -4.901 0.442 -0.966 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -6.432 0.572 1.028 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -7.796 0.309 -0.039 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -6.689 -1.902 -0.729 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -5.542 -1.643 0.570 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -8.570 -1.828 0.904 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -7.434 -3.116 1.253 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -6.367 -1.651 3.015 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -7.582 -0.428 2.698 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -8.104 -1.936 4.574 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -9.303 -1.906 3.371 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -8.232 -3.221 3.471 1.00 0.00 H new ATOM 771 N ILE A 52 -5.843 -0.817 -2.985 1.00 0.00 N ATOM 772 CA ILE A 52 -6.341 -1.452 -4.201 1.00 0.00 C ATOM 773 C ILE A 52 -6.599 -2.911 -3.849 1.00 0.00 C ATOM 774 O ILE A 52 -5.768 -3.548 -3.199 1.00 0.00 O ATOM 775 CB ILE A 52 -5.387 -1.213 -5.396 1.00 0.00 C ATOM 776 CG1 ILE A 52 -5.315 0.313 -5.646 1.00 0.00 C ATOM 777 CG2 ILE A 52 -5.859 -1.977 -6.653 1.00 0.00 C ATOM 778 CD1 ILE A 52 -4.577 0.771 -6.903 1.00 0.00 C ATOM 0 H ILE A 52 -4.999 -1.249 -2.608 1.00 0.00 H new ATOM 0 HA ILE A 52 -7.277 -1.014 -4.548 1.00 0.00 H new ATOM 0 HB ILE A 52 -4.393 -1.596 -5.165 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -6.334 0.698 -5.691 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -4.836 0.776 -4.783 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -5.168 -1.788 -7.474 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -5.887 -3.046 -6.440 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -6.856 -1.637 -6.932 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -4.598 1.859 -6.961 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -3.543 0.430 -6.862 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -5.063 0.351 -7.784 1.00 0.00 H new ATOM 790 N VAL A 53 -7.760 -3.424 -4.253 1.00 0.00 N ATOM 791 CA VAL A 53 -8.250 -4.751 -3.897 1.00 0.00 C ATOM 792 C VAL A 53 -8.613 -5.490 -5.190 1.00 0.00 C ATOM 793 O VAL A 53 -8.979 -4.873 -6.193 1.00 0.00 O ATOM 794 CB VAL A 53 -9.449 -4.644 -2.921 1.00 0.00 C ATOM 795 CG1 VAL A 53 -9.797 -5.993 -2.274 1.00 0.00 C ATOM 796 CG2 VAL A 53 -9.196 -3.652 -1.771 1.00 0.00 C ATOM 0 H VAL A 53 -8.404 -2.911 -4.855 1.00 0.00 H new ATOM 0 HA VAL A 53 -7.480 -5.318 -3.374 1.00 0.00 H new ATOM 0 HB VAL A 53 -10.272 -4.294 -3.544 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -10.643 -5.865 -1.599 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -10.058 -6.712 -3.050 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -8.938 -6.360 -1.713 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -10.070 -3.619 -1.120 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -8.328 -3.975 -1.197 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -9.011 -2.659 -2.181 1.00 0.00 H new ATOM 806 N LYS A 54 -8.546 -6.818 -5.158 1.00 0.00 N ATOM 807 CA LYS A 54 -8.901 -7.722 -6.245 1.00 0.00 C ATOM 808 C LYS A 54 -10.036 -8.609 -5.765 1.00 0.00 C ATOM 809 O LYS A 54 -9.995 -9.064 -4.618 1.00 0.00 O ATOM 810 CB LYS A 54 -7.679 -8.600 -6.565 1.00 0.00 C ATOM 811 CG LYS A 54 -6.557 -7.850 -7.277 1.00 0.00 C ATOM 812 CD LYS A 54 -6.897 -7.662 -8.753 1.00 0.00 C ATOM 813 CE LYS A 54 -5.709 -7.027 -9.468 1.00 0.00 C ATOM 814 NZ LYS A 54 -5.906 -7.033 -10.937 1.00 0.00 N ATOM 0 H LYS A 54 -8.225 -7.318 -4.329 1.00 0.00 H new ATOM 0 HA LYS A 54 -9.203 -7.166 -7.133 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -7.292 -9.021 -5.637 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -7.996 -9.437 -7.187 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -6.404 -6.879 -6.806 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -5.623 -8.403 -7.180 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -7.138 -8.623 -9.208 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -7.779 -7.030 -8.857 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -5.576 -6.003 -9.120 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -4.797 -7.570 -9.218 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -5.404 -6.226 -11.358 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -5.532 -7.919 -11.334 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -6.921 -6.959 -11.151 1.00 0.00 H new ATOM 828 N ILE A 55 -11.003 -8.902 -6.636 1.00 0.00 N ATOM 829 CA ILE A 55 -12.057 -9.864 -6.332 1.00 0.00 C ATOM 830 C ILE A 55 -12.447 -10.620 -7.611 1.00 0.00 C ATOM 831 O ILE A 55 -12.806 -10.020 -8.627 1.00 0.00 O ATOM 832 CB ILE A 55 -13.209 -9.149 -5.584 1.00 0.00 C ATOM 833 CG1 ILE A 55 -14.236 -10.179 -5.080 1.00 0.00 C ATOM 834 CG2 ILE A 55 -13.879 -8.015 -6.384 1.00 0.00 C ATOM 835 CD1 ILE A 55 -15.088 -9.635 -3.930 1.00 0.00 C ATOM 0 H ILE A 55 -11.076 -8.482 -7.563 1.00 0.00 H new ATOM 0 HA ILE A 55 -11.718 -10.639 -5.645 1.00 0.00 H new ATOM 0 HB ILE A 55 -12.755 -8.648 -4.729 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -14.887 -10.473 -5.904 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -13.714 -11.077 -4.749 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -14.674 -7.569 -5.787 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -13.137 -7.254 -6.627 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -14.300 -8.419 -7.305 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -15.797 -10.398 -3.610 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -14.442 -9.366 -3.094 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -15.632 -8.753 -4.266 1.00 0.00 H new ATOM 847 N ASP A 56 -12.299 -11.949 -7.577 1.00 0.00 N ATOM 848 CA ASP A 56 -12.603 -12.833 -8.702 1.00 0.00 C ATOM 849 C ASP A 56 -14.107 -13.087 -8.736 1.00 0.00 C ATOM 850 O ASP A 56 -14.639 -13.744 -7.835 1.00 0.00 O ATOM 851 CB ASP A 56 -11.835 -14.157 -8.573 1.00 0.00 C ATOM 852 CG ASP A 56 -12.143 -15.168 -9.697 1.00 0.00 C ATOM 853 OD1 ASP A 56 -12.942 -14.877 -10.615 1.00 0.00 O ATOM 854 OD2 ASP A 56 -11.545 -16.268 -9.661 1.00 0.00 O ATOM 0 H ASP A 56 -11.959 -12.446 -6.753 1.00 0.00 H new ATOM 0 HA ASP A 56 -12.292 -12.358 -9.632 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -10.765 -13.947 -8.569 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -12.074 -14.613 -7.612 1.00 0.00 H new ATOM 859 N VAL A 57 -14.805 -12.550 -9.738 1.00 0.00 N ATOM 860 CA VAL A 57 -16.261 -12.629 -9.819 1.00 0.00 C ATOM 861 C VAL A 57 -16.760 -14.068 -9.981 1.00 0.00 C ATOM 862 O VAL A 57 -17.878 -14.362 -9.561 1.00 0.00 O ATOM 863 CB VAL A 57 -16.816 -11.705 -10.925 1.00 0.00 C ATOM 864 CG1 VAL A 57 -16.390 -10.251 -10.681 1.00 0.00 C ATOM 865 CG2 VAL A 57 -16.414 -12.114 -12.351 1.00 0.00 C ATOM 0 H VAL A 57 -14.375 -12.048 -10.515 1.00 0.00 H new ATOM 0 HA VAL A 57 -16.649 -12.272 -8.865 1.00 0.00 H new ATOM 0 HB VAL A 57 -17.900 -11.805 -10.862 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -16.791 -9.617 -11.471 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -16.774 -9.916 -9.717 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -15.302 -10.186 -10.681 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -16.845 -11.413 -13.066 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -15.328 -12.101 -12.441 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -16.784 -13.118 -12.559 1.00 0.00 H new ATOM 875 N ASP A 58 -15.951 -14.980 -10.533 1.00 0.00 N ATOM 876 CA ASP A 58 -16.369 -16.370 -10.755 1.00 0.00 C ATOM 877 C ASP A 58 -16.488 -17.144 -9.435 1.00 0.00 C ATOM 878 O ASP A 58 -17.083 -18.219 -9.387 1.00 0.00 O ATOM 879 CB ASP A 58 -15.396 -17.076 -11.708 1.00 0.00 C ATOM 880 CG ASP A 58 -15.875 -18.499 -12.052 1.00 0.00 C ATOM 881 OD1 ASP A 58 -16.986 -18.650 -12.609 1.00 0.00 O ATOM 882 OD2 ASP A 58 -15.123 -19.469 -11.807 1.00 0.00 O ATOM 0 H ASP A 58 -14.998 -14.779 -10.836 1.00 0.00 H new ATOM 0 HA ASP A 58 -17.358 -16.349 -11.213 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -15.295 -16.494 -12.624 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -14.408 -17.124 -11.251 1.00 0.00 H new ATOM 887 N GLU A 59 -15.961 -16.577 -8.346 1.00 0.00 N ATOM 888 CA GLU A 59 -15.970 -17.157 -7.006 1.00 0.00 C ATOM 889 C GLU A 59 -16.708 -16.243 -6.016 1.00 0.00 C ATOM 890 O GLU A 59 -16.899 -16.627 -4.862 1.00 0.00 O ATOM 891 CB GLU A 59 -14.512 -17.386 -6.559 1.00 0.00 C ATOM 892 CG GLU A 59 -13.825 -18.574 -7.254 1.00 0.00 C ATOM 893 CD GLU A 59 -14.320 -19.932 -6.716 1.00 0.00 C ATOM 894 OE1 GLU A 59 -13.814 -20.395 -5.667 1.00 0.00 O ATOM 895 OE2 GLU A 59 -15.197 -20.568 -7.341 1.00 0.00 O ATOM 0 H GLU A 59 -15.500 -15.668 -8.378 1.00 0.00 H new ATOM 0 HA GLU A 59 -16.501 -18.108 -7.025 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -13.936 -16.481 -6.754 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -14.494 -17.549 -5.481 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -14.010 -18.521 -8.327 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -12.747 -18.501 -7.113 1.00 0.00 H new ATOM 902 N ASN A 60 -17.131 -15.044 -6.444 1.00 0.00 N ATOM 903 CA ASN A 60 -17.634 -13.985 -5.564 1.00 0.00 C ATOM 904 C ASN A 60 -18.735 -13.186 -6.261 1.00 0.00 C ATOM 905 O ASN A 60 -18.828 -11.962 -6.121 1.00 0.00 O ATOM 906 CB ASN A 60 -16.483 -13.065 -5.127 1.00 0.00 C ATOM 907 CG ASN A 60 -15.401 -13.795 -4.354 1.00 0.00 C ATOM 908 OD1 ASN A 60 -15.554 -14.060 -3.167 1.00 0.00 O ATOM 909 ND2 ASN A 60 -14.296 -14.122 -5.005 1.00 0.00 N ATOM 0 H ASN A 60 -17.132 -14.781 -7.430 1.00 0.00 H new ATOM 0 HA ASN A 60 -18.063 -14.445 -4.674 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -16.041 -12.601 -6.009 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -16.883 -12.260 -4.510 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -13.543 -14.608 -4.519 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -14.198 -13.888 -5.993 1.00 0.00 H new ATOM 916 N GLN A 61 -19.561 -13.872 -7.050 1.00 0.00 N ATOM 917 CA GLN A 61 -20.675 -13.276 -7.778 1.00 0.00 C ATOM 918 C GLN A 61 -21.670 -12.600 -6.827 1.00 0.00 C ATOM 919 O GLN A 61 -22.348 -11.652 -7.216 1.00 0.00 O ATOM 920 CB GLN A 61 -21.359 -14.314 -8.688 1.00 0.00 C ATOM 921 CG GLN A 61 -21.825 -15.614 -8.005 1.00 0.00 C ATOM 922 CD GLN A 61 -20.723 -16.678 -7.935 1.00 0.00 C ATOM 923 OE1 GLN A 61 -20.406 -17.321 -8.930 1.00 0.00 O ATOM 924 NE2 GLN A 61 -20.109 -16.886 -6.780 1.00 0.00 N ATOM 0 H GLN A 61 -19.471 -14.877 -7.202 1.00 0.00 H new ATOM 0 HA GLN A 61 -20.274 -12.494 -8.423 1.00 0.00 H new ATOM 0 HB2 GLN A 61 -22.224 -13.843 -9.155 1.00 0.00 H new ATOM 0 HB3 GLN A 61 -20.668 -14.576 -9.489 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -22.168 -15.386 -6.996 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -22.679 -16.018 -8.548 1.00 0.00 H new ATOM 0 HE21 GLN A 61 -20.377 -16.348 -5.956 1.00 0.00 H new ATOM 0 HE22 GLN A 61 -19.368 -17.584 -6.715 1.00 0.00 H new ATOM 933 N GLU A 62 -21.721 -13.048 -5.572 1.00 0.00 N ATOM 934 CA GLU A 62 -22.527 -12.493 -4.499 1.00 0.00 C ATOM 935 C GLU A 62 -22.158 -11.029 -4.225 1.00 0.00 C ATOM 936 O GLU A 62 -23.030 -10.235 -3.866 1.00 0.00 O ATOM 937 CB GLU A 62 -22.315 -13.336 -3.228 1.00 0.00 C ATOM 938 CG GLU A 62 -22.877 -14.769 -3.285 1.00 0.00 C ATOM 939 CD GLU A 62 -22.052 -15.779 -4.110 1.00 0.00 C ATOM 940 OE1 GLU A 62 -20.913 -15.476 -4.537 1.00 0.00 O ATOM 941 OE2 GLU A 62 -22.556 -16.900 -4.349 1.00 0.00 O ATOM 0 H GLU A 62 -21.170 -13.850 -5.267 1.00 0.00 H new ATOM 0 HA GLU A 62 -23.575 -12.520 -4.797 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -21.246 -13.391 -3.023 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -22.775 -12.817 -2.387 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -22.965 -15.146 -2.266 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -23.885 -14.728 -3.698 1.00 0.00 H new ATOM 948 N THR A 63 -20.889 -10.648 -4.409 1.00 0.00 N ATOM 949 CA THR A 63 -20.469 -9.259 -4.336 1.00 0.00 C ATOM 950 C THR A 63 -20.831 -8.539 -5.622 1.00 0.00 C ATOM 951 O THR A 63 -21.411 -7.464 -5.565 1.00 0.00 O ATOM 952 CB THR A 63 -18.962 -9.094 -4.060 1.00 0.00 C ATOM 953 OG1 THR A 63 -18.296 -10.328 -3.935 1.00 0.00 O ATOM 954 CG2 THR A 63 -18.736 -8.274 -2.790 1.00 0.00 C ATOM 0 H THR A 63 -20.131 -11.299 -4.612 1.00 0.00 H new ATOM 0 HA THR A 63 -20.999 -8.819 -3.491 1.00 0.00 H new ATOM 0 HB THR A 63 -18.546 -8.573 -4.923 1.00 0.00 H new ATOM 0 HG1 THR A 63 -18.365 -10.824 -4.778 1.00 0.00 H new ATOM 0 HG21 THR A 63 -17.666 -8.168 -2.611 1.00 0.00 H new ATOM 0 HG22 THR A 63 -19.184 -7.287 -2.910 1.00 0.00 H new ATOM 0 HG23 THR A 63 -19.197 -8.781 -1.943 1.00 0.00 H new ATOM 962 N ALA A 64 -20.507 -9.103 -6.788 1.00 0.00 N ATOM 963 CA ALA A 64 -20.658 -8.367 -8.034 1.00 0.00 C ATOM 964 C ALA A 64 -22.137 -8.031 -8.278 1.00 0.00 C ATOM 965 O ALA A 64 -22.485 -6.872 -8.516 1.00 0.00 O ATOM 966 CB ALA A 64 -20.045 -9.195 -9.170 1.00 0.00 C ATOM 0 H ALA A 64 -20.145 -10.051 -6.890 1.00 0.00 H new ATOM 0 HA ALA A 64 -20.129 -7.415 -7.984 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -20.151 -8.656 -10.111 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -18.988 -9.366 -8.966 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -20.560 -10.153 -9.241 1.00 0.00 H new ATOM 972 N GLY A 65 -23.022 -9.014 -8.092 1.00 0.00 N ATOM 973 CA GLY A 65 -24.464 -8.847 -8.200 1.00 0.00 C ATOM 974 C GLY A 65 -25.025 -7.855 -7.178 1.00 0.00 C ATOM 975 O GLY A 65 -26.054 -7.233 -7.443 1.00 0.00 O ATOM 0 H GLY A 65 -22.744 -9.967 -7.857 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -24.711 -8.505 -9.205 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -24.948 -9.814 -8.064 1.00 0.00 H new ATOM 979 N LYS A 66 -24.335 -7.637 -6.049 1.00 0.00 N ATOM 980 CA LYS A 66 -24.715 -6.652 -5.033 1.00 0.00 C ATOM 981 C LYS A 66 -24.771 -5.238 -5.622 1.00 0.00 C ATOM 982 O LYS A 66 -25.560 -4.419 -5.149 1.00 0.00 O ATOM 983 CB LYS A 66 -23.717 -6.712 -3.864 1.00 0.00 C ATOM 984 CG LYS A 66 -24.367 -6.509 -2.491 1.00 0.00 C ATOM 985 CD LYS A 66 -23.319 -6.429 -1.367 1.00 0.00 C ATOM 986 CE LYS A 66 -22.270 -7.561 -1.320 1.00 0.00 C ATOM 987 NZ LYS A 66 -22.837 -8.936 -1.268 1.00 0.00 N ATOM 0 H LYS A 66 -23.485 -8.149 -5.815 1.00 0.00 H new ATOM 0 HA LYS A 66 -25.714 -6.894 -4.669 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -23.211 -7.678 -3.878 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -22.952 -5.950 -4.011 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -24.959 -5.594 -2.501 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -25.054 -7.331 -2.289 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -22.792 -5.479 -1.459 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -23.844 -6.411 -0.412 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -21.630 -7.480 -2.198 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -21.634 -7.412 -0.447 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -22.108 -9.600 -0.937 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -23.645 -8.954 -0.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -23.155 -9.217 -2.218 1.00 0.00 H new ATOM 1001 N TYR A 67 -23.979 -4.969 -6.666 1.00 0.00 N ATOM 1002 CA TYR A 67 -23.929 -3.685 -7.367 1.00 0.00 C ATOM 1003 C TYR A 67 -24.400 -3.833 -8.826 1.00 0.00 C ATOM 1004 O TYR A 67 -24.221 -2.916 -9.630 1.00 0.00 O ATOM 1005 CB TYR A 67 -22.509 -3.091 -7.283 1.00 0.00 C ATOM 1006 CG TYR A 67 -21.757 -3.382 -5.996 1.00 0.00 C ATOM 1007 CD1 TYR A 67 -21.966 -2.613 -4.834 1.00 0.00 C ATOM 1008 CD2 TYR A 67 -20.866 -4.468 -5.964 1.00 0.00 C ATOM 1009 CE1 TYR A 67 -21.290 -2.938 -3.645 1.00 0.00 C ATOM 1010 CE2 TYR A 67 -20.209 -4.818 -4.776 1.00 0.00 C ATOM 1011 CZ TYR A 67 -20.431 -4.059 -3.602 1.00 0.00 C ATOM 1012 OH TYR A 67 -19.858 -4.409 -2.419 1.00 0.00 O ATOM 0 H TYR A 67 -23.338 -5.660 -7.056 1.00 0.00 H new ATOM 0 HA TYR A 67 -24.614 -2.992 -6.879 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -21.924 -3.472 -8.120 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -22.577 -2.010 -7.408 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -22.646 -1.774 -4.857 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -20.686 -5.039 -6.863 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -21.427 -2.330 -2.763 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -19.537 -5.663 -4.757 1.00 0.00 H new ATOM 0 HH TYR A 67 -18.884 -4.437 -2.523 1.00 0.00 H new ATOM 1022 N GLY A 68 -24.984 -4.983 -9.188 1.00 0.00 N ATOM 1023 CA GLY A 68 -25.453 -5.286 -10.537 1.00 0.00 C ATOM 1024 C GLY A 68 -24.323 -5.497 -11.550 1.00 0.00 C ATOM 1025 O GLY A 68 -24.561 -5.407 -12.757 1.00 0.00 O ATOM 0 H GLY A 68 -25.145 -5.745 -8.530 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -26.071 -6.183 -10.504 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -26.091 -4.472 -10.882 1.00 0.00 H new ATOM 1029 N VAL A 69 -23.099 -5.759 -11.088 1.00 0.00 N ATOM 1030 CA VAL A 69 -21.947 -6.047 -11.934 1.00 0.00 C ATOM 1031 C VAL A 69 -21.980 -7.537 -12.283 1.00 0.00 C ATOM 1032 O VAL A 69 -22.182 -8.384 -11.412 1.00 0.00 O ATOM 1033 CB VAL A 69 -20.646 -5.658 -11.189 1.00 0.00 C ATOM 1034 CG1 VAL A 69 -19.375 -6.012 -11.978 1.00 0.00 C ATOM 1035 CG2 VAL A 69 -20.614 -4.148 -10.898 1.00 0.00 C ATOM 0 H VAL A 69 -22.880 -5.776 -10.092 1.00 0.00 H new ATOM 0 HA VAL A 69 -21.978 -5.466 -12.856 1.00 0.00 H new ATOM 0 HB VAL A 69 -20.655 -6.233 -10.263 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -18.497 -5.715 -11.405 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -19.345 -7.087 -12.157 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -19.381 -5.485 -12.932 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -19.691 -3.898 -10.374 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -20.660 -3.596 -11.837 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -21.468 -3.879 -10.277 1.00 0.00 H new ATOM 1045 N MET A 70 -21.763 -7.856 -13.560 1.00 0.00 N ATOM 1046 CA MET A 70 -21.485 -9.210 -14.038 1.00 0.00 C ATOM 1047 C MET A 70 -20.708 -9.126 -15.366 1.00 0.00 C ATOM 1048 O MET A 70 -20.837 -9.972 -16.255 1.00 0.00 O ATOM 1049 CB MET A 70 -22.761 -10.083 -14.079 1.00 0.00 C ATOM 1050 CG MET A 70 -22.570 -11.330 -13.202 1.00 0.00 C ATOM 1051 SD MET A 70 -21.167 -12.397 -13.658 1.00 0.00 S ATOM 1052 CE MET A 70 -20.943 -13.323 -12.114 1.00 0.00 C ATOM 0 H MET A 70 -21.776 -7.163 -14.308 1.00 0.00 H new ATOM 0 HA MET A 70 -20.842 -9.734 -13.331 1.00 0.00 H new ATOM 0 HB2 MET A 70 -23.617 -9.508 -13.727 1.00 0.00 H new ATOM 0 HB3 MET A 70 -22.977 -10.379 -15.106 1.00 0.00 H new ATOM 0 HG2 MET A 70 -22.440 -11.010 -12.168 1.00 0.00 H new ATOM 0 HG3 MET A 70 -23.483 -11.924 -13.240 1.00 0.00 H new ATOM 0 HE1 MET A 70 -20.116 -14.024 -12.227 1.00 0.00 H new ATOM 0 HE2 MET A 70 -20.722 -12.630 -11.303 1.00 0.00 H new ATOM 0 HE3 MET A 70 -21.856 -13.872 -11.883 1.00 0.00 H new ATOM 1062 N SER A 71 -19.890 -8.076 -15.489 1.00 0.00 N ATOM 1063 CA SER A 71 -19.001 -7.791 -16.601 1.00 0.00 C ATOM 1064 C SER A 71 -17.690 -7.303 -15.986 1.00 0.00 C ATOM 1065 O SER A 71 -17.696 -6.756 -14.878 1.00 0.00 O ATOM 1066 CB SER A 71 -19.620 -6.725 -17.518 1.00 0.00 C ATOM 1067 OG SER A 71 -20.916 -7.105 -17.961 1.00 0.00 O ATOM 0 H SER A 71 -19.834 -7.361 -14.763 1.00 0.00 H new ATOM 0 HA SER A 71 -18.831 -8.673 -17.218 1.00 0.00 H new ATOM 0 HB2 SER A 71 -19.681 -5.776 -16.985 1.00 0.00 H new ATOM 0 HB3 SER A 71 -18.972 -6.565 -18.380 1.00 0.00 H new ATOM 0 HG SER A 71 -21.282 -6.405 -18.541 1.00 0.00 H new ATOM 1073 N ILE A 72 -16.567 -7.521 -16.670 1.00 0.00 N ATOM 1074 CA ILE A 72 -15.228 -7.317 -16.128 1.00 0.00 C ATOM 1075 C ILE A 72 -14.281 -6.859 -17.256 1.00 0.00 C ATOM 1076 O ILE A 72 -14.587 -7.115 -18.426 1.00 0.00 O ATOM 1077 CB ILE A 72 -14.733 -8.634 -15.475 1.00 0.00 C ATOM 1078 CG1 ILE A 72 -14.842 -9.838 -16.441 1.00 0.00 C ATOM 1079 CG2 ILE A 72 -15.477 -8.911 -14.154 1.00 0.00 C ATOM 1080 CD1 ILE A 72 -14.194 -11.114 -15.910 1.00 0.00 C ATOM 0 H ILE A 72 -16.565 -7.851 -17.635 1.00 0.00 H new ATOM 0 HA ILE A 72 -15.245 -6.541 -15.363 1.00 0.00 H new ATOM 0 HB ILE A 72 -13.675 -8.502 -15.247 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -15.895 -10.034 -16.645 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -14.377 -9.573 -17.391 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -15.110 -9.840 -13.718 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -15.302 -8.090 -13.459 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -16.546 -8.999 -14.350 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -14.311 -11.913 -16.642 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -13.133 -10.937 -15.733 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -14.675 -11.404 -14.976 1.00 0.00 H new ATOM 1092 N PRO A 73 -13.132 -6.223 -16.951 1.00 0.00 N ATOM 1093 CA PRO A 73 -12.757 -5.708 -15.639 1.00 0.00 C ATOM 1094 C PRO A 73 -13.684 -4.555 -15.259 1.00 0.00 C ATOM 1095 O PRO A 73 -14.037 -3.734 -16.112 1.00 0.00 O ATOM 1096 CB PRO A 73 -11.305 -5.232 -15.763 1.00 0.00 C ATOM 1097 CG PRO A 73 -11.113 -4.973 -17.256 1.00 0.00 C ATOM 1098 CD PRO A 73 -12.107 -5.915 -17.930 1.00 0.00 C ATOM 0 HA PRO A 73 -12.845 -6.466 -14.861 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -11.132 -4.329 -15.178 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -10.608 -5.986 -15.398 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -11.316 -3.932 -17.509 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -10.090 -5.183 -17.568 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -12.545 -5.447 -18.812 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -11.609 -6.825 -18.266 1.00 0.00 H new ATOM 1106 N THR A 74 -14.046 -4.478 -13.983 1.00 0.00 N ATOM 1107 CA THR A 74 -14.898 -3.423 -13.457 1.00 0.00 C ATOM 1108 C THR A 74 -14.228 -2.908 -12.192 1.00 0.00 C ATOM 1109 O THR A 74 -13.836 -3.688 -11.326 1.00 0.00 O ATOM 1110 CB THR A 74 -16.325 -3.961 -13.250 1.00 0.00 C ATOM 1111 OG1 THR A 74 -16.901 -4.227 -14.511 1.00 0.00 O ATOM 1112 CG2 THR A 74 -17.233 -2.971 -12.511 1.00 0.00 C ATOM 0 H THR A 74 -13.752 -5.155 -13.279 1.00 0.00 H new ATOM 0 HA THR A 74 -15.011 -2.585 -14.145 1.00 0.00 H new ATOM 0 HB THR A 74 -16.243 -4.861 -12.641 1.00 0.00 H new ATOM 0 HG1 THR A 74 -16.911 -5.194 -14.669 1.00 0.00 H new ATOM 0 HG21 THR A 74 -18.226 -3.405 -12.394 1.00 0.00 H new ATOM 0 HG22 THR A 74 -16.813 -2.756 -11.528 1.00 0.00 H new ATOM 0 HG23 THR A 74 -17.306 -2.047 -13.084 1.00 0.00 H new ATOM 1120 N LEU A 75 -14.062 -1.590 -12.105 1.00 0.00 N ATOM 1121 CA LEU A 75 -13.351 -0.919 -11.035 1.00 0.00 C ATOM 1122 C LEU A 75 -14.393 -0.140 -10.253 1.00 0.00 C ATOM 1123 O LEU A 75 -14.957 0.826 -10.772 1.00 0.00 O ATOM 1124 CB LEU A 75 -12.263 0.027 -11.578 1.00 0.00 C ATOM 1125 CG LEU A 75 -11.219 -0.604 -12.516 1.00 0.00 C ATOM 1126 CD1 LEU A 75 -10.151 0.444 -12.840 1.00 0.00 C ATOM 1127 CD2 LEU A 75 -10.551 -1.850 -11.935 1.00 0.00 C ATOM 0 H LEU A 75 -14.433 -0.945 -12.803 1.00 0.00 H new ATOM 0 HA LEU A 75 -12.836 -1.645 -10.406 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -12.753 0.843 -12.110 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -11.739 0.469 -10.730 1.00 0.00 H new ATOM 0 HG LEU A 75 -11.746 -0.927 -13.414 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -9.404 0.009 -13.505 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -10.617 1.300 -13.328 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -9.670 0.770 -11.918 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -9.827 -2.242 -12.650 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -10.041 -1.590 -11.007 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -11.308 -2.608 -11.733 1.00 0.00 H new ATOM 1139 N LEU A 76 -14.693 -0.577 -9.034 1.00 0.00 N ATOM 1140 CA LEU A 76 -15.477 0.239 -8.115 1.00 0.00 C ATOM 1141 C LEU A 76 -14.482 1.119 -7.376 1.00 0.00 C ATOM 1142 O LEU A 76 -13.344 0.705 -7.144 1.00 0.00 O ATOM 1143 CB LEU A 76 -16.270 -0.618 -7.114 1.00 0.00 C ATOM 1144 CG LEU A 76 -17.705 -0.924 -7.576 1.00 0.00 C ATOM 1145 CD1 LEU A 76 -17.763 -1.697 -8.899 1.00 0.00 C ATOM 1146 CD2 LEU A 76 -18.456 -1.699 -6.490 1.00 0.00 C ATOM 0 H LEU A 76 -14.408 -1.483 -8.662 1.00 0.00 H new ATOM 0 HA LEU A 76 -16.213 0.824 -8.666 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -15.741 -1.557 -6.951 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -16.307 -0.102 -6.155 1.00 0.00 H new ATOM 0 HG LEU A 76 -18.185 0.039 -7.750 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -18.803 -1.880 -9.168 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -17.283 -1.112 -9.684 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -17.244 -2.649 -8.787 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -19.470 -1.910 -6.829 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -17.939 -2.637 -6.289 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -18.494 -1.103 -5.578 1.00 0.00 H new ATOM 1158 N VAL A 77 -14.927 2.292 -6.943 1.00 0.00 N ATOM 1159 CA VAL A 77 -14.184 3.147 -6.037 1.00 0.00 C ATOM 1160 C VAL A 77 -15.132 3.361 -4.867 1.00 0.00 C ATOM 1161 O VAL A 77 -16.318 3.644 -5.070 1.00 0.00 O ATOM 1162 CB VAL A 77 -13.745 4.461 -6.714 1.00 0.00 C ATOM 1163 CG1 VAL A 77 -12.752 5.230 -5.828 1.00 0.00 C ATOM 1164 CG2 VAL A 77 -13.083 4.225 -8.083 1.00 0.00 C ATOM 0 H VAL A 77 -15.830 2.679 -7.218 1.00 0.00 H new ATOM 0 HA VAL A 77 -13.244 2.701 -5.712 1.00 0.00 H new ATOM 0 HB VAL A 77 -14.656 5.042 -6.859 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -12.458 6.153 -6.328 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -13.224 5.468 -4.875 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -11.869 4.615 -5.652 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -12.793 5.182 -8.517 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -12.198 3.601 -7.957 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -13.788 3.725 -8.747 1.00 0.00 H new ATOM 1174 N LEU A 78 -14.617 3.187 -3.655 1.00 0.00 N ATOM 1175 CA LEU A 78 -15.348 3.254 -2.400 1.00 0.00 C ATOM 1176 C LEU A 78 -14.533 4.126 -1.447 1.00 0.00 C ATOM 1177 O LEU A 78 -13.328 4.306 -1.641 1.00 0.00 O ATOM 1178 CB LEU A 78 -15.577 1.851 -1.789 1.00 0.00 C ATOM 1179 CG LEU A 78 -16.308 0.831 -2.695 1.00 0.00 C ATOM 1180 CD1 LEU A 78 -15.314 -0.051 -3.467 1.00 0.00 C ATOM 1181 CD2 LEU A 78 -17.246 -0.075 -1.885 1.00 0.00 C ATOM 0 H LEU A 78 -13.627 2.985 -3.517 1.00 0.00 H new ATOM 0 HA LEU A 78 -16.337 3.679 -2.573 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -14.609 1.434 -1.513 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -16.149 1.966 -0.868 1.00 0.00 H new ATOM 0 HG LEU A 78 -16.896 1.416 -3.402 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -15.862 -0.755 -4.093 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -14.682 0.577 -4.095 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -14.692 -0.601 -2.761 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -17.741 -0.778 -2.555 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -16.668 -0.627 -1.143 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -17.995 0.535 -1.381 1.00 0.00 H new ATOM 1193 N LYS A 79 -15.165 4.663 -0.406 1.00 0.00 N ATOM 1194 CA LYS A 79 -14.488 5.488 0.588 1.00 0.00 C ATOM 1195 C LYS A 79 -15.160 5.257 1.928 1.00 0.00 C ATOM 1196 O LYS A 79 -16.384 5.364 2.002 1.00 0.00 O ATOM 1197 CB LYS A 79 -14.556 6.960 0.145 1.00 0.00 C ATOM 1198 CG LYS A 79 -13.632 7.864 0.973 1.00 0.00 C ATOM 1199 CD LYS A 79 -13.594 9.272 0.361 1.00 0.00 C ATOM 1200 CE LYS A 79 -12.513 10.146 1.015 1.00 0.00 C ATOM 1201 NZ LYS A 79 -12.295 11.398 0.255 1.00 0.00 N ATOM 0 H LYS A 79 -16.162 4.538 -0.229 1.00 0.00 H new ATOM 0 HA LYS A 79 -13.435 5.224 0.683 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -14.283 7.033 -0.908 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -15.582 7.316 0.233 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -13.986 7.915 2.003 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -12.627 7.443 1.002 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -13.404 9.199 -0.710 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -14.568 9.747 0.480 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -12.806 10.386 2.037 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -11.579 9.588 1.074 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -11.339 11.759 0.448 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -12.394 11.208 -0.763 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -12.998 12.107 0.545 1.00 0.00 H new ATOM 1215 N ASP A 80 -14.376 4.924 2.960 1.00 0.00 N ATOM 1216 CA ASP A 80 -14.766 4.705 4.361 1.00 0.00 C ATOM 1217 C ASP A 80 -15.806 3.596 4.615 1.00 0.00 C ATOM 1218 O ASP A 80 -15.865 3.069 5.726 1.00 0.00 O ATOM 1219 CB ASP A 80 -15.188 6.036 5.002 1.00 0.00 C ATOM 1220 CG ASP A 80 -15.468 5.895 6.508 1.00 0.00 C ATOM 1221 OD1 ASP A 80 -14.509 5.717 7.291 1.00 0.00 O ATOM 1222 OD2 ASP A 80 -16.643 6.024 6.924 1.00 0.00 O ATOM 0 H ASP A 80 -13.373 4.790 2.829 1.00 0.00 H new ATOM 0 HA ASP A 80 -13.870 4.318 4.846 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -14.403 6.776 4.848 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -16.081 6.411 4.502 1.00 0.00 H new ATOM 1227 N GLY A 81 -16.571 3.174 3.607 1.00 0.00 N ATOM 1228 CA GLY A 81 -17.494 2.052 3.669 1.00 0.00 C ATOM 1229 C GLY A 81 -18.545 2.035 2.555 1.00 0.00 C ATOM 1230 O GLY A 81 -19.355 1.106 2.534 1.00 0.00 O ATOM 0 H GLY A 81 -16.560 3.625 2.692 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -16.923 1.125 3.627 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -18.004 2.069 4.632 1.00 0.00 H new ATOM 1234 N GLU A 82 -18.573 3.013 1.638 1.00 0.00 N ATOM 1235 CA GLU A 82 -19.617 3.138 0.627 1.00 0.00 C ATOM 1236 C GLU A 82 -19.002 3.417 -0.744 1.00 0.00 C ATOM 1237 O GLU A 82 -17.924 4.010 -0.829 1.00 0.00 O ATOM 1238 CB GLU A 82 -20.592 4.241 1.069 1.00 0.00 C ATOM 1239 CG GLU A 82 -20.039 5.674 0.995 1.00 0.00 C ATOM 1240 CD GLU A 82 -21.053 6.692 1.547 1.00 0.00 C ATOM 1241 OE1 GLU A 82 -21.908 7.189 0.779 1.00 0.00 O ATOM 1242 OE2 GLU A 82 -21.001 7.021 2.754 1.00 0.00 O ATOM 0 H GLU A 82 -17.862 3.743 1.582 1.00 0.00 H new ATOM 0 HA GLU A 82 -20.172 2.205 0.531 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -21.487 4.182 0.449 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -20.901 4.041 2.095 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -19.110 5.738 1.562 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -19.798 5.921 -0.039 1.00 0.00 H new ATOM 1249 N VAL A 83 -19.677 2.986 -1.813 1.00 0.00 N ATOM 1250 CA VAL A 83 -19.286 3.252 -3.192 1.00 0.00 C ATOM 1251 C VAL A 83 -19.384 4.759 -3.439 1.00 0.00 C ATOM 1252 O VAL A 83 -20.340 5.416 -3.017 1.00 0.00 O ATOM 1253 CB VAL A 83 -20.166 2.432 -4.167 1.00 0.00 C ATOM 1254 CG1 VAL A 83 -19.724 2.597 -5.628 1.00 0.00 C ATOM 1255 CG2 VAL A 83 -20.149 0.926 -3.853 1.00 0.00 C ATOM 0 H VAL A 83 -20.529 2.430 -1.738 1.00 0.00 H new ATOM 0 HA VAL A 83 -18.257 2.940 -3.369 1.00 0.00 H new ATOM 0 HB VAL A 83 -21.172 2.829 -4.030 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -20.371 2.003 -6.273 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -19.793 3.647 -5.913 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -18.694 2.258 -5.737 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -20.782 0.398 -4.566 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -19.128 0.550 -3.927 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -20.525 0.761 -2.843 1.00 0.00 H new ATOM 1265 N VAL A 84 -18.404 5.276 -4.174 1.00 0.00 N ATOM 1266 CA VAL A 84 -18.360 6.641 -4.671 1.00 0.00 C ATOM 1267 C VAL A 84 -18.270 6.655 -6.201 1.00 0.00 C ATOM 1268 O VAL A 84 -18.687 7.648 -6.799 1.00 0.00 O ATOM 1269 CB VAL A 84 -17.234 7.453 -3.987 1.00 0.00 C ATOM 1270 CG1 VAL A 84 -17.442 7.530 -2.466 1.00 0.00 C ATOM 1271 CG2 VAL A 84 -15.824 6.911 -4.265 1.00 0.00 C ATOM 0 H VAL A 84 -17.587 4.730 -4.449 1.00 0.00 H new ATOM 0 HA VAL A 84 -19.292 7.141 -4.407 1.00 0.00 H new ATOM 0 HB VAL A 84 -17.300 8.448 -4.428 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -16.634 8.107 -2.017 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -18.395 8.014 -2.253 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -17.445 6.523 -2.048 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -15.088 7.531 -3.753 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -15.750 5.886 -3.902 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -15.632 6.931 -5.338 1.00 0.00 H new ATOM 1281 N GLU A 85 -17.806 5.574 -6.853 1.00 0.00 N ATOM 1282 CA GLU A 85 -17.809 5.502 -8.320 1.00 0.00 C ATOM 1283 C GLU A 85 -17.761 4.050 -8.814 1.00 0.00 C ATOM 1284 O GLU A 85 -17.440 3.133 -8.057 1.00 0.00 O ATOM 1285 CB GLU A 85 -16.632 6.338 -8.873 1.00 0.00 C ATOM 1286 CG GLU A 85 -16.627 6.608 -10.385 1.00 0.00 C ATOM 1287 CD GLU A 85 -17.948 7.209 -10.898 1.00 0.00 C ATOM 1288 OE1 GLU A 85 -18.918 6.443 -11.093 1.00 0.00 O ATOM 1289 OE2 GLU A 85 -18.022 8.438 -11.125 1.00 0.00 O ATOM 0 H GLU A 85 -17.428 4.747 -6.390 1.00 0.00 H new ATOM 0 HA GLU A 85 -18.743 5.921 -8.695 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -16.624 7.298 -8.356 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -15.703 5.829 -8.615 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -15.809 7.288 -10.623 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -16.430 5.675 -10.913 1.00 0.00 H new ATOM 1296 N THR A 86 -18.082 3.835 -10.089 1.00 0.00 N ATOM 1297 CA THR A 86 -17.955 2.567 -10.798 1.00 0.00 C ATOM 1298 C THR A 86 -17.543 2.867 -12.249 1.00 0.00 C ATOM 1299 O THR A 86 -18.084 3.785 -12.871 1.00 0.00 O ATOM 1300 CB THR A 86 -19.301 1.824 -10.713 1.00 0.00 C ATOM 1301 OG1 THR A 86 -19.587 1.521 -9.362 1.00 0.00 O ATOM 1302 CG2 THR A 86 -19.347 0.523 -11.524 1.00 0.00 C ATOM 0 H THR A 86 -18.455 4.577 -10.682 1.00 0.00 H new ATOM 0 HA THR A 86 -17.192 1.927 -10.356 1.00 0.00 H new ATOM 0 HB THR A 86 -20.044 2.495 -11.143 1.00 0.00 H new ATOM 0 HG1 THR A 86 -20.444 1.050 -9.307 1.00 0.00 H new ATOM 0 HG21 THR A 86 -20.327 0.059 -11.413 1.00 0.00 H new ATOM 0 HG22 THR A 86 -19.167 0.744 -12.576 1.00 0.00 H new ATOM 0 HG23 THR A 86 -18.579 -0.160 -11.160 1.00 0.00 H new ATOM 1310 N SER A 87 -16.617 2.071 -12.789 1.00 0.00 N ATOM 1311 CA SER A 87 -16.060 2.201 -14.134 1.00 0.00 C ATOM 1312 C SER A 87 -15.821 0.797 -14.702 1.00 0.00 C ATOM 1313 O SER A 87 -15.625 -0.145 -13.934 1.00 0.00 O ATOM 1314 CB SER A 87 -14.740 2.987 -14.067 1.00 0.00 C ATOM 1315 OG SER A 87 -14.924 4.267 -13.481 1.00 0.00 O ATOM 0 H SER A 87 -16.219 1.284 -12.277 1.00 0.00 H new ATOM 0 HA SER A 87 -16.751 2.740 -14.782 1.00 0.00 H new ATOM 0 HB2 SER A 87 -14.009 2.423 -13.488 1.00 0.00 H new ATOM 0 HB3 SER A 87 -14.332 3.101 -15.071 1.00 0.00 H new ATOM 0 HG SER A 87 -14.066 4.740 -13.452 1.00 0.00 H new ATOM 1321 N VAL A 88 -15.839 0.636 -16.027 1.00 0.00 N ATOM 1322 CA VAL A 88 -15.737 -0.667 -16.690 1.00 0.00 C ATOM 1323 C VAL A 88 -14.719 -0.555 -17.832 1.00 0.00 C ATOM 1324 O VAL A 88 -14.624 0.492 -18.483 1.00 0.00 O ATOM 1325 CB VAL A 88 -17.136 -1.115 -17.186 1.00 0.00 C ATOM 1326 CG1 VAL A 88 -17.115 -2.531 -17.785 1.00 0.00 C ATOM 1327 CG2 VAL A 88 -18.195 -1.099 -16.068 1.00 0.00 C ATOM 0 H VAL A 88 -15.926 1.416 -16.678 1.00 0.00 H new ATOM 0 HA VAL A 88 -15.387 -1.431 -15.996 1.00 0.00 H new ATOM 0 HB VAL A 88 -17.403 -0.388 -17.953 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -18.117 -2.800 -18.118 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -16.431 -2.557 -18.634 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -16.781 -3.241 -17.028 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -19.155 -1.421 -16.471 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -17.891 -1.776 -15.269 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -18.289 -0.088 -15.671 1.00 0.00 H new ATOM 1337 N GLY A 89 -13.985 -1.639 -18.093 1.00 0.00 N ATOM 1338 CA GLY A 89 -13.067 -1.766 -19.216 1.00 0.00 C ATOM 1339 C GLY A 89 -11.655 -1.292 -18.872 1.00 0.00 C ATOM 1340 O GLY A 89 -11.396 -0.784 -17.776 1.00 0.00 O ATOM 0 H GLY A 89 -14.017 -2.475 -17.509 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -13.030 -2.808 -19.535 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -13.446 -1.188 -20.059 1.00 0.00 H new ATOM 1344 N PHE A 90 -10.730 -1.485 -19.816 1.00 0.00 N ATOM 1345 CA PHE A 90 -9.348 -1.027 -19.699 1.00 0.00 C ATOM 1346 C PHE A 90 -9.309 0.505 -19.604 1.00 0.00 C ATOM 1347 O PHE A 90 -10.066 1.190 -20.297 1.00 0.00 O ATOM 1348 CB PHE A 90 -8.539 -1.527 -20.906 1.00 0.00 C ATOM 1349 CG PHE A 90 -7.074 -1.127 -20.879 1.00 0.00 C ATOM 1350 CD1 PHE A 90 -6.662 0.094 -21.448 1.00 0.00 C ATOM 1351 CD2 PHE A 90 -6.124 -1.964 -20.263 1.00 0.00 C ATOM 1352 CE1 PHE A 90 -5.312 0.486 -21.385 1.00 0.00 C ATOM 1353 CE2 PHE A 90 -4.774 -1.577 -20.210 1.00 0.00 C ATOM 1354 CZ PHE A 90 -4.368 -0.350 -20.765 1.00 0.00 C ATOM 0 H PHE A 90 -10.925 -1.970 -20.692 1.00 0.00 H new ATOM 0 HA PHE A 90 -8.902 -1.433 -18.791 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -8.607 -2.614 -20.950 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -8.993 -1.142 -21.819 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -7.385 0.732 -21.935 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -6.433 -2.904 -19.831 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -5.002 1.428 -21.813 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -4.046 -2.223 -19.742 1.00 0.00 H new ATOM 0 HZ PHE A 90 -3.332 -0.051 -20.715 1.00 0.00 H new ATOM 1364 N LYS A 91 -8.377 1.040 -18.806 1.00 0.00 N ATOM 1365 CA LYS A 91 -8.035 2.460 -18.743 1.00 0.00 C ATOM 1366 C LYS A 91 -6.532 2.573 -18.477 1.00 0.00 C ATOM 1367 O LYS A 91 -5.990 1.703 -17.789 1.00 0.00 O ATOM 1368 CB LYS A 91 -8.810 3.166 -17.614 1.00 0.00 C ATOM 1369 CG LYS A 91 -10.137 3.756 -18.105 1.00 0.00 C ATOM 1370 CD LYS A 91 -10.872 4.489 -16.972 1.00 0.00 C ATOM 1371 CE LYS A 91 -12.270 4.973 -17.395 1.00 0.00 C ATOM 1372 NZ LYS A 91 -12.236 6.042 -18.428 1.00 0.00 N ATOM 0 H LYS A 91 -7.822 0.473 -18.165 1.00 0.00 H new ATOM 0 HA LYS A 91 -8.302 2.939 -19.685 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -9.005 2.456 -16.810 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -8.194 3.961 -17.194 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -9.949 4.447 -18.927 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -10.769 2.959 -18.497 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -10.965 3.824 -16.113 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -10.277 5.344 -16.650 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -12.839 4.126 -17.778 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -12.800 5.343 -16.517 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -13.208 6.323 -18.669 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -11.719 6.865 -18.059 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -11.757 5.686 -19.280 1.00 0.00 H new ATOM 1386 N PRO A 92 -5.862 3.621 -18.986 1.00 0.00 N ATOM 1387 CA PRO A 92 -4.450 3.866 -18.722 1.00 0.00 C ATOM 1388 C PRO A 92 -4.250 4.387 -17.294 1.00 0.00 C ATOM 1389 O PRO A 92 -5.168 4.949 -16.690 1.00 0.00 O ATOM 1390 CB PRO A 92 -4.037 4.902 -19.771 1.00 0.00 C ATOM 1391 CG PRO A 92 -5.311 5.715 -19.992 1.00 0.00 C ATOM 1392 CD PRO A 92 -6.409 4.663 -19.847 1.00 0.00 C ATOM 0 HA PRO A 92 -3.844 2.962 -18.791 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -3.218 5.528 -19.416 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -3.699 4.427 -20.692 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -5.415 6.513 -19.257 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -5.327 6.184 -20.976 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -7.309 5.097 -19.410 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -6.690 4.257 -20.819 1.00 0.00 H new ATOM 1400 N LYS A 93 -3.025 4.268 -16.765 1.00 0.00 N ATOM 1401 CA LYS A 93 -2.708 4.671 -15.393 1.00 0.00 C ATOM 1402 C LYS A 93 -3.022 6.145 -15.170 1.00 0.00 C ATOM 1403 O LYS A 93 -3.512 6.501 -14.107 1.00 0.00 O ATOM 1404 CB LYS A 93 -1.224 4.397 -15.110 1.00 0.00 C ATOM 1405 CG LYS A 93 -0.843 4.527 -13.621 1.00 0.00 C ATOM 1406 CD LYS A 93 0.533 5.192 -13.479 1.00 0.00 C ATOM 1407 CE LYS A 93 0.438 6.722 -13.612 1.00 0.00 C ATOM 1408 NZ LYS A 93 1.756 7.391 -13.456 1.00 0.00 N ATOM 0 H LYS A 93 -2.228 3.890 -17.277 1.00 0.00 H new ATOM 0 HA LYS A 93 -3.324 4.089 -14.707 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -0.977 3.392 -15.453 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -0.618 5.090 -15.693 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -1.595 5.116 -13.096 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -0.828 3.542 -13.155 1.00 0.00 H new ATOM 0 HD2 LYS A 93 0.963 4.936 -12.511 1.00 0.00 H new ATOM 0 HD3 LYS A 93 1.207 4.801 -14.241 1.00 0.00 H new ATOM 0 HE2 LYS A 93 0.020 6.973 -14.587 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -0.252 7.106 -12.861 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 1.710 8.348 -13.861 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 1.996 7.454 -12.446 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 2.486 6.840 -13.952 1.00 0.00 H new ATOM 1422 N GLU A 94 -2.759 7.002 -16.156 1.00 0.00 N ATOM 1423 CA GLU A 94 -3.000 8.433 -16.059 1.00 0.00 C ATOM 1424 C GLU A 94 -4.481 8.739 -15.801 1.00 0.00 C ATOM 1425 O GLU A 94 -4.803 9.605 -14.985 1.00 0.00 O ATOM 1426 CB GLU A 94 -2.479 9.099 -17.341 1.00 0.00 C ATOM 1427 CG GLU A 94 -2.464 10.624 -17.213 1.00 0.00 C ATOM 1428 CD GLU A 94 -1.863 11.295 -18.461 1.00 0.00 C ATOM 1429 OE1 GLU A 94 -2.607 11.569 -19.431 1.00 0.00 O ATOM 1430 OE2 GLU A 94 -0.643 11.574 -18.481 1.00 0.00 O ATOM 0 H GLU A 94 -2.368 6.714 -17.053 1.00 0.00 H new ATOM 0 HA GLU A 94 -2.463 8.842 -15.203 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -1.472 8.741 -17.555 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -3.107 8.809 -18.184 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -3.481 10.986 -17.059 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -1.887 10.910 -16.333 1.00 0.00 H new ATOM 1437 N ALA A 95 -5.384 7.995 -16.440 1.00 0.00 N ATOM 1438 CA ALA A 95 -6.811 8.134 -16.210 1.00 0.00 C ATOM 1439 C ALA A 95 -7.182 7.614 -14.822 1.00 0.00 C ATOM 1440 O ALA A 95 -7.975 8.230 -14.116 1.00 0.00 O ATOM 1441 CB ALA A 95 -7.573 7.352 -17.275 1.00 0.00 C ATOM 0 H ALA A 95 -5.142 7.283 -17.129 1.00 0.00 H new ATOM 0 HA ALA A 95 -7.078 9.189 -16.268 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -8.645 7.455 -17.105 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -7.323 7.743 -18.262 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -7.296 6.299 -17.221 1.00 0.00 H new ATOM 1447 N LEU A 96 -6.606 6.480 -14.419 1.00 0.00 N ATOM 1448 CA LEU A 96 -6.911 5.868 -13.137 1.00 0.00 C ATOM 1449 C LEU A 96 -6.400 6.728 -11.983 1.00 0.00 C ATOM 1450 O LEU A 96 -7.091 6.844 -10.976 1.00 0.00 O ATOM 1451 CB LEU A 96 -6.332 4.452 -13.035 1.00 0.00 C ATOM 1452 CG LEU A 96 -6.893 3.425 -14.036 1.00 0.00 C ATOM 1453 CD1 LEU A 96 -6.211 2.070 -13.819 1.00 0.00 C ATOM 1454 CD2 LEU A 96 -8.411 3.263 -13.899 1.00 0.00 C ATOM 0 H LEU A 96 -5.920 5.967 -14.973 1.00 0.00 H new ATOM 0 HA LEU A 96 -7.996 5.796 -13.066 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -5.252 4.511 -13.170 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -6.507 4.080 -12.025 1.00 0.00 H new ATOM 0 HG LEU A 96 -6.687 3.793 -15.041 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -6.609 1.344 -14.528 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -5.137 2.175 -13.972 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -6.401 1.726 -12.802 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -8.765 2.530 -14.623 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -8.651 2.923 -12.892 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -8.897 4.221 -14.085 1.00 0.00 H new ATOM 1466 N GLN A 97 -5.234 7.370 -12.106 1.00 0.00 N ATOM 1467 CA GLN A 97 -4.745 8.242 -11.044 1.00 0.00 C ATOM 1468 C GLN A 97 -5.578 9.519 -10.982 1.00 0.00 C ATOM 1469 O GLN A 97 -5.759 10.067 -9.897 1.00 0.00 O ATOM 1470 CB GLN A 97 -3.227 8.493 -11.127 1.00 0.00 C ATOM 1471 CG GLN A 97 -2.740 9.324 -12.318 1.00 0.00 C ATOM 1472 CD GLN A 97 -2.952 10.835 -12.183 1.00 0.00 C ATOM 1473 OE1 GLN A 97 -2.459 11.469 -11.253 1.00 0.00 O ATOM 1474 NE2 GLN A 97 -3.676 11.448 -13.106 1.00 0.00 N ATOM 0 H GLN A 97 -4.622 7.302 -12.919 1.00 0.00 H new ATOM 0 HA GLN A 97 -4.878 7.726 -10.093 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -2.912 8.992 -10.210 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -2.722 7.528 -11.154 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -1.677 9.133 -12.464 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -3.252 8.979 -13.216 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -4.081 10.913 -13.874 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -3.829 12.455 -13.049 1.00 0.00 H new ATOM 1483 N GLU A 98 -6.135 9.971 -12.112 1.00 0.00 N ATOM 1484 CA GLU A 98 -7.045 11.104 -12.116 1.00 0.00 C ATOM 1485 C GLU A 98 -8.298 10.691 -11.340 1.00 0.00 C ATOM 1486 O GLU A 98 -8.682 11.365 -10.387 1.00 0.00 O ATOM 1487 CB GLU A 98 -7.356 11.540 -13.558 1.00 0.00 C ATOM 1488 CG GLU A 98 -8.247 12.786 -13.637 1.00 0.00 C ATOM 1489 CD GLU A 98 -7.512 14.078 -13.230 1.00 0.00 C ATOM 1490 OE1 GLU A 98 -6.722 14.611 -14.043 1.00 0.00 O ATOM 1491 OE2 GLU A 98 -7.731 14.581 -12.106 1.00 0.00 O ATOM 0 H GLU A 98 -5.966 9.564 -13.032 1.00 0.00 H new ATOM 0 HA GLU A 98 -6.598 11.972 -11.631 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -6.420 11.738 -14.080 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -7.845 10.718 -14.081 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -8.623 12.893 -14.655 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -9.113 12.648 -12.990 1.00 0.00 H new ATOM 1498 N LEU A 99 -8.865 9.529 -11.670 1.00 0.00 N ATOM 1499 CA LEU A 99 -10.029 8.968 -10.986 1.00 0.00 C ATOM 1500 C LEU A 99 -9.773 8.867 -9.480 1.00 0.00 C ATOM 1501 O LEU A 99 -10.614 9.284 -8.688 1.00 0.00 O ATOM 1502 CB LEU A 99 -10.376 7.602 -11.608 1.00 0.00 C ATOM 1503 CG LEU A 99 -11.456 6.794 -10.861 1.00 0.00 C ATOM 1504 CD1 LEU A 99 -12.810 7.509 -10.845 1.00 0.00 C ATOM 1505 CD2 LEU A 99 -11.611 5.421 -11.527 1.00 0.00 C ATOM 0 H LEU A 99 -8.522 8.943 -12.432 1.00 0.00 H new ATOM 0 HA LEU A 99 -10.886 9.629 -11.116 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -10.710 7.762 -12.633 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -9.467 7.003 -11.658 1.00 0.00 H new ATOM 0 HG LEU A 99 -11.131 6.685 -9.826 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -13.537 6.900 -10.308 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -12.706 8.473 -10.348 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -13.152 7.663 -11.868 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -12.374 4.846 -11.002 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -11.908 5.553 -12.567 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -10.662 4.887 -11.485 1.00 0.00 H new ATOM 1517 N VAL A 100 -8.608 8.360 -9.076 1.00 0.00 N ATOM 1518 CA VAL A 100 -8.251 8.228 -7.671 1.00 0.00 C ATOM 1519 C VAL A 100 -8.177 9.612 -7.029 1.00 0.00 C ATOM 1520 O VAL A 100 -8.846 9.843 -6.025 1.00 0.00 O ATOM 1521 CB VAL A 100 -6.948 7.410 -7.535 1.00 0.00 C ATOM 1522 CG1 VAL A 100 -6.291 7.541 -6.152 1.00 0.00 C ATOM 1523 CG2 VAL A 100 -7.233 5.925 -7.814 1.00 0.00 C ATOM 0 H VAL A 100 -7.887 8.030 -9.718 1.00 0.00 H new ATOM 0 HA VAL A 100 -9.018 7.674 -7.129 1.00 0.00 H new ATOM 0 HB VAL A 100 -6.250 7.817 -8.267 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -5.381 6.942 -6.123 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -6.044 8.586 -5.964 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -6.982 7.188 -5.386 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -6.310 5.353 -7.717 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -7.967 5.555 -7.098 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -7.624 5.813 -8.825 1.00 0.00 H new ATOM 1533 N ASN A 101 -7.411 10.550 -7.596 1.00 0.00 N ATOM 1534 CA ASN A 101 -7.197 11.855 -6.962 1.00 0.00 C ATOM 1535 C ASN A 101 -8.486 12.675 -6.862 1.00 0.00 C ATOM 1536 O ASN A 101 -8.615 13.495 -5.954 1.00 0.00 O ATOM 1537 CB ASN A 101 -6.043 12.638 -7.616 1.00 0.00 C ATOM 1538 CG ASN A 101 -6.475 13.798 -8.508 1.00 0.00 C ATOM 1539 OD1 ASN A 101 -6.275 14.965 -8.187 1.00 0.00 O ATOM 1540 ND2 ASN A 101 -7.051 13.486 -9.651 1.00 0.00 N ATOM 0 H ASN A 101 -6.931 10.431 -8.488 1.00 0.00 H new ATOM 0 HA ASN A 101 -6.888 11.655 -5.936 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -5.395 13.026 -6.830 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -5.445 11.946 -8.209 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -7.342 14.223 -10.293 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -7.206 12.507 -9.894 1.00 0.00 H new ATOM 1547 N LYS A 102 -9.456 12.423 -7.745 1.00 0.00 N ATOM 1548 CA LYS A 102 -10.791 13.015 -7.655 1.00 0.00 C ATOM 1549 C LYS A 102 -11.573 12.520 -6.431 1.00 0.00 C ATOM 1550 O LYS A 102 -12.472 13.238 -5.989 1.00 0.00 O ATOM 1551 CB LYS A 102 -11.580 12.753 -8.949 1.00 0.00 C ATOM 1552 CG LYS A 102 -11.091 13.642 -10.106 1.00 0.00 C ATOM 1553 CD LYS A 102 -11.699 13.254 -11.463 1.00 0.00 C ATOM 1554 CE LYS A 102 -13.226 13.430 -11.487 1.00 0.00 C ATOM 1555 NZ LYS A 102 -13.805 13.137 -12.823 1.00 0.00 N ATOM 0 H LYS A 102 -9.336 11.801 -8.544 1.00 0.00 H new ATOM 0 HA LYS A 102 -10.659 14.090 -7.529 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -11.481 11.704 -9.229 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -12.640 12.937 -8.772 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -11.338 14.681 -9.888 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -10.005 13.580 -10.170 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -11.252 13.865 -12.247 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -11.451 12.216 -11.687 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -13.677 12.771 -10.745 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -13.477 14.451 -11.201 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -14.836 13.269 -12.791 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -13.395 13.782 -13.528 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -13.590 12.154 -13.087 1.00 0.00 H new ATOM 1569 N HIS A 103 -11.250 11.350 -5.864 1.00 0.00 N ATOM 1570 CA HIS A 103 -11.946 10.791 -4.704 1.00 0.00 C ATOM 1571 C HIS A 103 -11.097 10.789 -3.428 1.00 0.00 C ATOM 1572 O HIS A 103 -11.666 10.607 -2.349 1.00 0.00 O ATOM 1573 CB HIS A 103 -12.465 9.383 -5.029 1.00 0.00 C ATOM 1574 CG HIS A 103 -13.553 9.392 -6.073 1.00 0.00 C ATOM 1575 ND1 HIS A 103 -14.802 9.962 -5.950 1.00 0.00 N ATOM 1576 CD2 HIS A 103 -13.472 8.870 -7.335 1.00 0.00 C ATOM 1577 CE1 HIS A 103 -15.451 9.791 -7.115 1.00 0.00 C ATOM 1578 NE2 HIS A 103 -14.676 9.135 -7.997 1.00 0.00 N ATOM 0 H HIS A 103 -10.490 10.761 -6.204 1.00 0.00 H new ATOM 0 HA HIS A 103 -12.791 11.447 -4.494 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -11.637 8.766 -5.378 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -12.845 8.921 -4.118 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -12.625 8.344 -7.749 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -16.456 10.133 -7.315 1.00 0.00 H new ATOM 0 HE2 HIS A 103 -14.917 8.882 -8.955 1.00 0.00 H new ATOM 1586 N LEU A 104 -9.777 11.010 -3.504 1.00 0.00 N ATOM 1587 CA LEU A 104 -8.941 11.233 -2.324 1.00 0.00 C ATOM 1588 C LEU A 104 -9.502 12.401 -1.517 1.00 0.00 C ATOM 1589 O LEU A 104 -9.729 13.483 -2.099 1.00 0.00 O ATOM 1590 CB LEU A 104 -7.466 11.493 -2.683 1.00 0.00 C ATOM 1591 CG LEU A 104 -6.686 10.301 -3.269 1.00 0.00 C ATOM 1592 CD1 LEU A 104 -5.226 10.706 -3.487 1.00 0.00 C ATOM 1593 CD2 LEU A 104 -6.739 9.052 -2.383 1.00 0.00 C ATOM 1594 OXT LEU A 104 -9.711 12.233 -0.298 1.00 0.00 O ATOM 0 H LEU A 104 -9.263 11.038 -4.385 1.00 0.00 H new ATOM 0 HA LEU A 104 -8.963 10.321 -1.728 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -7.428 12.313 -3.400 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -6.950 11.831 -1.785 1.00 0.00 H new ATOM 0 HG LEU A 104 -7.164 10.043 -4.214 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -4.673 9.863 -3.902 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -5.181 11.546 -4.180 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -4.783 10.997 -2.535 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -6.171 8.249 -2.852 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -6.309 9.279 -1.408 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -7.775 8.738 -2.258 1.00 0.00 H new