USER MOD reduce.3.24.130724 H: found=0, std=0, add=789, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 787 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 46 TYR OH : rot -176:sc= 1.09 USER MOD Set 1.2: A 70 THR OG1 : rot 61:sc= 1.92 USER MOD Single : A 1 GLY N :NH3+ -120:sc= 0.111 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 SER OG : rot -57:sc= 0.00472 USER MOD Single : A 13 LYS NZ :NH3+ 166:sc=-0.00411 (180deg=-0.153) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ -110:sc= -1.6! (180deg=-4.87!) USER MOD Single : A 22 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 23 THR OG1 : rot 100:sc= -0.988 USER MOD Single : A 32 LYS NZ :NH3+ 131:sc= -1.86! (180deg=-3.26!) USER MOD Single : A 49 MET CE :methyl -172:sc= -0.346 (180deg=-0.62) USER MOD Single : A 51 LYS NZ :NH3+ 136:sc= 0.523 (180deg=0.0337) USER MOD Single : A 53 SER OG : rot 180:sc= -0.0316 USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 MET CE :methyl -111:sc= -3.92 (180deg=-11.6!) USER MOD Single : A 77 SER OG : rot 99:sc= 1.21 USER MOD Single : A 78 SER OG : rot 96:sc= 0.876 USER MOD Single : A 79 GLN : amide:sc= -0.0325 K(o=-0.032,f=-1.2) USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ -150:sc= -0.149 (180deg=-0.741) USER MOD Single : A 98 ASN : amide:sc= -0.304 K(o=-0.3,f=-1.6) USER MOD Single : A 101 HIS : no HD1:sc= -0.299 X(o=-0.3,f=-0.018) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -41.845 -39.114 17.826 1.00 0.00 N ATOM 2 CA GLY A 1 -40.562 -38.554 18.210 1.00 0.00 C ATOM 3 C GLY A 1 -39.849 -37.888 17.050 1.00 0.00 C ATOM 4 O GLY A 1 -40.356 -37.871 15.928 1.00 0.00 O ATOM 0 H1 GLY A 1 -42.600 -38.667 18.384 1.00 0.00 H new ATOM 0 H2 GLY A 1 -42.012 -38.939 16.815 1.00 0.00 H new ATOM 0 H3 GLY A 1 -41.844 -40.139 18.004 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -40.711 -37.826 19.007 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -39.930 -39.345 18.615 1.00 0.00 H new ATOM 8 N SER A 2 -38.670 -37.337 17.320 1.00 0.00 N ATOM 9 CA SER A 2 -37.888 -36.662 16.290 1.00 0.00 C ATOM 10 C SER A 2 -36.608 -37.434 15.987 1.00 0.00 C ATOM 11 O SER A 2 -36.274 -38.399 16.674 1.00 0.00 O ATOM 12 CB SER A 2 -37.546 -35.238 16.732 1.00 0.00 C ATOM 13 OG SER A 2 -36.943 -35.232 18.014 1.00 0.00 O ATOM 0 H SER A 2 -38.235 -37.345 18.243 1.00 0.00 H new ATOM 0 HA SER A 2 -38.489 -36.619 15.382 1.00 0.00 H new ATOM 0 HB2 SER A 2 -36.872 -34.781 16.008 1.00 0.00 H new ATOM 0 HB3 SER A 2 -38.452 -34.632 16.750 1.00 0.00 H new ATOM 0 HG SER A 2 -36.733 -34.310 18.272 1.00 0.00 H new ATOM 19 N SER A 3 -35.894 -37.001 14.952 1.00 0.00 N ATOM 20 CA SER A 3 -34.652 -37.653 14.554 1.00 0.00 C ATOM 21 C SER A 3 -33.849 -36.762 13.612 1.00 0.00 C ATOM 22 O SER A 3 -34.382 -35.822 13.023 1.00 0.00 O ATOM 23 CB SER A 3 -34.948 -38.993 13.879 1.00 0.00 C ATOM 24 OG SER A 3 -35.336 -38.809 12.528 1.00 0.00 O ATOM 0 H SER A 3 -36.155 -36.202 14.374 1.00 0.00 H new ATOM 0 HA SER A 3 -34.060 -37.830 15.452 1.00 0.00 H new ATOM 0 HB2 SER A 3 -34.064 -39.629 13.923 1.00 0.00 H new ATOM 0 HB3 SER A 3 -35.740 -39.510 14.421 1.00 0.00 H new ATOM 0 HG SER A 3 -35.518 -39.680 12.118 1.00 0.00 H new ATOM 30 N GLY A 4 -32.561 -37.064 13.474 1.00 0.00 N ATOM 31 CA GLY A 4 -31.704 -36.282 12.603 1.00 0.00 C ATOM 32 C GLY A 4 -30.593 -37.110 11.988 1.00 0.00 C ATOM 33 O GLY A 4 -30.814 -38.245 11.568 1.00 0.00 O ATOM 0 H GLY A 4 -32.096 -37.837 13.950 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -32.305 -35.839 11.809 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -31.269 -35.459 13.170 1.00 0.00 H new ATOM 37 N SER A 5 -29.393 -36.539 11.933 1.00 0.00 N ATOM 38 CA SER A 5 -28.244 -37.229 11.360 1.00 0.00 C ATOM 39 C SER A 5 -26.939 -36.589 11.824 1.00 0.00 C ATOM 40 O SER A 5 -26.833 -35.366 11.916 1.00 0.00 O ATOM 41 CB SER A 5 -28.320 -37.210 9.832 1.00 0.00 C ATOM 42 OG SER A 5 -27.197 -37.855 9.257 1.00 0.00 O ATOM 0 H SER A 5 -29.192 -35.601 12.278 1.00 0.00 H new ATOM 0 HA SER A 5 -28.264 -38.263 11.704 1.00 0.00 H new ATOM 0 HB2 SER A 5 -29.234 -37.704 9.504 1.00 0.00 H new ATOM 0 HB3 SER A 5 -28.371 -36.180 9.480 1.00 0.00 H new ATOM 0 HG SER A 5 -27.271 -37.831 8.280 1.00 0.00 H new ATOM 48 N SER A 6 -25.948 -37.425 12.115 1.00 0.00 N ATOM 49 CA SER A 6 -24.650 -36.942 12.573 1.00 0.00 C ATOM 50 C SER A 6 -23.553 -37.957 12.264 1.00 0.00 C ATOM 51 O SER A 6 -23.564 -39.075 12.777 1.00 0.00 O ATOM 52 CB SER A 6 -24.689 -36.658 14.075 1.00 0.00 C ATOM 53 OG SER A 6 -23.768 -35.640 14.426 1.00 0.00 O ATOM 0 H SER A 6 -26.019 -38.440 12.042 1.00 0.00 H new ATOM 0 HA SER A 6 -24.426 -36.017 12.041 1.00 0.00 H new ATOM 0 HB2 SER A 6 -25.696 -36.358 14.365 1.00 0.00 H new ATOM 0 HB3 SER A 6 -24.457 -37.569 14.627 1.00 0.00 H new ATOM 0 HG SER A 6 -23.814 -35.476 15.391 1.00 0.00 H new ATOM 59 N GLY A 7 -22.606 -37.556 11.421 1.00 0.00 N ATOM 60 CA GLY A 7 -21.515 -38.441 11.057 1.00 0.00 C ATOM 61 C GLY A 7 -20.511 -37.775 10.137 1.00 0.00 C ATOM 62 O GLY A 7 -20.824 -37.461 8.988 1.00 0.00 O ATOM 0 H GLY A 7 -22.575 -36.635 10.984 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -21.007 -38.778 11.961 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -21.918 -39.328 10.569 1.00 0.00 H new ATOM 66 N ASP A 8 -19.301 -37.558 10.641 1.00 0.00 N ATOM 67 CA ASP A 8 -18.248 -36.925 9.857 1.00 0.00 C ATOM 68 C ASP A 8 -16.870 -37.323 10.376 1.00 0.00 C ATOM 69 O ASP A 8 -16.729 -37.776 11.512 1.00 0.00 O ATOM 70 CB ASP A 8 -18.400 -35.403 9.894 1.00 0.00 C ATOM 71 CG ASP A 8 -17.259 -34.690 9.195 1.00 0.00 C ATOM 72 OD1 ASP A 8 -16.917 -35.088 8.062 1.00 0.00 O ATOM 73 OD2 ASP A 8 -16.708 -33.735 9.781 1.00 0.00 O ATOM 0 H ASP A 8 -19.025 -37.812 11.590 1.00 0.00 H new ATOM 0 HA ASP A 8 -18.341 -37.267 8.826 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -19.342 -35.123 9.423 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -18.451 -35.071 10.931 1.00 0.00 H new ATOM 78 N LYS A 9 -15.855 -37.153 9.535 1.00 0.00 N ATOM 79 CA LYS A 9 -14.487 -37.494 9.908 1.00 0.00 C ATOM 80 C LYS A 9 -13.607 -36.249 9.945 1.00 0.00 C ATOM 81 O LYS A 9 -13.429 -35.572 8.932 1.00 0.00 O ATOM 82 CB LYS A 9 -13.907 -38.512 8.923 1.00 0.00 C ATOM 83 CG LYS A 9 -14.648 -39.838 8.912 1.00 0.00 C ATOM 84 CD LYS A 9 -14.323 -40.668 10.142 1.00 0.00 C ATOM 85 CE LYS A 9 -12.992 -41.389 9.992 1.00 0.00 C ATOM 86 NZ LYS A 9 -13.152 -42.717 9.337 1.00 0.00 N ATOM 0 H LYS A 9 -15.954 -36.781 8.590 1.00 0.00 H new ATOM 0 HA LYS A 9 -14.507 -37.933 10.905 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -13.926 -38.086 7.920 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -12.861 -38.692 9.173 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -15.722 -39.656 8.868 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -14.383 -40.397 8.014 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -14.292 -40.023 11.020 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -15.116 -41.397 10.310 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -12.310 -40.774 9.405 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -12.537 -41.521 10.974 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -12.223 -43.177 9.253 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -13.783 -43.313 9.910 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -13.562 -42.590 8.390 1.00 0.00 H new ATOM 100 N ILE A 10 -13.057 -35.953 11.118 1.00 0.00 N ATOM 101 CA ILE A 10 -12.193 -34.791 11.286 1.00 0.00 C ATOM 102 C ILE A 10 -10.723 -35.196 11.293 1.00 0.00 C ATOM 103 O ILE A 10 -9.906 -34.613 10.582 1.00 0.00 O ATOM 104 CB ILE A 10 -12.513 -34.036 12.589 1.00 0.00 C ATOM 105 CG1 ILE A 10 -13.972 -33.575 12.593 1.00 0.00 C ATOM 106 CG2 ILE A 10 -11.576 -32.848 12.756 1.00 0.00 C ATOM 107 CD1 ILE A 10 -14.535 -33.362 13.980 1.00 0.00 C ATOM 0 H ILE A 10 -13.195 -36.502 11.966 1.00 0.00 H new ATOM 0 HA ILE A 10 -12.381 -34.132 10.439 1.00 0.00 H new ATOM 0 HB ILE A 10 -12.364 -34.713 13.430 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -14.052 -32.645 12.031 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -14.580 -34.315 12.073 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -11.814 -32.324 13.682 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -10.545 -33.200 12.793 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -11.697 -32.168 11.913 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -15.572 -33.036 13.905 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -14.487 -34.296 14.539 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -13.952 -32.600 14.496 1.00 0.00 H new ATOM 119 N GLU A 11 -10.395 -36.199 12.101 1.00 0.00 N ATOM 120 CA GLU A 11 -9.022 -36.682 12.200 1.00 0.00 C ATOM 121 C GLU A 11 -8.589 -37.359 10.903 1.00 0.00 C ATOM 122 O GLU A 11 -9.390 -37.537 9.985 1.00 0.00 O ATOM 123 CB GLU A 11 -8.885 -37.660 13.369 1.00 0.00 C ATOM 124 CG GLU A 11 -9.780 -38.882 13.249 1.00 0.00 C ATOM 125 CD GLU A 11 -9.707 -39.781 14.467 1.00 0.00 C ATOM 126 OE1 GLU A 11 -10.106 -39.330 15.561 1.00 0.00 O ATOM 127 OE2 GLU A 11 -9.250 -40.935 14.327 1.00 0.00 O ATOM 0 H GLU A 11 -11.060 -36.693 12.696 1.00 0.00 H new ATOM 0 HA GLU A 11 -8.374 -35.824 12.376 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -7.847 -37.986 13.439 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -9.119 -37.139 14.297 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -10.811 -38.560 13.102 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -9.494 -39.451 12.364 1.00 0.00 H new ATOM 134 N SER A 12 -7.316 -37.734 10.834 1.00 0.00 N ATOM 135 CA SER A 12 -6.774 -38.387 9.648 1.00 0.00 C ATOM 136 C SER A 12 -6.622 -37.392 8.502 1.00 0.00 C ATOM 137 O SER A 12 -6.906 -37.710 7.347 1.00 0.00 O ATOM 138 CB SER A 12 -7.678 -39.544 9.219 1.00 0.00 C ATOM 139 OG SER A 12 -6.966 -40.483 8.433 1.00 0.00 O ATOM 0 H SER A 12 -6.640 -37.597 11.586 1.00 0.00 H new ATOM 0 HA SER A 12 -5.788 -38.780 9.898 1.00 0.00 H new ATOM 0 HB2 SER A 12 -8.085 -40.038 10.101 1.00 0.00 H new ATOM 0 HB3 SER A 12 -8.524 -39.157 8.651 1.00 0.00 H new ATOM 0 HG SER A 12 -6.577 -40.031 7.656 1.00 0.00 H new ATOM 145 N LYS A 13 -6.173 -36.185 8.829 1.00 0.00 N ATOM 146 CA LYS A 13 -5.981 -35.142 7.829 1.00 0.00 C ATOM 147 C LYS A 13 -4.497 -34.902 7.570 1.00 0.00 C ATOM 148 O LYS A 13 -4.001 -33.787 7.732 1.00 0.00 O ATOM 149 CB LYS A 13 -6.647 -33.842 8.284 1.00 0.00 C ATOM 150 CG LYS A 13 -8.127 -33.766 7.948 1.00 0.00 C ATOM 151 CD LYS A 13 -8.774 -32.534 8.558 1.00 0.00 C ATOM 152 CE LYS A 13 -8.324 -31.262 7.856 1.00 0.00 C ATOM 153 NZ LYS A 13 -8.878 -31.164 6.477 1.00 0.00 N ATOM 0 H LYS A 13 -5.935 -35.905 9.780 1.00 0.00 H new ATOM 0 HA LYS A 13 -6.444 -35.475 6.900 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -6.522 -33.738 9.362 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -6.134 -32.999 7.820 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -8.255 -33.747 6.866 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -8.630 -34.661 8.313 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -9.859 -32.622 8.494 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -8.521 -32.475 9.617 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -8.640 -30.395 8.437 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -7.235 -31.237 7.813 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -8.752 -30.195 6.120 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -8.378 -31.830 5.854 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -9.891 -31.398 6.492 1.00 0.00 H new ATOM 167 N LEU A 14 -3.794 -35.955 7.166 1.00 0.00 N ATOM 168 CA LEU A 14 -2.366 -35.858 6.882 1.00 0.00 C ATOM 169 C LEU A 14 -2.123 -35.550 5.408 1.00 0.00 C ATOM 170 O LEU A 14 -2.393 -36.378 4.537 1.00 0.00 O ATOM 171 CB LEU A 14 -1.661 -37.160 7.267 1.00 0.00 C ATOM 172 CG LEU A 14 -1.310 -37.321 8.746 1.00 0.00 C ATOM 173 CD1 LEU A 14 -0.822 -38.734 9.027 1.00 0.00 C ATOM 174 CD2 LEU A 14 -0.260 -36.300 9.159 1.00 0.00 C ATOM 0 H LEU A 14 -4.189 -36.885 7.028 1.00 0.00 H new ATOM 0 HA LEU A 14 -1.957 -35.041 7.476 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -2.297 -37.995 6.972 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -0.742 -37.238 6.686 1.00 0.00 H new ATOM 0 HG LEU A 14 -2.210 -37.145 9.335 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -0.577 -38.831 10.085 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -1.605 -39.447 8.770 1.00 0.00 H new ATOM 0 HD13 LEU A 14 0.066 -38.938 8.428 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -0.022 -36.429 10.215 1.00 0.00 H new ATOM 0 HD22 LEU A 14 0.642 -36.444 8.564 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -0.646 -35.294 8.995 1.00 0.00 H new ATOM 186 N LEU A 15 -1.610 -34.356 5.136 1.00 0.00 N ATOM 187 CA LEU A 15 -1.328 -33.939 3.766 1.00 0.00 C ATOM 188 C LEU A 15 -0.563 -32.619 3.746 1.00 0.00 C ATOM 189 O LEU A 15 -0.868 -31.702 4.507 1.00 0.00 O ATOM 190 CB LEU A 15 -2.630 -33.799 2.976 1.00 0.00 C ATOM 191 CG LEU A 15 -3.438 -32.527 3.233 1.00 0.00 C ATOM 192 CD1 LEU A 15 -4.350 -32.227 2.054 1.00 0.00 C ATOM 193 CD2 LEU A 15 -4.248 -32.660 4.515 1.00 0.00 C ATOM 0 H LEU A 15 -1.381 -33.659 5.845 1.00 0.00 H new ATOM 0 HA LEU A 15 -0.708 -34.705 3.299 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -2.393 -33.846 1.913 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -3.262 -34.658 3.201 1.00 0.00 H new ATOM 0 HG LEU A 15 -2.743 -31.695 3.350 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -4.917 -31.318 2.255 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -3.749 -32.088 1.155 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -5.038 -33.059 1.906 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -4.817 -31.745 4.682 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -4.933 -33.503 4.426 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -3.574 -32.827 5.355 1.00 0.00 H new ATOM 205 N ALA A 16 0.430 -32.530 2.867 1.00 0.00 N ATOM 206 CA ALA A 16 1.235 -31.321 2.744 1.00 0.00 C ATOM 207 C ALA A 16 0.993 -30.635 1.404 1.00 0.00 C ATOM 208 O ALA A 16 1.688 -30.902 0.423 1.00 0.00 O ATOM 209 CB ALA A 16 2.711 -31.651 2.912 1.00 0.00 C ATOM 0 H ALA A 16 0.696 -33.281 2.230 1.00 0.00 H new ATOM 0 HA ALA A 16 0.936 -30.632 3.534 1.00 0.00 H new ATOM 0 HB1 ALA A 16 3.301 -30.739 2.818 1.00 0.00 H new ATOM 0 HB2 ALA A 16 2.876 -32.090 3.896 1.00 0.00 H new ATOM 0 HB3 ALA A 16 3.015 -32.361 2.143 1.00 0.00 H new ATOM 215 N LYS A 17 0.004 -29.748 1.369 1.00 0.00 N ATOM 216 CA LYS A 17 -0.330 -29.022 0.150 1.00 0.00 C ATOM 217 C LYS A 17 -0.668 -27.567 0.458 1.00 0.00 C ATOM 218 O LYS A 17 -1.677 -27.276 1.100 1.00 0.00 O ATOM 219 CB LYS A 17 -1.509 -29.691 -0.560 1.00 0.00 C ATOM 220 CG LYS A 17 -1.195 -31.082 -1.084 1.00 0.00 C ATOM 221 CD LYS A 17 -0.269 -31.028 -2.287 1.00 0.00 C ATOM 222 CE LYS A 17 -0.204 -32.370 -3.000 1.00 0.00 C ATOM 223 NZ LYS A 17 0.637 -33.352 -2.261 1.00 0.00 N ATOM 0 H LYS A 17 -0.580 -29.515 2.172 1.00 0.00 H new ATOM 0 HA LYS A 17 0.541 -29.043 -0.505 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -2.350 -29.754 0.131 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -1.826 -29.062 -1.392 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -0.733 -31.674 -0.294 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -2.121 -31.586 -1.359 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -0.616 -30.262 -2.981 1.00 0.00 H new ATOM 0 HD3 LYS A 17 0.731 -30.737 -1.965 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -1.212 -32.769 -3.115 1.00 0.00 H new ATOM 0 HE3 LYS A 17 0.199 -32.229 -4.003 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 0.655 -34.253 -2.780 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 1.605 -32.983 -2.173 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 0.238 -33.507 -1.313 1.00 0.00 H new ATOM 237 N LYS A 18 0.182 -26.656 -0.004 1.00 0.00 N ATOM 238 CA LYS A 18 -0.027 -25.231 0.220 1.00 0.00 C ATOM 239 C LYS A 18 0.410 -24.420 -0.996 1.00 0.00 C ATOM 240 O LYS A 18 1.571 -24.464 -1.400 1.00 0.00 O ATOM 241 CB LYS A 18 0.746 -24.769 1.458 1.00 0.00 C ATOM 242 CG LYS A 18 0.001 -25.001 2.761 1.00 0.00 C ATOM 243 CD LYS A 18 -0.868 -23.810 3.126 1.00 0.00 C ATOM 244 CE LYS A 18 -2.262 -23.933 2.530 1.00 0.00 C ATOM 245 NZ LYS A 18 -2.343 -23.318 1.176 1.00 0.00 N ATOM 0 H LYS A 18 1.023 -26.880 -0.536 1.00 0.00 H new ATOM 0 HA LYS A 18 -1.092 -25.067 0.382 1.00 0.00 H new ATOM 0 HB2 LYS A 18 1.701 -25.293 1.497 1.00 0.00 H new ATOM 0 HB3 LYS A 18 0.970 -23.707 1.361 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -0.620 -25.892 2.672 1.00 0.00 H new ATOM 0 HG3 LYS A 18 0.716 -25.190 3.562 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -0.941 -23.730 4.211 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -0.399 -22.893 2.770 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -2.539 -24.985 2.468 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -2.983 -23.452 3.191 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -2.919 -22.453 1.221 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -1.386 -23.079 0.845 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -2.780 -23.991 0.515 1.00 0.00 H new ATOM 259 N ALA A 19 -0.529 -23.678 -1.575 1.00 0.00 N ATOM 260 CA ALA A 19 -0.240 -22.854 -2.742 1.00 0.00 C ATOM 261 C ALA A 19 -0.448 -21.375 -2.435 1.00 0.00 C ATOM 262 O ALA A 19 -1.573 -20.931 -2.208 1.00 0.00 O ATOM 263 CB ALA A 19 -1.110 -23.278 -3.916 1.00 0.00 C ATOM 0 H ALA A 19 -1.496 -23.631 -1.255 1.00 0.00 H new ATOM 0 HA ALA A 19 0.807 -22.999 -3.008 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -0.884 -22.654 -4.781 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -0.910 -24.322 -4.159 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -2.161 -23.162 -3.651 1.00 0.00 H new ATOM 269 N GLU A 20 0.645 -20.617 -2.429 1.00 0.00 N ATOM 270 CA GLU A 20 0.581 -19.188 -2.148 1.00 0.00 C ATOM 271 C GLU A 20 0.658 -18.376 -3.438 1.00 0.00 C ATOM 272 O GLU A 20 1.322 -18.773 -4.396 1.00 0.00 O ATOM 273 CB GLU A 20 1.716 -18.780 -1.207 1.00 0.00 C ATOM 274 CG GLU A 20 1.698 -17.306 -0.835 1.00 0.00 C ATOM 275 CD GLU A 20 2.907 -16.896 -0.017 1.00 0.00 C ATOM 276 OE1 GLU A 20 3.251 -17.622 0.939 1.00 0.00 O ATOM 277 OE2 GLU A 20 3.509 -15.849 -0.334 1.00 0.00 O ATOM 0 H GLU A 20 1.584 -20.969 -2.615 1.00 0.00 H new ATOM 0 HA GLU A 20 -0.374 -18.981 -1.665 1.00 0.00 H new ATOM 0 HB2 GLU A 20 1.654 -19.377 -0.297 1.00 0.00 H new ATOM 0 HB3 GLU A 20 2.670 -19.016 -1.679 1.00 0.00 H new ATOM 0 HG2 GLU A 20 1.659 -16.706 -1.744 1.00 0.00 H new ATOM 0 HG3 GLU A 20 0.791 -17.089 -0.270 1.00 0.00 H new ATOM 284 N VAL A 21 -0.026 -17.236 -3.455 1.00 0.00 N ATOM 285 CA VAL A 21 -0.035 -16.367 -4.625 1.00 0.00 C ATOM 286 C VAL A 21 1.022 -15.276 -4.508 1.00 0.00 C ATOM 287 O VAL A 21 1.479 -14.955 -3.411 1.00 0.00 O ATOM 288 CB VAL A 21 -1.414 -15.711 -4.826 1.00 0.00 C ATOM 289 CG1 VAL A 21 -1.694 -14.706 -3.720 1.00 0.00 C ATOM 290 CG2 VAL A 21 -1.494 -15.048 -6.193 1.00 0.00 C ATOM 0 H VAL A 21 -0.581 -16.893 -2.671 1.00 0.00 H new ATOM 0 HA VAL A 21 0.190 -16.995 -5.487 1.00 0.00 H new ATOM 0 HB VAL A 21 -2.177 -16.488 -4.779 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -2.673 -14.253 -3.879 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -1.682 -15.214 -2.755 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -0.929 -13.930 -3.731 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -2.475 -14.590 -6.318 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -0.723 -14.282 -6.271 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -1.342 -15.797 -6.970 1.00 0.00 H new ATOM 300 N ASN A 22 1.408 -14.707 -5.646 1.00 0.00 N ATOM 301 CA ASN A 22 2.413 -13.651 -5.671 1.00 0.00 C ATOM 302 C ASN A 22 2.170 -12.643 -4.552 1.00 0.00 C ATOM 303 O ASN A 22 1.029 -12.390 -4.164 1.00 0.00 O ATOM 304 CB ASN A 22 2.400 -12.939 -7.025 1.00 0.00 C ATOM 305 CG ASN A 22 2.977 -13.797 -8.135 1.00 0.00 C ATOM 306 OD1 ASN A 22 4.190 -13.831 -8.341 1.00 0.00 O ATOM 307 ND2 ASN A 22 2.107 -14.495 -8.855 1.00 0.00 N ATOM 0 H ASN A 22 1.040 -14.960 -6.563 1.00 0.00 H new ATOM 0 HA ASN A 22 3.390 -14.109 -5.518 1.00 0.00 H new ATOM 0 HB2 ASN A 22 1.376 -12.663 -7.278 1.00 0.00 H new ATOM 0 HB3 ASN A 22 2.971 -12.013 -6.951 1.00 0.00 H new ATOM 0 HD21 ASN A 22 2.436 -15.091 -9.615 1.00 0.00 H new ATOM 0 HD22 ASN A 22 1.110 -14.436 -8.648 1.00 0.00 H new ATOM 314 N THR A 23 3.252 -12.068 -4.035 1.00 0.00 N ATOM 315 CA THR A 23 3.158 -11.089 -2.960 1.00 0.00 C ATOM 316 C THR A 23 3.722 -9.740 -3.394 1.00 0.00 C ATOM 317 O THR A 23 4.503 -9.660 -4.342 1.00 0.00 O ATOM 318 CB THR A 23 3.906 -11.563 -1.700 1.00 0.00 C ATOM 319 OG1 THR A 23 5.229 -11.986 -2.046 1.00 0.00 O ATOM 320 CG2 THR A 23 3.162 -12.708 -1.028 1.00 0.00 C ATOM 0 H THR A 23 4.204 -12.264 -4.344 1.00 0.00 H new ATOM 0 HA THR A 23 2.099 -10.979 -2.725 1.00 0.00 H new ATOM 0 HB THR A 23 3.963 -10.728 -1.002 1.00 0.00 H new ATOM 0 HG1 THR A 23 5.866 -11.272 -1.836 1.00 0.00 H new ATOM 0 HG21 THR A 23 3.709 -13.026 -0.141 1.00 0.00 H new ATOM 0 HG22 THR A 23 2.165 -12.375 -0.740 1.00 0.00 H new ATOM 0 HG23 THR A 23 3.078 -13.544 -1.722 1.00 0.00 H new ATOM 328 N ILE A 24 3.321 -8.684 -2.695 1.00 0.00 N ATOM 329 CA ILE A 24 3.788 -7.339 -3.008 1.00 0.00 C ATOM 330 C ILE A 24 4.904 -6.911 -2.061 1.00 0.00 C ATOM 331 O ILE A 24 4.749 -6.911 -0.839 1.00 0.00 O ATOM 332 CB ILE A 24 2.643 -6.313 -2.932 1.00 0.00 C ATOM 333 CG1 ILE A 24 1.564 -6.643 -3.965 1.00 0.00 C ATOM 334 CG2 ILE A 24 3.177 -4.905 -3.147 1.00 0.00 C ATOM 335 CD1 ILE A 24 0.358 -5.733 -3.891 1.00 0.00 C ATOM 0 H ILE A 24 2.674 -8.734 -1.908 1.00 0.00 H new ATOM 0 HA ILE A 24 4.171 -7.367 -4.028 1.00 0.00 H new ATOM 0 HB ILE A 24 2.196 -6.363 -1.939 1.00 0.00 H new ATOM 0 HG12 ILE A 24 1.997 -6.579 -4.963 1.00 0.00 H new ATOM 0 HG13 ILE A 24 1.240 -7.674 -3.823 1.00 0.00 H new ATOM 0 HG21 ILE A 24 2.355 -4.191 -3.090 1.00 0.00 H new ATOM 0 HG22 ILE A 24 3.912 -4.673 -2.377 1.00 0.00 H new ATOM 0 HG23 ILE A 24 3.647 -4.840 -4.128 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -0.366 -6.025 -4.652 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -0.099 -5.815 -2.905 1.00 0.00 H new ATOM 0 HD13 ILE A 24 0.669 -4.702 -4.063 1.00 0.00 H new ATOM 347 N PRO A 25 6.056 -6.535 -2.635 1.00 0.00 N ATOM 348 CA PRO A 25 7.220 -6.094 -1.860 1.00 0.00 C ATOM 349 C PRO A 25 6.995 -4.740 -1.196 1.00 0.00 C ATOM 350 O PRO A 25 7.886 -4.206 -0.537 1.00 0.00 O ATOM 351 CB PRO A 25 8.329 -5.997 -2.910 1.00 0.00 C ATOM 352 CG PRO A 25 7.614 -5.767 -4.197 1.00 0.00 C ATOM 353 CD PRO A 25 6.311 -6.510 -4.085 1.00 0.00 C ATOM 0 HA PRO A 25 7.448 -6.777 -1.042 1.00 0.00 H new ATOM 0 HB2 PRO A 25 9.015 -5.180 -2.687 1.00 0.00 H new ATOM 0 HB3 PRO A 25 8.922 -6.911 -2.945 1.00 0.00 H new ATOM 0 HG2 PRO A 25 7.444 -4.703 -4.364 1.00 0.00 H new ATOM 0 HG3 PRO A 25 8.200 -6.132 -5.040 1.00 0.00 H new ATOM 0 HD2 PRO A 25 5.511 -6.003 -4.625 1.00 0.00 H new ATOM 0 HD3 PRO A 25 6.385 -7.516 -4.497 1.00 0.00 H new ATOM 361 N GLY A 26 5.798 -4.189 -1.375 1.00 0.00 N ATOM 362 CA GLY A 26 5.478 -2.902 -0.786 1.00 0.00 C ATOM 363 C GLY A 26 4.732 -1.995 -1.745 1.00 0.00 C ATOM 364 O GLY A 26 5.173 -1.776 -2.873 1.00 0.00 O ATOM 0 H GLY A 26 5.044 -4.611 -1.917 1.00 0.00 H new ATOM 0 HA2 GLY A 26 4.874 -3.055 0.108 1.00 0.00 H new ATOM 0 HA3 GLY A 26 6.399 -2.412 -0.469 1.00 0.00 H new ATOM 368 N PHE A 27 3.598 -1.468 -1.296 1.00 0.00 N ATOM 369 CA PHE A 27 2.787 -0.582 -2.124 1.00 0.00 C ATOM 370 C PHE A 27 2.786 0.837 -1.562 1.00 0.00 C ATOM 371 O PHE A 27 2.279 1.082 -0.467 1.00 0.00 O ATOM 372 CB PHE A 27 1.353 -1.107 -2.217 1.00 0.00 C ATOM 373 CG PHE A 27 0.413 -0.164 -2.911 1.00 0.00 C ATOM 374 CD1 PHE A 27 0.505 0.045 -4.278 1.00 0.00 C ATOM 375 CD2 PHE A 27 -0.563 0.513 -2.198 1.00 0.00 C ATOM 376 CE1 PHE A 27 -0.358 0.913 -4.920 1.00 0.00 C ATOM 377 CE2 PHE A 27 -1.429 1.382 -2.834 1.00 0.00 C ATOM 378 CZ PHE A 27 -1.327 1.582 -4.197 1.00 0.00 C ATOM 0 H PHE A 27 3.220 -1.639 -0.364 1.00 0.00 H new ATOM 0 HA PHE A 27 3.223 -0.558 -3.123 1.00 0.00 H new ATOM 0 HB2 PHE A 27 1.357 -2.059 -2.748 1.00 0.00 H new ATOM 0 HB3 PHE A 27 0.981 -1.304 -1.212 1.00 0.00 H new ATOM 0 HD1 PHE A 27 1.260 -0.476 -4.848 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -0.648 0.360 -1.132 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -0.275 1.068 -5.986 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -2.185 1.904 -2.266 1.00 0.00 H new ATOM 0 HZ PHE A 27 -2.003 2.260 -4.697 1.00 0.00 H new ATOM 388 N ASP A 28 3.358 1.767 -2.319 1.00 0.00 N ATOM 389 CA ASP A 28 3.423 3.161 -1.898 1.00 0.00 C ATOM 390 C ASP A 28 2.234 3.949 -2.440 1.00 0.00 C ATOM 391 O ASP A 28 1.736 4.867 -1.790 1.00 0.00 O ATOM 392 CB ASP A 28 4.731 3.798 -2.370 1.00 0.00 C ATOM 393 CG ASP A 28 4.919 3.689 -3.870 1.00 0.00 C ATOM 394 OD1 ASP A 28 4.646 2.604 -4.424 1.00 0.00 O ATOM 395 OD2 ASP A 28 5.340 4.688 -4.490 1.00 0.00 O ATOM 0 H ASP A 28 3.783 1.580 -3.227 1.00 0.00 H new ATOM 0 HA ASP A 28 3.387 3.188 -0.809 1.00 0.00 H new ATOM 0 HB2 ASP A 28 4.745 4.849 -2.080 1.00 0.00 H new ATOM 0 HB3 ASP A 28 5.569 3.317 -1.866 1.00 0.00 H new ATOM 400 N GLY A 29 1.784 3.582 -3.636 1.00 0.00 N ATOM 401 CA GLY A 29 0.658 4.265 -4.246 1.00 0.00 C ATOM 402 C GLY A 29 -0.365 4.722 -3.226 1.00 0.00 C ATOM 403 O GLY A 29 -1.124 3.913 -2.691 1.00 0.00 O ATOM 0 H GLY A 29 2.179 2.824 -4.193 1.00 0.00 H new ATOM 0 HA2 GLY A 29 1.020 5.128 -4.805 1.00 0.00 H new ATOM 0 HA3 GLY A 29 0.179 3.599 -4.964 1.00 0.00 H new ATOM 407 N VAL A 30 -0.386 6.023 -2.952 1.00 0.00 N ATOM 408 CA VAL A 30 -1.323 6.587 -1.988 1.00 0.00 C ATOM 409 C VAL A 30 -2.759 6.211 -2.334 1.00 0.00 C ATOM 410 O VAL A 30 -3.168 6.278 -3.493 1.00 0.00 O ATOM 411 CB VAL A 30 -1.207 8.121 -1.924 1.00 0.00 C ATOM 412 CG1 VAL A 30 -1.307 8.724 -3.317 1.00 0.00 C ATOM 413 CG2 VAL A 30 -2.274 8.698 -1.006 1.00 0.00 C ATOM 0 H VAL A 30 0.236 6.706 -3.385 1.00 0.00 H new ATOM 0 HA VAL A 30 -1.065 6.170 -1.014 1.00 0.00 H new ATOM 0 HB VAL A 30 -0.230 8.377 -1.514 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -1.223 9.809 -3.251 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -0.502 8.335 -3.941 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -2.268 8.461 -3.759 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -2.177 9.783 -0.973 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -3.261 8.433 -1.384 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -2.149 8.292 -0.002 1.00 0.00 H new ATOM 423 N VAL A 31 -3.522 5.816 -1.319 1.00 0.00 N ATOM 424 CA VAL A 31 -4.915 5.431 -1.515 1.00 0.00 C ATOM 425 C VAL A 31 -5.795 6.653 -1.752 1.00 0.00 C ATOM 426 O VAL A 31 -5.534 7.733 -1.221 1.00 0.00 O ATOM 427 CB VAL A 31 -5.456 4.649 -0.303 1.00 0.00 C ATOM 428 CG1 VAL A 31 -6.819 4.051 -0.619 1.00 0.00 C ATOM 429 CG2 VAL A 31 -4.473 3.566 0.114 1.00 0.00 C ATOM 0 H VAL A 31 -3.199 5.754 -0.353 1.00 0.00 H new ATOM 0 HA VAL A 31 -4.946 4.789 -2.396 1.00 0.00 H new ATOM 0 HB VAL A 31 -5.574 5.341 0.531 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -7.186 3.502 0.249 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -7.519 4.850 -0.865 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -6.731 3.372 -1.467 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -4.871 3.024 0.971 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -4.321 2.874 -0.714 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -3.521 4.023 0.384 1.00 0.00 H new ATOM 439 N LYS A 32 -6.841 6.476 -2.553 1.00 0.00 N ATOM 440 CA LYS A 32 -7.762 7.563 -2.860 1.00 0.00 C ATOM 441 C LYS A 32 -8.995 7.501 -1.964 1.00 0.00 C ATOM 442 O LYS A 32 -9.499 8.529 -1.513 1.00 0.00 O ATOM 443 CB LYS A 32 -8.183 7.502 -4.330 1.00 0.00 C ATOM 444 CG LYS A 32 -7.016 7.554 -5.300 1.00 0.00 C ATOM 445 CD LYS A 32 -6.708 8.980 -5.726 1.00 0.00 C ATOM 446 CE LYS A 32 -6.095 9.782 -4.589 1.00 0.00 C ATOM 447 NZ LYS A 32 -7.132 10.495 -3.792 1.00 0.00 N ATOM 0 H LYS A 32 -7.071 5.589 -3.001 1.00 0.00 H new ATOM 0 HA LYS A 32 -7.247 8.506 -2.675 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -8.745 6.584 -4.500 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -8.857 8.332 -4.541 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -6.134 7.114 -4.834 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -7.245 6.952 -6.179 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -6.023 8.967 -6.574 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -7.624 9.466 -6.063 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -5.531 9.115 -3.937 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -5.388 10.505 -4.995 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -6.975 10.316 -2.780 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -7.070 11.517 -3.977 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -8.075 10.150 -4.062 1.00 0.00 H new ATOM 461 N ASP A 33 -9.475 6.288 -1.709 1.00 0.00 N ATOM 462 CA ASP A 33 -10.647 6.092 -0.865 1.00 0.00 C ATOM 463 C ASP A 33 -10.581 4.747 -0.147 1.00 0.00 C ATOM 464 O ASP A 33 -9.698 3.933 -0.415 1.00 0.00 O ATOM 465 CB ASP A 33 -11.925 6.175 -1.701 1.00 0.00 C ATOM 466 CG ASP A 33 -12.416 7.600 -1.868 1.00 0.00 C ATOM 467 OD1 ASP A 33 -11.694 8.408 -2.488 1.00 0.00 O ATOM 468 OD2 ASP A 33 -13.523 7.906 -1.378 1.00 0.00 O ATOM 0 H ASP A 33 -9.070 5.426 -2.075 1.00 0.00 H new ATOM 0 HA ASP A 33 -10.660 6.884 -0.116 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -11.742 5.739 -2.683 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -12.705 5.578 -1.228 1.00 0.00 H new ATOM 473 N ALA A 34 -11.521 4.522 0.765 1.00 0.00 N ATOM 474 CA ALA A 34 -11.570 3.277 1.520 1.00 0.00 C ATOM 475 C ALA A 34 -11.677 2.074 0.589 1.00 0.00 C ATOM 476 O ALA A 34 -10.946 1.095 0.739 1.00 0.00 O ATOM 477 CB ALA A 34 -12.737 3.296 2.496 1.00 0.00 C ATOM 0 H ALA A 34 -12.259 5.186 0.999 1.00 0.00 H new ATOM 0 HA ALA A 34 -10.641 3.187 2.083 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -12.761 2.359 3.053 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -12.617 4.128 3.190 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -13.670 3.414 1.945 1.00 0.00 H new ATOM 483 N GLU A 35 -12.592 2.155 -0.372 1.00 0.00 N ATOM 484 CA GLU A 35 -12.794 1.071 -1.326 1.00 0.00 C ATOM 485 C GLU A 35 -11.475 0.669 -1.980 1.00 0.00 C ATOM 486 O GLU A 35 -11.090 -0.500 -1.956 1.00 0.00 O ATOM 487 CB GLU A 35 -13.801 1.488 -2.400 1.00 0.00 C ATOM 488 CG GLU A 35 -13.440 2.786 -3.102 1.00 0.00 C ATOM 489 CD GLU A 35 -14.593 3.355 -3.905 1.00 0.00 C ATOM 490 OE1 GLU A 35 -15.701 3.486 -3.344 1.00 0.00 O ATOM 491 OE2 GLU A 35 -14.387 3.670 -5.096 1.00 0.00 O ATOM 0 H GLU A 35 -13.204 2.959 -0.510 1.00 0.00 H new ATOM 0 HA GLU A 35 -13.187 0.212 -0.783 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -13.878 0.693 -3.142 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -14.785 1.594 -1.942 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -13.122 3.519 -2.361 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -12.592 2.613 -3.764 1.00 0.00 H new ATOM 498 N GLU A 36 -10.788 1.646 -2.564 1.00 0.00 N ATOM 499 CA GLU A 36 -9.514 1.393 -3.225 1.00 0.00 C ATOM 500 C GLU A 36 -8.504 0.795 -2.250 1.00 0.00 C ATOM 501 O GLU A 36 -7.639 0.011 -2.639 1.00 0.00 O ATOM 502 CB GLU A 36 -8.958 2.688 -3.822 1.00 0.00 C ATOM 503 CG GLU A 36 -7.665 2.495 -4.597 1.00 0.00 C ATOM 504 CD GLU A 36 -7.904 2.107 -6.043 1.00 0.00 C ATOM 505 OE1 GLU A 36 -8.647 2.833 -6.736 1.00 0.00 O ATOM 506 OE2 GLU A 36 -7.348 1.078 -6.482 1.00 0.00 O ATOM 0 H GLU A 36 -11.093 2.619 -2.593 1.00 0.00 H new ATOM 0 HA GLU A 36 -9.687 0.676 -4.027 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -9.707 3.124 -4.484 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -8.787 3.404 -3.019 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -7.085 3.417 -4.563 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -7.067 1.724 -4.112 1.00 0.00 H new ATOM 513 N ALA A 37 -8.620 1.172 -0.981 1.00 0.00 N ATOM 514 CA ALA A 37 -7.720 0.673 0.051 1.00 0.00 C ATOM 515 C ALA A 37 -7.935 -0.817 0.293 1.00 0.00 C ATOM 516 O ALA A 37 -6.998 -1.543 0.626 1.00 0.00 O ATOM 517 CB ALA A 37 -7.913 1.454 1.342 1.00 0.00 C ATOM 0 H ALA A 37 -9.329 1.822 -0.643 1.00 0.00 H new ATOM 0 HA ALA A 37 -6.696 0.813 -0.295 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -7.234 1.071 2.104 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -7.701 2.508 1.165 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -8.942 1.343 1.684 1.00 0.00 H new ATOM 523 N VAL A 38 -9.174 -1.266 0.124 1.00 0.00 N ATOM 524 CA VAL A 38 -9.512 -2.670 0.325 1.00 0.00 C ATOM 525 C VAL A 38 -8.967 -3.534 -0.807 1.00 0.00 C ATOM 526 O VAL A 38 -8.342 -4.567 -0.568 1.00 0.00 O ATOM 527 CB VAL A 38 -11.036 -2.873 0.422 1.00 0.00 C ATOM 528 CG1 VAL A 38 -11.376 -4.354 0.468 1.00 0.00 C ATOM 529 CG2 VAL A 38 -11.592 -2.151 1.639 1.00 0.00 C ATOM 0 H VAL A 38 -9.961 -0.678 -0.152 1.00 0.00 H new ATOM 0 HA VAL A 38 -9.052 -2.974 1.265 1.00 0.00 H new ATOM 0 HB VAL A 38 -11.500 -2.447 -0.468 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -12.457 -4.477 0.536 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -11.012 -4.839 -0.438 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -10.903 -4.809 1.338 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -12.670 -2.305 1.692 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -11.124 -2.545 2.541 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -11.381 -1.085 1.557 1.00 0.00 H new ATOM 539 N ARG A 39 -9.206 -3.102 -2.041 1.00 0.00 N ATOM 540 CA ARG A 39 -8.740 -3.836 -3.212 1.00 0.00 C ATOM 541 C ARG A 39 -7.222 -3.995 -3.184 1.00 0.00 C ATOM 542 O ARG A 39 -6.703 -5.108 -3.269 1.00 0.00 O ATOM 543 CB ARG A 39 -9.165 -3.118 -4.493 1.00 0.00 C ATOM 544 CG ARG A 39 -10.668 -3.123 -4.725 1.00 0.00 C ATOM 545 CD ARG A 39 -11.084 -2.041 -5.708 1.00 0.00 C ATOM 546 NE ARG A 39 -12.531 -2.008 -5.906 1.00 0.00 N ATOM 547 CZ ARG A 39 -13.147 -1.120 -6.678 1.00 0.00 C ATOM 548 NH1 ARG A 39 -12.446 -0.197 -7.322 1.00 0.00 N ATOM 549 NH2 ARG A 39 -14.467 -1.155 -6.808 1.00 0.00 N ATOM 0 H ARG A 39 -9.720 -2.247 -2.256 1.00 0.00 H new ATOM 0 HA ARG A 39 -9.193 -4.827 -3.193 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -8.815 -2.086 -4.454 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -8.673 -3.589 -5.344 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -10.975 -4.098 -5.104 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -11.184 -2.972 -3.777 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -10.746 -1.071 -5.344 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -10.591 -2.212 -6.665 1.00 0.00 H new ATOM 0 HE ARG A 39 -13.099 -2.705 -5.425 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -11.431 -0.168 -7.225 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -12.922 0.484 -7.914 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -15.009 -1.864 -6.315 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -14.939 -0.473 -7.401 1.00 0.00 H new ATOM 563 N ILE A 40 -6.518 -2.874 -3.067 1.00 0.00 N ATOM 564 CA ILE A 40 -5.061 -2.890 -3.028 1.00 0.00 C ATOM 565 C ILE A 40 -4.550 -3.792 -1.910 1.00 0.00 C ATOM 566 O ILE A 40 -3.745 -4.693 -2.144 1.00 0.00 O ATOM 567 CB ILE A 40 -4.488 -1.473 -2.833 1.00 0.00 C ATOM 568 CG1 ILE A 40 -4.960 -0.549 -3.957 1.00 0.00 C ATOM 569 CG2 ILE A 40 -2.968 -1.519 -2.780 1.00 0.00 C ATOM 570 CD1 ILE A 40 -4.777 0.920 -3.647 1.00 0.00 C ATOM 0 H ILE A 40 -6.932 -1.945 -2.998 1.00 0.00 H new ATOM 0 HA ILE A 40 -4.724 -3.281 -3.988 1.00 0.00 H new ATOM 0 HB ILE A 40 -4.853 -1.077 -1.886 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -4.414 -0.791 -4.869 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -6.014 -0.742 -4.156 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -2.578 -0.511 -2.642 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -2.652 -2.147 -1.947 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -2.584 -1.932 -3.713 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -5.133 1.516 -4.487 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -5.346 1.177 -2.753 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -3.720 1.127 -3.477 1.00 0.00 H new ATOM 582 N ALA A 41 -5.024 -3.543 -0.694 1.00 0.00 N ATOM 583 CA ALA A 41 -4.619 -4.335 0.461 1.00 0.00 C ATOM 584 C ALA A 41 -4.777 -5.827 0.186 1.00 0.00 C ATOM 585 O ALA A 41 -3.885 -6.621 0.486 1.00 0.00 O ATOM 586 CB ALA A 41 -5.426 -3.934 1.686 1.00 0.00 C ATOM 0 H ALA A 41 -5.689 -2.799 -0.483 1.00 0.00 H new ATOM 0 HA ALA A 41 -3.565 -4.137 0.654 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -5.113 -4.534 2.540 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -5.259 -2.879 1.902 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -6.486 -4.102 1.494 1.00 0.00 H new ATOM 592 N ARG A 42 -5.917 -6.201 -0.385 1.00 0.00 N ATOM 593 CA ARG A 42 -6.192 -7.598 -0.698 1.00 0.00 C ATOM 594 C ARG A 42 -5.102 -8.180 -1.593 1.00 0.00 C ATOM 595 O ARG A 42 -4.786 -9.366 -1.512 1.00 0.00 O ATOM 596 CB ARG A 42 -7.553 -7.731 -1.383 1.00 0.00 C ATOM 597 CG ARG A 42 -8.729 -7.634 -0.425 1.00 0.00 C ATOM 598 CD ARG A 42 -9.974 -7.107 -1.122 1.00 0.00 C ATOM 599 NE ARG A 42 -11.199 -7.630 -0.524 1.00 0.00 N ATOM 600 CZ ARG A 42 -12.402 -7.488 -1.070 1.00 0.00 C ATOM 601 NH1 ARG A 42 -12.540 -6.843 -2.220 1.00 0.00 N ATOM 602 NH2 ARG A 42 -13.470 -7.993 -0.465 1.00 0.00 N ATOM 0 H ARG A 42 -6.665 -5.556 -0.640 1.00 0.00 H new ATOM 0 HA ARG A 42 -6.207 -8.157 0.238 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -7.647 -6.952 -2.140 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -7.597 -8.688 -1.903 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -8.936 -8.617 -0.001 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -8.470 -6.977 0.405 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -9.983 -6.018 -1.073 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -9.941 -7.379 -2.177 1.00 0.00 H new ATOM 0 HE ARG A 42 -11.127 -8.132 0.361 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -11.721 -6.454 -2.688 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -13.465 -6.736 -2.637 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -13.368 -8.490 0.420 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -14.393 -7.884 -0.885 1.00 0.00 H new ATOM 616 N GLU A 43 -4.531 -7.335 -2.447 1.00 0.00 N ATOM 617 CA GLU A 43 -3.477 -7.767 -3.358 1.00 0.00 C ATOM 618 C GLU A 43 -2.167 -7.990 -2.607 1.00 0.00 C ATOM 619 O GLU A 43 -1.444 -8.951 -2.872 1.00 0.00 O ATOM 620 CB GLU A 43 -3.273 -6.730 -4.464 1.00 0.00 C ATOM 621 CG GLU A 43 -4.152 -6.959 -5.682 1.00 0.00 C ATOM 622 CD GLU A 43 -3.690 -6.170 -6.892 1.00 0.00 C ATOM 623 OE1 GLU A 43 -3.596 -4.929 -6.791 1.00 0.00 O ATOM 624 OE2 GLU A 43 -3.422 -6.795 -7.940 1.00 0.00 O ATOM 0 H GLU A 43 -4.780 -6.349 -2.527 1.00 0.00 H new ATOM 0 HA GLU A 43 -3.784 -8.712 -3.807 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -3.475 -5.737 -4.062 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -2.228 -6.742 -4.773 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -4.158 -8.021 -5.926 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -5.178 -6.681 -5.442 1.00 0.00 H new ATOM 631 N ILE A 44 -1.868 -7.096 -1.671 1.00 0.00 N ATOM 632 CA ILE A 44 -0.647 -7.196 -0.882 1.00 0.00 C ATOM 633 C ILE A 44 -0.622 -8.485 -0.068 1.00 0.00 C ATOM 634 O ILE A 44 0.420 -9.124 0.070 1.00 0.00 O ATOM 635 CB ILE A 44 -0.493 -5.996 0.072 1.00 0.00 C ATOM 636 CG1 ILE A 44 -0.204 -4.720 -0.721 1.00 0.00 C ATOM 637 CG2 ILE A 44 0.613 -6.261 1.082 1.00 0.00 C ATOM 638 CD1 ILE A 44 0.175 -3.542 0.148 1.00 0.00 C ATOM 0 H ILE A 44 -2.455 -6.294 -1.441 1.00 0.00 H new ATOM 0 HA ILE A 44 0.184 -7.198 -1.587 1.00 0.00 H new ATOM 0 HB ILE A 44 -1.428 -5.860 0.615 1.00 0.00 H new ATOM 0 HG12 ILE A 44 0.604 -4.915 -1.427 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -1.084 -4.460 -1.308 1.00 0.00 H new ATOM 0 HG21 ILE A 44 0.710 -5.404 1.749 1.00 0.00 H new ATOM 0 HG22 ILE A 44 0.368 -7.149 1.665 1.00 0.00 H new ATOM 0 HG23 ILE A 44 1.555 -6.420 0.557 1.00 0.00 H new ATOM 0 HD11 ILE A 44 0.366 -2.672 -0.481 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -0.641 -3.320 0.836 1.00 0.00 H new ATOM 0 HD13 ILE A 44 1.074 -3.783 0.716 1.00 0.00 H new ATOM 650 N GLY A 45 -1.778 -8.862 0.469 1.00 0.00 N ATOM 651 CA GLY A 45 -1.868 -10.075 1.262 1.00 0.00 C ATOM 652 C GLY A 45 -1.805 -9.800 2.751 1.00 0.00 C ATOM 653 O GLY A 45 -0.722 -9.727 3.331 1.00 0.00 O ATOM 0 H GLY A 45 -2.654 -8.349 0.369 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -2.801 -10.589 1.030 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -1.056 -10.747 0.985 1.00 0.00 H new ATOM 657 N TYR A 46 -2.969 -9.644 3.371 1.00 0.00 N ATOM 658 CA TYR A 46 -3.043 -9.371 4.802 1.00 0.00 C ATOM 659 C TYR A 46 -2.076 -10.262 5.577 1.00 0.00 C ATOM 660 O TYR A 46 -1.729 -11.363 5.150 1.00 0.00 O ATOM 661 CB TYR A 46 -4.469 -9.584 5.311 1.00 0.00 C ATOM 662 CG TYR A 46 -5.466 -8.596 4.748 1.00 0.00 C ATOM 663 CD1 TYR A 46 -6.148 -8.862 3.567 1.00 0.00 C ATOM 664 CD2 TYR A 46 -5.727 -7.396 5.399 1.00 0.00 C ATOM 665 CE1 TYR A 46 -7.059 -7.962 3.050 1.00 0.00 C ATOM 666 CE2 TYR A 46 -6.637 -6.490 4.890 1.00 0.00 C ATOM 667 CZ TYR A 46 -7.300 -6.778 3.715 1.00 0.00 C ATOM 668 OH TYR A 46 -8.208 -5.879 3.203 1.00 0.00 O ATOM 0 H TYR A 46 -3.875 -9.702 2.905 1.00 0.00 H new ATOM 0 HA TYR A 46 -2.759 -8.331 4.962 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -4.789 -10.595 5.058 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -4.472 -9.511 6.399 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -5.962 -9.789 3.044 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -5.209 -7.168 6.319 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -7.580 -8.184 2.130 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -6.828 -5.562 5.409 1.00 0.00 H new ATOM 0 HH TYR A 46 -8.215 -5.070 3.756 1.00 0.00 H new ATOM 678 N PRO A 47 -1.632 -9.775 6.745 1.00 0.00 N ATOM 679 CA PRO A 47 -2.038 -8.465 7.262 1.00 0.00 C ATOM 680 C PRO A 47 -1.455 -7.314 6.448 1.00 0.00 C ATOM 681 O PRO A 47 -0.455 -7.478 5.750 1.00 0.00 O ATOM 682 CB PRO A 47 -1.471 -8.454 8.684 1.00 0.00 C ATOM 683 CG PRO A 47 -0.321 -9.399 8.641 1.00 0.00 C ATOM 684 CD PRO A 47 -0.697 -10.465 7.650 1.00 0.00 C ATOM 0 HA PRO A 47 -3.118 -8.326 7.217 1.00 0.00 H new ATOM 0 HB2 PRO A 47 -1.150 -7.454 8.975 1.00 0.00 H new ATOM 0 HB3 PRO A 47 -2.218 -8.773 9.411 1.00 0.00 H new ATOM 0 HG2 PRO A 47 0.593 -8.888 8.337 1.00 0.00 H new ATOM 0 HG3 PRO A 47 -0.133 -9.830 9.625 1.00 0.00 H new ATOM 0 HD2 PRO A 47 0.175 -10.842 7.116 1.00 0.00 H new ATOM 0 HD3 PRO A 47 -1.166 -11.319 8.138 1.00 0.00 H new ATOM 692 N VAL A 48 -2.088 -6.149 6.543 1.00 0.00 N ATOM 693 CA VAL A 48 -1.632 -4.970 5.816 1.00 0.00 C ATOM 694 C VAL A 48 -1.609 -3.743 6.720 1.00 0.00 C ATOM 695 O VAL A 48 -2.624 -3.378 7.313 1.00 0.00 O ATOM 696 CB VAL A 48 -2.527 -4.681 4.597 1.00 0.00 C ATOM 697 CG1 VAL A 48 -2.398 -5.789 3.564 1.00 0.00 C ATOM 698 CG2 VAL A 48 -3.976 -4.510 5.029 1.00 0.00 C ATOM 0 H VAL A 48 -2.918 -5.996 7.116 1.00 0.00 H new ATOM 0 HA VAL A 48 -0.620 -5.182 5.471 1.00 0.00 H new ATOM 0 HB VAL A 48 -2.196 -3.750 4.138 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -3.038 -5.567 2.710 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -1.362 -5.859 3.233 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -2.701 -6.737 4.008 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -4.595 -4.306 4.155 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -4.321 -5.423 5.513 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -4.051 -3.678 5.729 1.00 0.00 H new ATOM 708 N MET A 49 -0.445 -3.109 6.819 1.00 0.00 N ATOM 709 CA MET A 49 -0.291 -1.920 7.650 1.00 0.00 C ATOM 710 C MET A 49 -0.749 -0.672 6.902 1.00 0.00 C ATOM 711 O MET A 49 -0.396 -0.468 5.740 1.00 0.00 O ATOM 712 CB MET A 49 1.167 -1.761 8.085 1.00 0.00 C ATOM 713 CG MET A 49 1.395 -0.592 9.029 1.00 0.00 C ATOM 714 SD MET A 49 3.144 -0.288 9.348 1.00 0.00 S ATOM 715 CE MET A 49 3.664 -1.895 9.944 1.00 0.00 C ATOM 0 H MET A 49 0.405 -3.398 6.335 1.00 0.00 H new ATOM 0 HA MET A 49 -0.915 -2.042 8.535 1.00 0.00 H new ATOM 0 HB2 MET A 49 1.495 -2.680 8.572 1.00 0.00 H new ATOM 0 HB3 MET A 49 1.789 -1.630 7.200 1.00 0.00 H new ATOM 0 HG2 MET A 49 0.946 0.306 8.605 1.00 0.00 H new ATOM 0 HG3 MET A 49 0.886 -0.788 9.973 1.00 0.00 H new ATOM 0 HE1 MET A 49 4.686 -1.831 10.317 1.00 0.00 H new ATOM 0 HE2 MET A 49 3.003 -2.216 10.749 1.00 0.00 H new ATOM 0 HE3 MET A 49 3.620 -2.617 9.129 1.00 0.00 H new ATOM 725 N ILE A 50 -1.537 0.160 7.576 1.00 0.00 N ATOM 726 CA ILE A 50 -2.041 1.388 6.975 1.00 0.00 C ATOM 727 C ILE A 50 -1.492 2.617 7.691 1.00 0.00 C ATOM 728 O ILE A 50 -1.805 2.863 8.856 1.00 0.00 O ATOM 729 CB ILE A 50 -3.581 1.437 7.002 1.00 0.00 C ATOM 730 CG1 ILE A 50 -4.164 0.280 6.189 1.00 0.00 C ATOM 731 CG2 ILE A 50 -4.078 2.772 6.466 1.00 0.00 C ATOM 732 CD1 ILE A 50 -5.584 -0.073 6.574 1.00 0.00 C ATOM 0 H ILE A 50 -1.840 0.006 8.538 1.00 0.00 H new ATOM 0 HA ILE A 50 -1.703 1.394 5.939 1.00 0.00 H new ATOM 0 HB ILE A 50 -3.915 1.335 8.035 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -4.137 0.540 5.131 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -3.532 -0.599 6.318 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -5.168 2.791 6.491 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -3.686 3.580 7.083 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -3.737 2.902 5.439 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -5.933 -0.901 5.957 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -5.615 -0.364 7.624 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -6.229 0.792 6.419 1.00 0.00 H new ATOM 744 N LYS A 51 -0.672 3.389 6.986 1.00 0.00 N ATOM 745 CA LYS A 51 -0.080 4.595 7.551 1.00 0.00 C ATOM 746 C LYS A 51 -0.578 5.839 6.823 1.00 0.00 C ATOM 747 O LYS A 51 -1.204 5.743 5.768 1.00 0.00 O ATOM 748 CB LYS A 51 1.447 4.523 7.475 1.00 0.00 C ATOM 749 CG LYS A 51 2.019 3.204 7.963 1.00 0.00 C ATOM 750 CD LYS A 51 2.138 2.195 6.832 1.00 0.00 C ATOM 751 CE LYS A 51 3.419 2.398 6.038 1.00 0.00 C ATOM 752 NZ LYS A 51 4.553 1.615 6.603 1.00 0.00 N ATOM 0 H LYS A 51 -0.402 3.200 6.021 1.00 0.00 H new ATOM 0 HA LYS A 51 -0.383 4.662 8.596 1.00 0.00 H new ATOM 0 HB2 LYS A 51 1.759 4.685 6.443 1.00 0.00 H new ATOM 0 HB3 LYS A 51 1.870 5.334 8.067 1.00 0.00 H new ATOM 0 HG2 LYS A 51 3.001 3.374 8.405 1.00 0.00 H new ATOM 0 HG3 LYS A 51 1.381 2.798 8.748 1.00 0.00 H new ATOM 0 HD2 LYS A 51 2.118 1.185 7.241 1.00 0.00 H new ATOM 0 HD3 LYS A 51 1.278 2.288 6.168 1.00 0.00 H new ATOM 0 HE2 LYS A 51 3.254 2.102 5.002 1.00 0.00 H new ATOM 0 HE3 LYS A 51 3.677 3.457 6.030 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 5.077 1.157 5.831 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 5.189 2.252 7.123 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 4.185 0.889 7.250 1.00 0.00 H new ATOM 766 N ALA A 52 -0.294 7.006 7.391 1.00 0.00 N ATOM 767 CA ALA A 52 -0.710 8.269 6.794 1.00 0.00 C ATOM 768 C ALA A 52 0.359 8.808 5.850 1.00 0.00 C ATOM 769 O ALA A 52 1.441 9.204 6.284 1.00 0.00 O ATOM 770 CB ALA A 52 -1.023 9.289 7.878 1.00 0.00 C ATOM 0 H ALA A 52 0.223 7.103 8.265 1.00 0.00 H new ATOM 0 HA ALA A 52 -1.613 8.087 6.212 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -1.332 10.227 7.417 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -1.827 8.913 8.510 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -0.134 9.459 8.485 1.00 0.00 H new ATOM 776 N SER A 53 0.050 8.821 4.557 1.00 0.00 N ATOM 777 CA SER A 53 0.987 9.308 3.552 1.00 0.00 C ATOM 778 C SER A 53 1.581 10.650 3.967 1.00 0.00 C ATOM 779 O SER A 53 2.773 10.896 3.788 1.00 0.00 O ATOM 780 CB SER A 53 0.289 9.444 2.197 1.00 0.00 C ATOM 781 OG SER A 53 1.207 9.279 1.131 1.00 0.00 O ATOM 0 H SER A 53 -0.842 8.500 4.181 1.00 0.00 H new ATOM 0 HA SER A 53 1.797 8.584 3.465 1.00 0.00 H new ATOM 0 HB2 SER A 53 -0.504 8.700 2.117 1.00 0.00 H new ATOM 0 HB3 SER A 53 -0.184 10.423 2.125 1.00 0.00 H new ATOM 0 HG SER A 53 0.736 9.369 0.277 1.00 0.00 H new ATOM 787 N ALA A 54 0.739 11.515 4.524 1.00 0.00 N ATOM 788 CA ALA A 54 1.180 12.832 4.967 1.00 0.00 C ATOM 789 C ALA A 54 2.485 12.739 5.751 1.00 0.00 C ATOM 790 O ALA A 54 3.413 13.513 5.524 1.00 0.00 O ATOM 791 CB ALA A 54 0.101 13.493 5.812 1.00 0.00 C ATOM 0 H ALA A 54 -0.252 11.327 4.679 1.00 0.00 H new ATOM 0 HA ALA A 54 1.360 13.444 4.083 1.00 0.00 H new ATOM 0 HB1 ALA A 54 0.444 14.476 6.136 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -0.808 13.603 5.221 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -0.107 12.875 6.685 1.00 0.00 H new ATOM 797 N GLY A 55 2.548 11.786 6.676 1.00 0.00 N ATOM 798 CA GLY A 55 3.743 11.610 7.480 1.00 0.00 C ATOM 799 C GLY A 55 4.175 10.160 7.567 1.00 0.00 C ATOM 800 O GLY A 55 5.272 9.805 7.138 1.00 0.00 O ATOM 0 H GLY A 55 1.792 11.133 6.883 1.00 0.00 H new ATOM 0 HA2 GLY A 55 4.553 12.202 7.055 1.00 0.00 H new ATOM 0 HA3 GLY A 55 3.561 11.993 8.484 1.00 0.00 H new ATOM 804 N GLY A 56 3.311 9.319 8.127 1.00 0.00 N ATOM 805 CA GLY A 56 3.628 7.909 8.261 1.00 0.00 C ATOM 806 C GLY A 56 4.821 7.667 9.163 1.00 0.00 C ATOM 807 O GLY A 56 5.188 8.526 9.963 1.00 0.00 O ATOM 0 H GLY A 56 2.397 9.589 8.490 1.00 0.00 H new ATOM 0 HA2 GLY A 56 2.762 7.381 8.660 1.00 0.00 H new ATOM 0 HA3 GLY A 56 3.831 7.490 7.275 1.00 0.00 H new ATOM 811 N GLY A 57 5.429 6.491 9.036 1.00 0.00 N ATOM 812 CA GLY A 57 6.580 6.158 9.854 1.00 0.00 C ATOM 813 C GLY A 57 6.290 5.040 10.836 1.00 0.00 C ATOM 814 O GLY A 57 7.134 4.176 11.072 1.00 0.00 O ATOM 0 H GLY A 57 5.144 5.763 8.381 1.00 0.00 H new ATOM 0 HA2 GLY A 57 7.408 5.865 9.208 1.00 0.00 H new ATOM 0 HA3 GLY A 57 6.901 7.044 10.402 1.00 0.00 H new ATOM 818 N GLY A 58 5.091 5.056 11.412 1.00 0.00 N ATOM 819 CA GLY A 58 4.714 4.032 12.369 1.00 0.00 C ATOM 820 C GLY A 58 4.698 4.548 13.794 1.00 0.00 C ATOM 821 O GLY A 58 5.308 3.955 14.684 1.00 0.00 O ATOM 0 H GLY A 58 4.375 5.760 11.233 1.00 0.00 H new ATOM 0 HA2 GLY A 58 3.727 3.647 12.114 1.00 0.00 H new ATOM 0 HA3 GLY A 58 5.411 3.197 12.296 1.00 0.00 H new ATOM 825 N LYS A 59 3.999 5.657 14.012 1.00 0.00 N ATOM 826 CA LYS A 59 3.906 6.254 15.339 1.00 0.00 C ATOM 827 C LYS A 59 2.492 6.122 15.897 1.00 0.00 C ATOM 828 O LYS A 59 2.296 5.625 17.005 1.00 0.00 O ATOM 829 CB LYS A 59 4.309 7.730 15.287 1.00 0.00 C ATOM 830 CG LYS A 59 4.611 8.327 16.650 1.00 0.00 C ATOM 831 CD LYS A 59 3.338 8.593 17.437 1.00 0.00 C ATOM 832 CE LYS A 59 3.517 9.746 18.412 1.00 0.00 C ATOM 833 NZ LYS A 59 3.442 11.067 17.728 1.00 0.00 N ATOM 0 H LYS A 59 3.489 6.160 13.287 1.00 0.00 H new ATOM 0 HA LYS A 59 4.590 5.720 15.999 1.00 0.00 H new ATOM 0 HB2 LYS A 59 5.188 7.836 14.651 1.00 0.00 H new ATOM 0 HB3 LYS A 59 3.507 8.301 14.820 1.00 0.00 H new ATOM 0 HG2 LYS A 59 5.252 7.648 17.212 1.00 0.00 H new ATOM 0 HG3 LYS A 59 5.164 9.258 16.526 1.00 0.00 H new ATOM 0 HD2 LYS A 59 2.524 8.820 16.749 1.00 0.00 H new ATOM 0 HD3 LYS A 59 3.052 7.694 17.983 1.00 0.00 H new ATOM 0 HE2 LYS A 59 2.749 9.692 19.183 1.00 0.00 H new ATOM 0 HE3 LYS A 59 4.480 9.651 18.914 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 3.569 11.827 18.426 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 4.191 11.129 17.009 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 2.514 11.169 17.270 1.00 0.00 H new ATOM 847 N GLY A 60 1.510 6.569 15.121 1.00 0.00 N ATOM 848 CA GLY A 60 0.127 6.491 15.554 1.00 0.00 C ATOM 849 C GLY A 60 -0.803 6.043 14.445 1.00 0.00 C ATOM 850 O GLY A 60 -1.866 6.629 14.242 1.00 0.00 O ATOM 0 H GLY A 60 1.647 6.984 14.199 1.00 0.00 H new ATOM 0 HA2 GLY A 60 0.050 5.797 16.391 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -0.192 7.467 15.919 1.00 0.00 H new ATOM 854 N MET A 61 -0.403 5.001 13.723 1.00 0.00 N ATOM 855 CA MET A 61 -1.209 4.475 12.628 1.00 0.00 C ATOM 856 C MET A 61 -1.958 3.218 13.058 1.00 0.00 C ATOM 857 O MET A 61 -1.826 2.764 14.195 1.00 0.00 O ATOM 858 CB MET A 61 -0.325 4.167 11.418 1.00 0.00 C ATOM 859 CG MET A 61 0.594 2.975 11.625 1.00 0.00 C ATOM 860 SD MET A 61 -0.266 1.398 11.463 1.00 0.00 S ATOM 861 CE MET A 61 -0.162 0.782 13.142 1.00 0.00 C ATOM 0 H MET A 61 0.475 4.504 13.877 1.00 0.00 H new ATOM 0 HA MET A 61 -1.940 5.235 12.351 1.00 0.00 H new ATOM 0 HB2 MET A 61 -0.960 3.979 10.552 1.00 0.00 H new ATOM 0 HB3 MET A 61 0.278 5.045 11.186 1.00 0.00 H new ATOM 0 HG2 MET A 61 1.407 3.017 10.900 1.00 0.00 H new ATOM 0 HG3 MET A 61 1.047 3.038 12.615 1.00 0.00 H new ATOM 0 HE1 MET A 61 0.507 -0.078 13.173 1.00 0.00 H new ATOM 0 HE2 MET A 61 0.224 1.566 13.794 1.00 0.00 H new ATOM 0 HE3 MET A 61 -1.154 0.483 13.482 1.00 0.00 H new ATOM 871 N ARG A 62 -2.744 2.660 12.144 1.00 0.00 N ATOM 872 CA ARG A 62 -3.515 1.456 12.430 1.00 0.00 C ATOM 873 C ARG A 62 -3.231 0.370 11.396 1.00 0.00 C ATOM 874 O ARG A 62 -2.812 0.660 10.276 1.00 0.00 O ATOM 875 CB ARG A 62 -5.010 1.775 12.452 1.00 0.00 C ATOM 876 CG ARG A 62 -5.851 0.709 13.135 1.00 0.00 C ATOM 877 CD ARG A 62 -7.329 0.881 12.824 1.00 0.00 C ATOM 878 NE ARG A 62 -8.049 -0.389 12.867 1.00 0.00 N ATOM 879 CZ ARG A 62 -9.364 -0.483 13.036 1.00 0.00 C ATOM 880 NH1 ARG A 62 -10.098 0.612 13.176 1.00 0.00 N ATOM 881 NH2 ARG A 62 -9.946 -1.675 13.064 1.00 0.00 N ATOM 0 H ARG A 62 -2.864 3.023 11.198 1.00 0.00 H new ATOM 0 HA ARG A 62 -3.215 1.087 13.411 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -5.162 2.727 12.961 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -5.361 1.901 11.428 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -5.522 -0.278 12.810 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -5.697 0.758 14.213 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -7.772 1.573 13.540 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -7.442 1.328 11.837 1.00 0.00 H new ATOM 0 HE ARG A 62 -7.514 -1.251 12.762 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -9.654 1.530 13.154 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -11.107 0.537 13.306 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -9.384 -2.519 12.956 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -10.955 -1.747 13.194 1.00 0.00 H new ATOM 895 N ILE A 63 -3.462 -0.881 11.781 1.00 0.00 N ATOM 896 CA ILE A 63 -3.231 -2.009 10.888 1.00 0.00 C ATOM 897 C ILE A 63 -4.524 -2.772 10.622 1.00 0.00 C ATOM 898 O ILE A 63 -5.394 -2.861 11.488 1.00 0.00 O ATOM 899 CB ILE A 63 -2.185 -2.980 11.466 1.00 0.00 C ATOM 900 CG1 ILE A 63 -0.938 -2.214 11.913 1.00 0.00 C ATOM 901 CG2 ILE A 63 -1.821 -4.040 10.437 1.00 0.00 C ATOM 902 CD1 ILE A 63 0.112 -3.092 12.557 1.00 0.00 C ATOM 0 H ILE A 63 -3.809 -1.138 12.705 1.00 0.00 H new ATOM 0 HA ILE A 63 -2.854 -1.598 9.951 1.00 0.00 H new ATOM 0 HB ILE A 63 -2.614 -3.477 12.336 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -0.501 -1.712 11.050 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -1.232 -1.437 12.618 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -1.081 -4.719 10.860 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -2.714 -4.602 10.162 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -1.408 -3.559 9.550 1.00 0.00 H new ATOM 0 HD11 ILE A 63 0.967 -2.482 12.849 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -0.308 -3.574 13.440 1.00 0.00 H new ATOM 0 HD13 ILE A 63 0.435 -3.854 11.847 1.00 0.00 H new ATOM 914 N ALA A 64 -4.643 -3.324 9.418 1.00 0.00 N ATOM 915 CA ALA A 64 -5.828 -4.083 9.039 1.00 0.00 C ATOM 916 C ALA A 64 -5.467 -5.520 8.678 1.00 0.00 C ATOM 917 O ALA A 64 -4.382 -5.785 8.159 1.00 0.00 O ATOM 918 CB ALA A 64 -6.538 -3.407 7.876 1.00 0.00 C ATOM 0 H ALA A 64 -3.933 -3.259 8.689 1.00 0.00 H new ATOM 0 HA ALA A 64 -6.502 -4.109 9.895 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -7.421 -3.985 7.603 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -6.839 -2.401 8.168 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -5.864 -3.350 7.021 1.00 0.00 H new ATOM 924 N TRP A 65 -6.381 -6.442 8.956 1.00 0.00 N ATOM 925 CA TRP A 65 -6.157 -7.853 8.660 1.00 0.00 C ATOM 926 C TRP A 65 -7.208 -8.378 7.688 1.00 0.00 C ATOM 927 O TRP A 65 -7.052 -9.457 7.115 1.00 0.00 O ATOM 928 CB TRP A 65 -6.181 -8.675 9.950 1.00 0.00 C ATOM 929 CG TRP A 65 -5.005 -8.415 10.841 1.00 0.00 C ATOM 930 CD1 TRP A 65 -4.776 -7.298 11.592 1.00 0.00 C ATOM 931 CD2 TRP A 65 -3.895 -9.291 11.074 1.00 0.00 C ATOM 932 NE1 TRP A 65 -3.592 -7.425 12.277 1.00 0.00 N ATOM 933 CE2 TRP A 65 -3.033 -8.639 11.977 1.00 0.00 C ATOM 934 CE3 TRP A 65 -3.548 -10.562 10.609 1.00 0.00 C ATOM 935 CZ2 TRP A 65 -1.846 -9.217 12.421 1.00 0.00 C ATOM 936 CZ3 TRP A 65 -2.370 -11.133 11.050 1.00 0.00 C ATOM 937 CH2 TRP A 65 -1.531 -10.462 11.949 1.00 0.00 C ATOM 0 H TRP A 65 -7.284 -6.239 9.386 1.00 0.00 H new ATOM 0 HA TRP A 65 -5.177 -7.951 8.193 1.00 0.00 H new ATOM 0 HB2 TRP A 65 -7.098 -8.454 10.496 1.00 0.00 H new ATOM 0 HB3 TRP A 65 -6.209 -9.735 9.697 1.00 0.00 H new ATOM 0 HD1 TRP A 65 -5.430 -6.440 11.640 1.00 0.00 H new ATOM 0 HE1 TRP A 65 -3.194 -6.728 12.907 1.00 0.00 H new ATOM 0 HE3 TRP A 65 -4.189 -11.088 9.917 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 -1.197 -8.701 13.113 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 -2.091 -12.114 10.695 1.00 0.00 H new ATOM 0 HH2 TRP A 65 -0.618 -10.937 12.276 1.00 0.00 H new ATOM 948 N ASP A 66 -8.276 -7.611 7.507 1.00 0.00 N ATOM 949 CA ASP A 66 -9.352 -7.999 6.602 1.00 0.00 C ATOM 950 C ASP A 66 -10.006 -6.771 5.976 1.00 0.00 C ATOM 951 O ASP A 66 -9.744 -5.640 6.385 1.00 0.00 O ATOM 952 CB ASP A 66 -10.401 -8.825 7.349 1.00 0.00 C ATOM 953 CG ASP A 66 -9.782 -9.925 8.189 1.00 0.00 C ATOM 954 OD1 ASP A 66 -9.073 -10.780 7.618 1.00 0.00 O ATOM 955 OD2 ASP A 66 -10.005 -9.929 9.417 1.00 0.00 O ATOM 0 H ASP A 66 -8.421 -6.716 7.975 1.00 0.00 H new ATOM 0 HA ASP A 66 -8.922 -8.605 5.805 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -10.987 -8.167 7.991 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -11.091 -9.266 6.630 1.00 0.00 H new ATOM 960 N ASP A 67 -10.855 -7.002 4.981 1.00 0.00 N ATOM 961 CA ASP A 67 -11.546 -5.914 4.298 1.00 0.00 C ATOM 962 C ASP A 67 -12.252 -5.005 5.298 1.00 0.00 C ATOM 963 O ASP A 67 -12.089 -3.786 5.265 1.00 0.00 O ATOM 964 CB ASP A 67 -12.557 -6.474 3.296 1.00 0.00 C ATOM 965 CG ASP A 67 -13.696 -7.210 3.973 1.00 0.00 C ATOM 966 OD1 ASP A 67 -14.689 -6.551 4.346 1.00 0.00 O ATOM 967 OD2 ASP A 67 -13.595 -8.445 4.131 1.00 0.00 O ATOM 0 H ASP A 67 -11.081 -7.932 4.629 1.00 0.00 H new ATOM 0 HA ASP A 67 -10.803 -5.324 3.762 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -12.961 -5.658 2.697 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -12.048 -7.151 2.610 1.00 0.00 H new ATOM 972 N GLU A 68 -13.037 -5.608 6.186 1.00 0.00 N ATOM 973 CA GLU A 68 -13.769 -4.851 7.195 1.00 0.00 C ATOM 974 C GLU A 68 -12.829 -3.944 7.984 1.00 0.00 C ATOM 975 O GLU A 68 -13.155 -2.792 8.267 1.00 0.00 O ATOM 976 CB GLU A 68 -14.498 -5.801 8.148 1.00 0.00 C ATOM 977 CG GLU A 68 -13.612 -6.903 8.703 1.00 0.00 C ATOM 978 CD GLU A 68 -14.301 -7.719 9.780 1.00 0.00 C ATOM 979 OE1 GLU A 68 -14.333 -7.261 10.941 1.00 0.00 O ATOM 980 OE2 GLU A 68 -14.808 -8.815 9.462 1.00 0.00 O ATOM 0 H GLU A 68 -13.182 -6.617 6.227 1.00 0.00 H new ATOM 0 HA GLU A 68 -14.502 -4.228 6.683 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -14.910 -5.225 8.977 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -15.340 -6.253 7.624 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -13.308 -7.563 7.891 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -12.703 -6.462 9.112 1.00 0.00 H new ATOM 987 N GLU A 69 -11.661 -4.474 8.335 1.00 0.00 N ATOM 988 CA GLU A 69 -10.675 -3.712 9.092 1.00 0.00 C ATOM 989 C GLU A 69 -10.050 -2.621 8.228 1.00 0.00 C ATOM 990 O GLU A 69 -9.774 -1.518 8.703 1.00 0.00 O ATOM 991 CB GLU A 69 -9.583 -4.641 9.628 1.00 0.00 C ATOM 992 CG GLU A 69 -10.010 -5.442 10.847 1.00 0.00 C ATOM 993 CD GLU A 69 -8.842 -5.814 11.739 1.00 0.00 C ATOM 994 OE1 GLU A 69 -8.256 -4.903 12.361 1.00 0.00 O ATOM 995 OE2 GLU A 69 -8.513 -7.016 11.814 1.00 0.00 O ATOM 0 H GLU A 69 -11.375 -5.426 8.108 1.00 0.00 H new ATOM 0 HA GLU A 69 -11.185 -3.239 9.931 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -9.283 -5.330 8.838 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -8.705 -4.047 9.883 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -10.732 -4.863 11.423 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -10.517 -6.350 10.521 1.00 0.00 H new ATOM 1002 N THR A 70 -9.829 -2.935 6.955 1.00 0.00 N ATOM 1003 CA THR A 70 -9.236 -1.984 6.025 1.00 0.00 C ATOM 1004 C THR A 70 -10.028 -0.682 5.990 1.00 0.00 C ATOM 1005 O THR A 70 -9.483 0.395 6.234 1.00 0.00 O ATOM 1006 CB THR A 70 -9.160 -2.564 4.600 1.00 0.00 C ATOM 1007 OG1 THR A 70 -8.538 -3.853 4.628 1.00 0.00 O ATOM 1008 CG2 THR A 70 -8.379 -1.638 3.679 1.00 0.00 C ATOM 0 H THR A 70 -10.052 -3.842 6.545 1.00 0.00 H new ATOM 0 HA THR A 70 -8.226 -1.782 6.381 1.00 0.00 H new ATOM 0 HB THR A 70 -10.176 -2.660 4.216 1.00 0.00 H new ATOM 0 HG1 THR A 70 -9.073 -4.463 5.178 1.00 0.00 H new ATOM 0 HG21 THR A 70 -8.339 -2.069 2.679 1.00 0.00 H new ATOM 0 HG22 THR A 70 -8.872 -0.667 3.636 1.00 0.00 H new ATOM 0 HG23 THR A 70 -7.366 -1.514 4.061 1.00 0.00 H new ATOM 1016 N ARG A 71 -11.317 -0.787 5.684 1.00 0.00 N ATOM 1017 CA ARG A 71 -12.185 0.383 5.617 1.00 0.00 C ATOM 1018 C ARG A 71 -12.214 1.116 6.955 1.00 0.00 C ATOM 1019 O ARG A 71 -11.873 2.296 7.035 1.00 0.00 O ATOM 1020 CB ARG A 71 -13.603 -0.030 5.218 1.00 0.00 C ATOM 1021 CG ARG A 71 -13.701 -0.584 3.806 1.00 0.00 C ATOM 1022 CD ARG A 71 -14.920 -1.479 3.643 1.00 0.00 C ATOM 1023 NE ARG A 71 -15.261 -1.688 2.238 1.00 0.00 N ATOM 1024 CZ ARG A 71 -15.695 -0.723 1.436 1.00 0.00 C ATOM 1025 NH1 ARG A 71 -15.840 0.512 1.896 1.00 0.00 N ATOM 1026 NH2 ARG A 71 -15.985 -0.992 0.169 1.00 0.00 N ATOM 0 H ARG A 71 -11.784 -1.670 5.478 1.00 0.00 H new ATOM 0 HA ARG A 71 -11.785 1.059 4.861 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -13.965 -0.781 5.920 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -14.263 0.833 5.307 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -13.755 0.239 3.094 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -12.799 -1.149 3.572 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -14.729 -2.442 4.117 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -15.769 -1.032 4.160 1.00 0.00 H new ATOM 0 HE ARG A 71 -15.160 -2.627 1.852 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -15.618 0.723 2.869 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -16.174 1.251 1.277 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -15.875 -1.941 -0.189 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -16.318 -0.250 -0.446 1.00 0.00 H new ATOM 1040 N ASP A 72 -12.623 0.408 8.002 1.00 0.00 N ATOM 1041 CA ASP A 72 -12.697 0.991 9.337 1.00 0.00 C ATOM 1042 C ASP A 72 -11.421 1.759 9.665 1.00 0.00 C ATOM 1043 O ASP A 72 -11.471 2.894 10.138 1.00 0.00 O ATOM 1044 CB ASP A 72 -12.932 -0.102 10.381 1.00 0.00 C ATOM 1045 CG ASP A 72 -14.406 -0.381 10.605 1.00 0.00 C ATOM 1046 OD1 ASP A 72 -14.960 -1.246 9.896 1.00 0.00 O ATOM 1047 OD2 ASP A 72 -15.004 0.267 11.490 1.00 0.00 O ATOM 0 H ASP A 72 -12.908 -0.570 7.952 1.00 0.00 H new ATOM 0 HA ASP A 72 -13.535 1.688 9.357 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -12.436 -1.019 10.061 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -12.474 0.196 11.324 1.00 0.00 H new ATOM 1052 N GLY A 73 -10.276 1.131 9.413 1.00 0.00 N ATOM 1053 CA GLY A 73 -9.003 1.770 9.689 1.00 0.00 C ATOM 1054 C GLY A 73 -8.715 2.921 8.745 1.00 0.00 C ATOM 1055 O GLY A 73 -8.147 3.937 9.148 1.00 0.00 O ATOM 0 H GLY A 73 -10.208 0.191 9.023 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -8.999 2.136 10.716 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -8.205 1.032 9.611 1.00 0.00 H new ATOM 1059 N PHE A 74 -9.106 2.763 7.485 1.00 0.00 N ATOM 1060 CA PHE A 74 -8.884 3.797 6.481 1.00 0.00 C ATOM 1061 C PHE A 74 -9.654 5.067 6.828 1.00 0.00 C ATOM 1062 O PHE A 74 -9.123 6.174 6.733 1.00 0.00 O ATOM 1063 CB PHE A 74 -9.306 3.293 5.099 1.00 0.00 C ATOM 1064 CG PHE A 74 -9.293 4.360 4.042 1.00 0.00 C ATOM 1065 CD1 PHE A 74 -10.367 5.223 3.897 1.00 0.00 C ATOM 1066 CD2 PHE A 74 -8.206 4.501 3.194 1.00 0.00 C ATOM 1067 CE1 PHE A 74 -10.358 6.207 2.926 1.00 0.00 C ATOM 1068 CE2 PHE A 74 -8.191 5.482 2.221 1.00 0.00 C ATOM 1069 CZ PHE A 74 -9.269 6.336 2.086 1.00 0.00 C ATOM 0 H PHE A 74 -9.578 1.929 7.135 1.00 0.00 H new ATOM 0 HA PHE A 74 -7.820 4.032 6.466 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -8.640 2.485 4.797 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -10.309 2.871 5.166 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -11.221 5.126 4.550 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -7.361 3.836 3.295 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -11.201 6.874 2.824 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -7.338 5.581 1.567 1.00 0.00 H new ATOM 0 HZ PHE A 74 -9.260 7.103 1.325 1.00 0.00 H new ATOM 1079 N ARG A 75 -10.910 4.899 7.231 1.00 0.00 N ATOM 1080 CA ARG A 75 -11.755 6.032 7.591 1.00 0.00 C ATOM 1081 C ARG A 75 -11.168 6.792 8.777 1.00 0.00 C ATOM 1082 O ARG A 75 -11.154 8.024 8.793 1.00 0.00 O ATOM 1083 CB ARG A 75 -13.169 5.555 7.926 1.00 0.00 C ATOM 1084 CG ARG A 75 -13.904 4.949 6.742 1.00 0.00 C ATOM 1085 CD ARG A 75 -15.407 4.926 6.971 1.00 0.00 C ATOM 1086 NE ARG A 75 -16.015 6.234 6.740 1.00 0.00 N ATOM 1087 CZ ARG A 75 -16.093 6.808 5.545 1.00 0.00 C ATOM 1088 NH1 ARG A 75 -15.605 6.192 4.477 1.00 0.00 N ATOM 1089 NH2 ARG A 75 -16.662 8.000 5.416 1.00 0.00 N ATOM 0 H ARG A 75 -11.364 3.990 7.316 1.00 0.00 H new ATOM 0 HA ARG A 75 -11.800 6.706 6.736 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -13.114 4.816 8.726 1.00 0.00 H new ATOM 0 HB3 ARG A 75 -13.746 6.397 8.309 1.00 0.00 H new ATOM 0 HG2 ARG A 75 -13.681 5.522 5.842 1.00 0.00 H new ATOM 0 HG3 ARG A 75 -13.545 3.934 6.571 1.00 0.00 H new ATOM 0 HD2 ARG A 75 -15.864 4.191 6.308 1.00 0.00 H new ATOM 0 HD3 ARG A 75 -15.613 4.605 7.992 1.00 0.00 H new ATOM 0 HE ARG A 75 -16.401 6.734 7.541 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -15.168 5.275 4.572 1.00 0.00 H new ATOM 0 HH12 ARG A 75 -15.666 6.635 3.560 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -17.040 8.476 6.235 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -16.721 8.440 4.498 1.00 0.00 H new ATOM 1103 N LEU A 76 -10.685 6.051 9.768 1.00 0.00 N ATOM 1104 CA LEU A 76 -10.098 6.654 10.959 1.00 0.00 C ATOM 1105 C LEU A 76 -8.729 7.251 10.648 1.00 0.00 C ATOM 1106 O LEU A 76 -8.517 8.454 10.795 1.00 0.00 O ATOM 1107 CB LEU A 76 -9.972 5.613 12.073 1.00 0.00 C ATOM 1108 CG LEU A 76 -11.267 4.911 12.484 1.00 0.00 C ATOM 1109 CD1 LEU A 76 -10.962 3.669 13.307 1.00 0.00 C ATOM 1110 CD2 LEU A 76 -12.165 5.861 13.262 1.00 0.00 C ATOM 0 H LEU A 76 -10.688 5.031 9.770 1.00 0.00 H new ATOM 0 HA LEU A 76 -10.757 7.456 11.293 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -9.256 4.855 11.755 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -9.551 6.100 12.953 1.00 0.00 H new ATOM 0 HG LEU A 76 -11.794 4.603 11.581 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -11.895 3.182 13.591 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -10.358 2.980 12.716 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -10.413 3.953 14.205 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -13.082 5.344 13.546 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -11.646 6.199 14.159 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -12.411 6.721 12.639 1.00 0.00 H new ATOM 1122 N SER A 77 -7.803 6.401 10.215 1.00 0.00 N ATOM 1123 CA SER A 77 -6.453 6.843 9.885 1.00 0.00 C ATOM 1124 C SER A 77 -6.490 8.096 9.015 1.00 0.00 C ATOM 1125 O SER A 77 -5.603 8.946 9.093 1.00 0.00 O ATOM 1126 CB SER A 77 -5.691 5.730 9.164 1.00 0.00 C ATOM 1127 OG SER A 77 -5.827 4.495 9.845 1.00 0.00 O ATOM 0 H SER A 77 -7.963 5.402 10.085 1.00 0.00 H new ATOM 0 HA SER A 77 -5.938 7.082 10.815 1.00 0.00 H new ATOM 0 HB2 SER A 77 -6.065 5.630 8.145 1.00 0.00 H new ATOM 0 HB3 SER A 77 -4.636 5.995 9.092 1.00 0.00 H new ATOM 0 HG SER A 77 -6.521 3.957 9.411 1.00 0.00 H new ATOM 1133 N SER A 78 -7.524 8.203 8.186 1.00 0.00 N ATOM 1134 CA SER A 78 -7.676 9.349 7.297 1.00 0.00 C ATOM 1135 C SER A 78 -7.927 10.625 8.095 1.00 0.00 C ATOM 1136 O SER A 78 -7.245 11.632 7.905 1.00 0.00 O ATOM 1137 CB SER A 78 -8.827 9.113 6.317 1.00 0.00 C ATOM 1138 OG SER A 78 -8.407 8.322 5.219 1.00 0.00 O ATOM 0 H SER A 78 -8.269 7.510 8.112 1.00 0.00 H new ATOM 0 HA SER A 78 -6.749 9.467 6.736 1.00 0.00 H new ATOM 0 HB2 SER A 78 -9.651 8.619 6.831 1.00 0.00 H new ATOM 0 HB3 SER A 78 -9.204 10.070 5.957 1.00 0.00 H new ATOM 0 HG SER A 78 -8.635 7.384 5.385 1.00 0.00 H new ATOM 1144 N GLN A 79 -8.910 10.574 8.988 1.00 0.00 N ATOM 1145 CA GLN A 79 -9.252 11.726 9.814 1.00 0.00 C ATOM 1146 C GLN A 79 -8.032 12.228 10.579 1.00 0.00 C ATOM 1147 O GLN A 79 -7.892 13.425 10.825 1.00 0.00 O ATOM 1148 CB GLN A 79 -10.369 11.363 10.794 1.00 0.00 C ATOM 1149 CG GLN A 79 -11.654 10.918 10.114 1.00 0.00 C ATOM 1150 CD GLN A 79 -12.528 10.070 11.017 1.00 0.00 C ATOM 1151 OE1 GLN A 79 -12.238 9.902 12.202 1.00 0.00 O ATOM 1152 NE2 GLN A 79 -13.606 9.531 10.460 1.00 0.00 N ATOM 0 H GLN A 79 -9.483 9.748 9.158 1.00 0.00 H new ATOM 0 HA GLN A 79 -9.599 12.523 9.157 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -10.020 10.566 11.450 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -10.582 12.226 11.425 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -12.214 11.796 9.793 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -11.408 10.351 9.216 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -13.808 9.697 9.474 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -14.233 8.951 11.018 1.00 0.00 H new ATOM 1161 N GLU A 80 -7.152 11.304 10.954 1.00 0.00 N ATOM 1162 CA GLU A 80 -5.945 11.654 11.692 1.00 0.00 C ATOM 1163 C GLU A 80 -5.035 12.548 10.854 1.00 0.00 C ATOM 1164 O GLU A 80 -4.784 13.700 11.205 1.00 0.00 O ATOM 1165 CB GLU A 80 -5.192 10.390 12.111 1.00 0.00 C ATOM 1166 CG GLU A 80 -5.766 9.721 13.349 1.00 0.00 C ATOM 1167 CD GLU A 80 -5.121 8.380 13.640 1.00 0.00 C ATOM 1168 OE1 GLU A 80 -4.730 7.688 12.677 1.00 0.00 O ATOM 1169 OE2 GLU A 80 -5.006 8.024 14.832 1.00 0.00 O ATOM 0 H GLU A 80 -7.253 10.308 10.759 1.00 0.00 H new ATOM 0 HA GLU A 80 -6.242 12.203 12.585 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -5.205 9.679 11.285 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -4.148 10.644 12.296 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -5.632 10.378 14.208 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -6.839 9.583 13.218 1.00 0.00 H new ATOM 1176 N ALA A 81 -4.542 12.006 9.745 1.00 0.00 N ATOM 1177 CA ALA A 81 -3.661 12.753 8.856 1.00 0.00 C ATOM 1178 C ALA A 81 -4.242 14.126 8.534 1.00 0.00 C ATOM 1179 O ALA A 81 -3.523 15.125 8.513 1.00 0.00 O ATOM 1180 CB ALA A 81 -3.415 11.969 7.575 1.00 0.00 C ATOM 0 H ALA A 81 -4.738 11.052 9.441 1.00 0.00 H new ATOM 0 HA ALA A 81 -2.710 12.900 9.367 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -2.755 12.539 6.921 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -2.949 11.014 7.817 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -4.364 11.792 7.069 1.00 0.00 H new ATOM 1186 N ALA A 82 -5.546 14.168 8.284 1.00 0.00 N ATOM 1187 CA ALA A 82 -6.223 15.419 7.965 1.00 0.00 C ATOM 1188 C ALA A 82 -5.881 16.503 8.981 1.00 0.00 C ATOM 1189 O ALA A 82 -5.818 17.685 8.645 1.00 0.00 O ATOM 1190 CB ALA A 82 -7.728 15.204 7.905 1.00 0.00 C ATOM 0 H ALA A 82 -6.155 13.350 8.296 1.00 0.00 H new ATOM 0 HA ALA A 82 -5.876 15.752 6.987 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -8.221 16.146 7.666 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -7.960 14.468 7.135 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -8.083 14.844 8.871 1.00 0.00 H new ATOM 1196 N SER A 83 -5.662 16.092 10.227 1.00 0.00 N ATOM 1197 CA SER A 83 -5.332 17.029 11.294 1.00 0.00 C ATOM 1198 C SER A 83 -3.822 17.107 11.500 1.00 0.00 C ATOM 1199 O SER A 83 -3.257 18.193 11.628 1.00 0.00 O ATOM 1200 CB SER A 83 -6.015 16.613 12.597 1.00 0.00 C ATOM 1201 OG SER A 83 -5.722 17.525 13.641 1.00 0.00 O ATOM 0 H SER A 83 -5.707 15.116 10.521 1.00 0.00 H new ATOM 0 HA SER A 83 -5.693 18.015 11.002 1.00 0.00 H new ATOM 0 HB2 SER A 83 -7.093 16.563 12.446 1.00 0.00 H new ATOM 0 HB3 SER A 83 -5.686 15.613 12.880 1.00 0.00 H new ATOM 0 HG SER A 83 -6.172 17.237 14.463 1.00 0.00 H new ATOM 1207 N SER A 84 -3.175 15.946 11.531 1.00 0.00 N ATOM 1208 CA SER A 84 -1.731 15.880 11.726 1.00 0.00 C ATOM 1209 C SER A 84 -1.016 16.887 10.830 1.00 0.00 C ATOM 1210 O SER A 84 -0.386 17.827 11.313 1.00 0.00 O ATOM 1211 CB SER A 84 -1.220 14.468 11.436 1.00 0.00 C ATOM 1212 OG SER A 84 -0.075 14.170 12.216 1.00 0.00 O ATOM 0 H SER A 84 -3.628 15.038 11.424 1.00 0.00 H new ATOM 0 HA SER A 84 -1.517 16.129 12.765 1.00 0.00 H new ATOM 0 HB2 SER A 84 -2.006 13.743 11.647 1.00 0.00 H new ATOM 0 HB3 SER A 84 -0.977 14.376 10.377 1.00 0.00 H new ATOM 0 HG SER A 84 0.231 13.261 12.013 1.00 0.00 H new ATOM 1218 N PHE A 85 -1.119 16.681 9.521 1.00 0.00 N ATOM 1219 CA PHE A 85 -0.481 17.569 8.555 1.00 0.00 C ATOM 1220 C PHE A 85 -1.514 18.458 7.870 1.00 0.00 C ATOM 1221 O PHE A 85 -1.315 19.664 7.728 1.00 0.00 O ATOM 1222 CB PHE A 85 0.282 16.755 7.509 1.00 0.00 C ATOM 1223 CG PHE A 85 1.343 15.868 8.096 1.00 0.00 C ATOM 1224 CD1 PHE A 85 1.014 14.632 8.630 1.00 0.00 C ATOM 1225 CD2 PHE A 85 2.669 16.269 8.113 1.00 0.00 C ATOM 1226 CE1 PHE A 85 1.988 13.815 9.171 1.00 0.00 C ATOM 1227 CE2 PHE A 85 3.647 15.456 8.653 1.00 0.00 C ATOM 1228 CZ PHE A 85 3.306 14.227 9.182 1.00 0.00 C ATOM 0 H PHE A 85 -1.638 15.908 9.105 1.00 0.00 H new ATOM 0 HA PHE A 85 0.222 18.206 9.092 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -0.425 16.141 6.951 1.00 0.00 H new ATOM 0 HB3 PHE A 85 0.744 17.437 6.796 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -0.015 14.304 8.623 1.00 0.00 H new ATOM 0 HD2 PHE A 85 2.942 17.229 7.699 1.00 0.00 H new ATOM 0 HE1 PHE A 85 1.719 12.855 9.585 1.00 0.00 H new ATOM 0 HE2 PHE A 85 4.677 15.781 8.661 1.00 0.00 H new ATOM 0 HZ PHE A 85 4.069 13.589 9.604 1.00 0.00 H new ATOM 1238 N GLY A 86 -2.620 17.853 7.446 1.00 0.00 N ATOM 1239 CA GLY A 86 -3.668 18.604 6.780 1.00 0.00 C ATOM 1240 C GLY A 86 -4.405 17.778 5.745 1.00 0.00 C ATOM 1241 O GLY A 86 -5.594 17.989 5.504 1.00 0.00 O ATOM 0 H GLY A 86 -2.809 16.856 7.552 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -4.378 18.968 7.523 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -3.233 19.480 6.299 1.00 0.00 H new ATOM 1245 N ASP A 87 -3.699 16.835 5.130 1.00 0.00 N ATOM 1246 CA ASP A 87 -4.294 15.974 4.115 1.00 0.00 C ATOM 1247 C ASP A 87 -4.742 14.648 4.721 1.00 0.00 C ATOM 1248 O ASP A 87 -4.242 14.232 5.767 1.00 0.00 O ATOM 1249 CB ASP A 87 -3.297 15.721 2.983 1.00 0.00 C ATOM 1250 CG ASP A 87 -3.185 16.899 2.035 1.00 0.00 C ATOM 1251 OD1 ASP A 87 -4.222 17.539 1.760 1.00 0.00 O ATOM 1252 OD2 ASP A 87 -2.062 17.181 1.568 1.00 0.00 O ATOM 0 H ASP A 87 -2.714 16.648 5.317 1.00 0.00 H new ATOM 0 HA ASP A 87 -5.170 16.482 3.711 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -2.317 15.506 3.408 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -3.603 14.837 2.424 1.00 0.00 H new ATOM 1257 N ASP A 88 -5.686 13.989 4.059 1.00 0.00 N ATOM 1258 CA ASP A 88 -6.202 12.710 4.532 1.00 0.00 C ATOM 1259 C ASP A 88 -5.591 11.554 3.747 1.00 0.00 C ATOM 1260 O ASP A 88 -6.201 10.494 3.608 1.00 0.00 O ATOM 1261 CB ASP A 88 -7.726 12.675 4.413 1.00 0.00 C ATOM 1262 CG ASP A 88 -8.190 12.198 3.051 1.00 0.00 C ATOM 1263 OD1 ASP A 88 -7.818 12.833 2.042 1.00 0.00 O ATOM 1264 OD2 ASP A 88 -8.923 11.189 2.994 1.00 0.00 O ATOM 0 H ASP A 88 -6.110 14.320 3.192 1.00 0.00 H new ATOM 0 HA ASP A 88 -5.925 12.600 5.580 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -8.133 12.019 5.182 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -8.125 13.672 4.601 1.00 0.00 H new ATOM 1269 N ARG A 89 -4.383 11.766 3.234 1.00 0.00 N ATOM 1270 CA ARG A 89 -3.691 10.742 2.461 1.00 0.00 C ATOM 1271 C ARG A 89 -3.299 9.563 3.347 1.00 0.00 C ATOM 1272 O ARG A 89 -3.013 9.732 4.533 1.00 0.00 O ATOM 1273 CB ARG A 89 -2.445 11.331 1.796 1.00 0.00 C ATOM 1274 CG ARG A 89 -2.725 12.577 0.972 1.00 0.00 C ATOM 1275 CD ARG A 89 -3.102 12.225 -0.459 1.00 0.00 C ATOM 1276 NE ARG A 89 -3.914 13.266 -1.083 1.00 0.00 N ATOM 1277 CZ ARG A 89 -4.223 13.282 -2.374 1.00 0.00 C ATOM 1278 NH1 ARG A 89 -3.791 12.317 -3.175 1.00 0.00 N ATOM 1279 NH2 ARG A 89 -4.966 14.264 -2.868 1.00 0.00 N ATOM 0 H ARG A 89 -3.864 12.638 3.340 1.00 0.00 H new ATOM 0 HA ARG A 89 -4.372 10.383 1.689 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -1.712 11.572 2.566 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -1.995 10.574 1.153 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -3.533 13.146 1.433 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -1.844 13.219 0.970 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -2.196 12.072 -1.045 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -3.651 11.283 -0.468 1.00 0.00 H new ATOM 0 HE ARG A 89 -4.263 14.023 -0.495 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -3.220 11.560 -2.799 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -4.030 12.332 -4.166 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -5.301 15.008 -2.256 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -5.203 14.275 -3.860 1.00 0.00 H new ATOM 1293 N LEU A 90 -3.290 8.370 2.763 1.00 0.00 N ATOM 1294 CA LEU A 90 -2.934 7.162 3.500 1.00 0.00 C ATOM 1295 C LEU A 90 -2.004 6.276 2.676 1.00 0.00 C ATOM 1296 O LEU A 90 -1.719 6.569 1.514 1.00 0.00 O ATOM 1297 CB LEU A 90 -4.194 6.382 3.880 1.00 0.00 C ATOM 1298 CG LEU A 90 -5.019 6.961 5.030 1.00 0.00 C ATOM 1299 CD1 LEU A 90 -6.248 6.103 5.289 1.00 0.00 C ATOM 1300 CD2 LEU A 90 -4.172 7.077 6.289 1.00 0.00 C ATOM 0 H LEU A 90 -3.525 8.213 1.783 1.00 0.00 H new ATOM 0 HA LEU A 90 -2.411 7.461 4.409 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -4.833 6.312 3.000 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -3.902 5.365 4.144 1.00 0.00 H new ATOM 0 HG LEU A 90 -5.351 7.960 4.747 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -6.823 6.530 6.111 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -6.866 6.072 4.391 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -5.937 5.092 5.551 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -4.776 7.491 7.097 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -3.810 6.090 6.576 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -3.323 7.734 6.097 1.00 0.00 H new ATOM 1312 N LEU A 91 -1.536 5.192 3.284 1.00 0.00 N ATOM 1313 CA LEU A 91 -0.639 4.262 2.607 1.00 0.00 C ATOM 1314 C LEU A 91 -0.913 2.826 3.044 1.00 0.00 C ATOM 1315 O LEU A 91 -1.541 2.591 4.076 1.00 0.00 O ATOM 1316 CB LEU A 91 0.818 4.626 2.894 1.00 0.00 C ATOM 1317 CG LEU A 91 1.293 5.975 2.353 1.00 0.00 C ATOM 1318 CD1 LEU A 91 2.639 6.347 2.953 1.00 0.00 C ATOM 1319 CD2 LEU A 91 1.374 5.941 0.834 1.00 0.00 C ATOM 0 H LEU A 91 -1.763 4.935 4.245 1.00 0.00 H new ATOM 0 HA LEU A 91 -0.820 4.337 1.535 1.00 0.00 H new ATOM 0 HB2 LEU A 91 0.968 4.617 3.974 1.00 0.00 H new ATOM 0 HB3 LEU A 91 1.455 3.846 2.478 1.00 0.00 H new ATOM 0 HG LEU A 91 0.568 6.736 2.641 1.00 0.00 H new ATOM 0 HD11 LEU A 91 2.961 7.310 2.556 1.00 0.00 H new ATOM 0 HD12 LEU A 91 2.548 6.413 4.037 1.00 0.00 H new ATOM 0 HD13 LEU A 91 3.375 5.585 2.697 1.00 0.00 H new ATOM 0 HD21 LEU A 91 1.714 6.909 0.466 1.00 0.00 H new ATOM 0 HD22 LEU A 91 2.077 5.168 0.524 1.00 0.00 H new ATOM 0 HD23 LEU A 91 0.389 5.721 0.422 1.00 0.00 H new ATOM 1331 N ILE A 92 -0.434 1.871 2.254 1.00 0.00 N ATOM 1332 CA ILE A 92 -0.625 0.459 2.561 1.00 0.00 C ATOM 1333 C ILE A 92 0.628 -0.348 2.236 1.00 0.00 C ATOM 1334 O ILE A 92 1.073 -0.386 1.090 1.00 0.00 O ATOM 1335 CB ILE A 92 -1.817 -0.131 1.785 1.00 0.00 C ATOM 1336 CG1 ILE A 92 -3.039 0.781 1.916 1.00 0.00 C ATOM 1337 CG2 ILE A 92 -2.137 -1.530 2.290 1.00 0.00 C ATOM 1338 CD1 ILE A 92 -4.261 0.260 1.192 1.00 0.00 C ATOM 0 H ILE A 92 0.089 2.049 1.397 1.00 0.00 H new ATOM 0 HA ILE A 92 -0.830 0.394 3.629 1.00 0.00 H new ATOM 0 HB ILE A 92 -1.548 -0.199 0.731 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -3.278 0.906 2.972 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -2.789 1.768 1.527 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -2.982 -1.934 1.732 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -1.269 -2.174 2.151 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -2.390 -1.485 3.349 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -5.089 0.956 1.328 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -4.040 0.162 0.129 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -4.536 -0.714 1.597 1.00 0.00 H new ATOM 1350 N GLU A 93 1.190 -0.993 3.254 1.00 0.00 N ATOM 1351 CA GLU A 93 2.391 -1.800 3.075 1.00 0.00 C ATOM 1352 C GLU A 93 2.261 -3.137 3.800 1.00 0.00 C ATOM 1353 O GLU A 93 1.718 -3.208 4.903 1.00 0.00 O ATOM 1354 CB GLU A 93 3.620 -1.047 3.589 1.00 0.00 C ATOM 1355 CG GLU A 93 3.891 0.252 2.849 1.00 0.00 C ATOM 1356 CD GLU A 93 5.357 0.640 2.869 1.00 0.00 C ATOM 1357 OE1 GLU A 93 5.890 0.885 3.972 1.00 0.00 O ATOM 1358 OE2 GLU A 93 5.971 0.700 1.784 1.00 0.00 O ATOM 0 H GLU A 93 0.833 -0.972 4.209 1.00 0.00 H new ATOM 0 HA GLU A 93 2.512 -1.994 2.009 1.00 0.00 H new ATOM 0 HB2 GLU A 93 3.486 -0.830 4.649 1.00 0.00 H new ATOM 0 HB3 GLU A 93 4.494 -1.693 3.504 1.00 0.00 H new ATOM 0 HG2 GLU A 93 3.559 0.153 1.815 1.00 0.00 H new ATOM 0 HG3 GLU A 93 3.301 1.051 3.298 1.00 0.00 H new ATOM 1365 N LYS A 94 2.763 -4.195 3.172 1.00 0.00 N ATOM 1366 CA LYS A 94 2.704 -5.530 3.754 1.00 0.00 C ATOM 1367 C LYS A 94 3.216 -5.520 5.191 1.00 0.00 C ATOM 1368 O LYS A 94 4.311 -5.029 5.467 1.00 0.00 O ATOM 1369 CB LYS A 94 3.526 -6.511 2.916 1.00 0.00 C ATOM 1370 CG LYS A 94 3.742 -7.855 3.590 1.00 0.00 C ATOM 1371 CD LYS A 94 2.533 -8.761 3.429 1.00 0.00 C ATOM 1372 CE LYS A 94 2.934 -10.228 3.417 1.00 0.00 C ATOM 1373 NZ LYS A 94 3.825 -10.551 2.269 1.00 0.00 N ATOM 0 H LYS A 94 3.216 -4.153 2.259 1.00 0.00 H new ATOM 0 HA LYS A 94 1.662 -5.851 3.760 1.00 0.00 H new ATOM 0 HB2 LYS A 94 3.024 -6.669 1.961 1.00 0.00 H new ATOM 0 HB3 LYS A 94 4.496 -6.064 2.696 1.00 0.00 H new ATOM 0 HG2 LYS A 94 4.620 -8.340 3.164 1.00 0.00 H new ATOM 0 HG3 LYS A 94 3.945 -7.703 4.650 1.00 0.00 H new ATOM 0 HD2 LYS A 94 1.831 -8.581 4.243 1.00 0.00 H new ATOM 0 HD3 LYS A 94 2.015 -8.517 2.502 1.00 0.00 H new ATOM 0 HE2 LYS A 94 3.441 -10.473 4.350 1.00 0.00 H new ATOM 0 HE3 LYS A 94 2.039 -10.848 3.368 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 3.677 -11.540 1.983 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 3.604 -9.923 1.470 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 4.817 -10.417 2.551 1.00 0.00 H new ATOM 1387 N PHE A 95 2.418 -6.065 6.103 1.00 0.00 N ATOM 1388 CA PHE A 95 2.791 -6.118 7.512 1.00 0.00 C ATOM 1389 C PHE A 95 3.461 -7.447 7.846 1.00 0.00 C ATOM 1390 O PHE A 95 2.803 -8.485 7.920 1.00 0.00 O ATOM 1391 CB PHE A 95 1.558 -5.919 8.396 1.00 0.00 C ATOM 1392 CG PHE A 95 1.840 -6.078 9.862 1.00 0.00 C ATOM 1393 CD1 PHE A 95 1.867 -7.335 10.444 1.00 0.00 C ATOM 1394 CD2 PHE A 95 2.077 -4.970 10.659 1.00 0.00 C ATOM 1395 CE1 PHE A 95 2.126 -7.484 11.793 1.00 0.00 C ATOM 1396 CE2 PHE A 95 2.337 -5.113 12.010 1.00 0.00 C ATOM 1397 CZ PHE A 95 2.362 -6.371 12.577 1.00 0.00 C ATOM 0 H PHE A 95 1.509 -6.476 5.892 1.00 0.00 H new ATOM 0 HA PHE A 95 3.501 -5.314 7.705 1.00 0.00 H new ATOM 0 HB2 PHE A 95 1.150 -4.924 8.218 1.00 0.00 H new ATOM 0 HB3 PHE A 95 0.791 -6.635 8.102 1.00 0.00 H new ATOM 0 HD1 PHE A 95 1.683 -8.209 9.836 1.00 0.00 H new ATOM 0 HD2 PHE A 95 2.059 -3.983 10.220 1.00 0.00 H new ATOM 0 HE1 PHE A 95 2.144 -8.470 12.234 1.00 0.00 H new ATOM 0 HE2 PHE A 95 2.520 -4.241 12.620 1.00 0.00 H new ATOM 0 HZ PHE A 95 2.566 -6.485 13.631 1.00 0.00 H new ATOM 1407 N ILE A 96 4.774 -7.407 8.047 1.00 0.00 N ATOM 1408 CA ILE A 96 5.534 -8.607 8.374 1.00 0.00 C ATOM 1409 C ILE A 96 6.249 -8.457 9.713 1.00 0.00 C ATOM 1410 O ILE A 96 7.325 -7.864 9.791 1.00 0.00 O ATOM 1411 CB ILE A 96 6.572 -8.930 7.284 1.00 0.00 C ATOM 1412 CG1 ILE A 96 5.919 -8.898 5.901 1.00 0.00 C ATOM 1413 CG2 ILE A 96 7.208 -10.288 7.544 1.00 0.00 C ATOM 1414 CD1 ILE A 96 6.812 -9.423 4.798 1.00 0.00 C ATOM 0 H ILE A 96 5.334 -6.556 7.989 1.00 0.00 H new ATOM 0 HA ILE A 96 4.818 -9.427 8.437 1.00 0.00 H new ATOM 0 HB ILE A 96 7.355 -8.172 7.313 1.00 0.00 H new ATOM 0 HG12 ILE A 96 5.003 -9.488 5.927 1.00 0.00 H new ATOM 0 HG13 ILE A 96 5.632 -7.873 5.668 1.00 0.00 H new ATOM 0 HG21 ILE A 96 7.940 -10.502 6.765 1.00 0.00 H new ATOM 0 HG22 ILE A 96 7.704 -10.278 8.515 1.00 0.00 H new ATOM 0 HG23 ILE A 96 6.437 -11.058 7.539 1.00 0.00 H new ATOM 0 HD11 ILE A 96 6.284 -9.370 3.846 1.00 0.00 H new ATOM 0 HD12 ILE A 96 7.718 -8.819 4.744 1.00 0.00 H new ATOM 0 HD13 ILE A 96 7.079 -10.459 5.008 1.00 0.00 H new ATOM 1426 N ASP A 97 5.644 -9.000 10.764 1.00 0.00 N ATOM 1427 CA ASP A 97 6.224 -8.930 12.100 1.00 0.00 C ATOM 1428 C ASP A 97 7.246 -10.043 12.308 1.00 0.00 C ATOM 1429 O ASP A 97 7.373 -10.585 13.405 1.00 0.00 O ATOM 1430 CB ASP A 97 5.127 -9.023 13.161 1.00 0.00 C ATOM 1431 CG ASP A 97 5.684 -9.042 14.571 1.00 0.00 C ATOM 1432 OD1 ASP A 97 6.388 -8.079 14.944 1.00 0.00 O ATOM 1433 OD2 ASP A 97 5.416 -10.018 15.302 1.00 0.00 O ATOM 0 H ASP A 97 4.752 -9.493 10.716 1.00 0.00 H new ATOM 0 HA ASP A 97 6.733 -7.971 12.198 1.00 0.00 H new ATOM 0 HB2 ASP A 97 4.449 -8.177 13.053 1.00 0.00 H new ATOM 0 HB3 ASP A 97 4.539 -9.926 12.994 1.00 0.00 H new ATOM 1438 N ASN A 98 7.972 -10.380 11.247 1.00 0.00 N ATOM 1439 CA ASN A 98 8.981 -11.430 11.313 1.00 0.00 C ATOM 1440 C ASN A 98 10.005 -11.272 10.193 1.00 0.00 C ATOM 1441 O ASN A 98 9.745 -10.647 9.164 1.00 0.00 O ATOM 1442 CB ASN A 98 8.321 -12.807 11.225 1.00 0.00 C ATOM 1443 CG ASN A 98 7.928 -13.348 12.587 1.00 0.00 C ATOM 1444 OD1 ASN A 98 8.776 -13.538 13.459 1.00 0.00 O ATOM 1445 ND2 ASN A 98 6.638 -13.599 12.774 1.00 0.00 N ATOM 0 H ASN A 98 7.880 -9.941 10.331 1.00 0.00 H new ATOM 0 HA ASN A 98 9.498 -11.343 12.269 1.00 0.00 H new ATOM 0 HB2 ASN A 98 7.435 -12.743 10.593 1.00 0.00 H new ATOM 0 HB3 ASN A 98 9.006 -13.505 10.744 1.00 0.00 H new ATOM 0 HD21 ASN A 98 6.314 -13.965 13.669 1.00 0.00 H new ATOM 0 HD22 ASN A 98 5.971 -13.426 12.022 1.00 0.00 H new ATOM 1452 N PRO A 99 11.197 -11.852 10.394 1.00 0.00 N ATOM 1453 CA PRO A 99 12.283 -11.791 9.412 1.00 0.00 C ATOM 1454 C PRO A 99 11.984 -12.615 8.164 1.00 0.00 C ATOM 1455 O PRO A 99 12.763 -12.621 7.211 1.00 0.00 O ATOM 1456 CB PRO A 99 13.478 -12.379 10.167 1.00 0.00 C ATOM 1457 CG PRO A 99 12.873 -13.264 11.202 1.00 0.00 C ATOM 1458 CD PRO A 99 11.576 -12.613 11.596 1.00 0.00 C ATOM 0 HA PRO A 99 12.447 -10.776 9.050 1.00 0.00 H new ATOM 0 HB2 PRO A 99 14.131 -12.940 9.499 1.00 0.00 H new ATOM 0 HB3 PRO A 99 14.084 -11.595 10.621 1.00 0.00 H new ATOM 0 HG2 PRO A 99 12.703 -14.266 10.808 1.00 0.00 H new ATOM 0 HG3 PRO A 99 13.535 -13.368 12.062 1.00 0.00 H new ATOM 0 HD2 PRO A 99 10.819 -13.352 11.859 1.00 0.00 H new ATOM 0 HD3 PRO A 99 11.700 -11.962 12.461 1.00 0.00 H new ATOM 1466 N ARG A 100 10.850 -13.308 8.176 1.00 0.00 N ATOM 1467 CA ARG A 100 10.448 -14.136 7.045 1.00 0.00 C ATOM 1468 C ARG A 100 10.655 -13.394 5.728 1.00 0.00 C ATOM 1469 O ARG A 100 10.525 -12.171 5.665 1.00 0.00 O ATOM 1470 CB ARG A 100 8.982 -14.550 7.185 1.00 0.00 C ATOM 1471 CG ARG A 100 8.604 -15.747 6.328 1.00 0.00 C ATOM 1472 CD ARG A 100 7.115 -15.762 6.018 1.00 0.00 C ATOM 1473 NE ARG A 100 6.750 -16.868 5.137 1.00 0.00 N ATOM 1474 CZ ARG A 100 6.663 -18.131 5.541 1.00 0.00 C ATOM 1475 NH1 ARG A 100 6.913 -18.445 6.805 1.00 0.00 N ATOM 1476 NH2 ARG A 100 6.325 -19.082 4.680 1.00 0.00 N ATOM 0 H ARG A 100 10.193 -13.313 8.956 1.00 0.00 H new ATOM 0 HA ARG A 100 11.072 -15.030 7.040 1.00 0.00 H new ATOM 0 HB2 ARG A 100 8.777 -14.782 8.230 1.00 0.00 H new ATOM 0 HB3 ARG A 100 8.347 -13.706 6.916 1.00 0.00 H new ATOM 0 HG2 ARG A 100 9.170 -15.723 5.397 1.00 0.00 H new ATOM 0 HG3 ARG A 100 8.879 -16.667 6.844 1.00 0.00 H new ATOM 0 HD2 ARG A 100 6.552 -15.839 6.948 1.00 0.00 H new ATOM 0 HD3 ARG A 100 6.832 -14.818 5.551 1.00 0.00 H new ATOM 0 HE ARG A 100 6.551 -16.660 4.158 1.00 0.00 H new ATOM 0 HH11 ARG A 100 7.173 -17.716 7.470 1.00 0.00 H new ATOM 0 HH12 ARG A 100 6.845 -19.415 7.112 1.00 0.00 H new ATOM 0 HH21 ARG A 100 6.132 -18.844 3.707 1.00 0.00 H new ATOM 0 HH22 ARG A 100 6.258 -20.051 4.991 1.00 0.00 H new ATOM 1490 N HIS A 101 10.979 -14.142 4.678 1.00 0.00 N ATOM 1491 CA HIS A 101 11.204 -13.555 3.362 1.00 0.00 C ATOM 1492 C HIS A 101 10.775 -14.517 2.258 1.00 0.00 C ATOM 1493 O HIS A 101 10.893 -15.734 2.402 1.00 0.00 O ATOM 1494 CB HIS A 101 12.678 -13.187 3.189 1.00 0.00 C ATOM 1495 CG HIS A 101 13.595 -14.371 3.190 1.00 0.00 C ATOM 1496 ND1 HIS A 101 14.544 -14.588 2.213 1.00 0.00 N ATOM 1497 CD2 HIS A 101 13.706 -15.405 4.056 1.00 0.00 C ATOM 1498 CE1 HIS A 101 15.197 -15.705 2.477 1.00 0.00 C ATOM 1499 NE2 HIS A 101 14.709 -16.220 3.591 1.00 0.00 N ATOM 0 H HIS A 101 11.092 -15.155 4.713 1.00 0.00 H new ATOM 0 HA HIS A 101 10.601 -12.650 3.287 1.00 0.00 H new ATOM 0 HB2 HIS A 101 12.801 -12.644 2.252 1.00 0.00 H new ATOM 0 HB3 HIS A 101 12.971 -12.510 3.991 1.00 0.00 H new ATOM 0 HD2 HIS A 101 13.116 -15.560 4.947 1.00 0.00 H new ATOM 0 HE1 HIS A 101 15.995 -16.126 1.883 1.00 0.00 H new ATOM 0 HE2 HIS A 101 15.025 -17.083 4.034 1.00 0.00 H new ATOM 1508 N ILE A 102 10.277 -13.963 1.157 1.00 0.00 N ATOM 1509 CA ILE A 102 9.832 -14.773 0.030 1.00 0.00 C ATOM 1510 C ILE A 102 10.838 -14.722 -1.115 1.00 0.00 C ATOM 1511 O ILE A 102 11.567 -13.742 -1.271 1.00 0.00 O ATOM 1512 CB ILE A 102 8.458 -14.308 -0.488 1.00 0.00 C ATOM 1513 CG1 ILE A 102 8.079 -15.078 -1.755 1.00 0.00 C ATOM 1514 CG2 ILE A 102 8.471 -12.811 -0.755 1.00 0.00 C ATOM 1515 CD1 ILE A 102 6.626 -14.925 -2.144 1.00 0.00 C ATOM 0 H ILE A 102 10.172 -12.957 1.022 1.00 0.00 H new ATOM 0 HA ILE A 102 9.748 -15.798 0.391 1.00 0.00 H new ATOM 0 HB ILE A 102 7.709 -14.514 0.277 1.00 0.00 H new ATOM 0 HG12 ILE A 102 8.705 -14.736 -2.579 1.00 0.00 H new ATOM 0 HG13 ILE A 102 8.297 -16.136 -1.606 1.00 0.00 H new ATOM 0 HG21 ILE A 102 7.493 -12.498 -1.120 1.00 0.00 H new ATOM 0 HG22 ILE A 102 8.701 -12.279 0.168 1.00 0.00 H new ATOM 0 HG23 ILE A 102 9.229 -12.582 -1.504 1.00 0.00 H new ATOM 0 HD11 ILE A 102 6.430 -15.498 -3.050 1.00 0.00 H new ATOM 0 HD12 ILE A 102 5.993 -15.294 -1.337 1.00 0.00 H new ATOM 0 HD13 ILE A 102 6.407 -13.873 -2.325 1.00 0.00 H new ATOM 1527 N SER A 103 10.870 -15.783 -1.914 1.00 0.00 N ATOM 1528 CA SER A 103 11.788 -15.861 -3.045 1.00 0.00 C ATOM 1529 C SER A 103 11.044 -16.226 -4.325 1.00 0.00 C ATOM 1530 O SER A 103 9.917 -16.718 -4.282 1.00 0.00 O ATOM 1531 CB SER A 103 12.886 -16.890 -2.768 1.00 0.00 C ATOM 1532 OG SER A 103 14.005 -16.681 -3.611 1.00 0.00 O ATOM 0 H SER A 103 10.271 -16.601 -1.800 1.00 0.00 H new ATOM 0 HA SER A 103 12.245 -14.880 -3.179 1.00 0.00 H new ATOM 0 HB2 SER A 103 13.195 -16.824 -1.725 1.00 0.00 H new ATOM 0 HB3 SER A 103 12.494 -17.895 -2.922 1.00 0.00 H new ATOM 0 HG SER A 103 14.693 -17.350 -3.413 1.00 0.00 H new ATOM 1538 N GLY A 104 11.684 -15.982 -5.465 1.00 0.00 N ATOM 1539 CA GLY A 104 11.068 -16.291 -6.742 1.00 0.00 C ATOM 1540 C GLY A 104 10.572 -15.052 -7.461 1.00 0.00 C ATOM 1541 O GLY A 104 9.393 -14.701 -7.396 1.00 0.00 O ATOM 0 H GLY A 104 12.618 -15.576 -5.527 1.00 0.00 H new ATOM 0 HA2 GLY A 104 11.789 -16.810 -7.374 1.00 0.00 H new ATOM 0 HA3 GLY A 104 10.233 -16.974 -6.584 1.00 0.00 H new ATOM 1545 N PRO A 105 11.484 -14.366 -8.166 1.00 0.00 N ATOM 1546 CA PRO A 105 11.155 -13.148 -8.913 1.00 0.00 C ATOM 1547 C PRO A 105 10.285 -13.433 -10.132 1.00 0.00 C ATOM 1548 O PRO A 105 9.583 -12.550 -10.625 1.00 0.00 O ATOM 1549 CB PRO A 105 12.524 -12.618 -9.346 1.00 0.00 C ATOM 1550 CG PRO A 105 13.403 -13.820 -9.380 1.00 0.00 C ATOM 1551 CD PRO A 105 12.906 -14.727 -8.288 1.00 0.00 C ATOM 0 HA PRO A 105 10.580 -12.444 -8.312 1.00 0.00 H new ATOM 0 HB2 PRO A 105 12.472 -12.138 -10.323 1.00 0.00 H new ATOM 0 HB3 PRO A 105 12.900 -11.873 -8.645 1.00 0.00 H new ATOM 0 HG2 PRO A 105 13.352 -14.313 -10.351 1.00 0.00 H new ATOM 0 HG3 PRO A 105 14.445 -13.546 -9.216 1.00 0.00 H new ATOM 0 HD2 PRO A 105 13.033 -15.778 -8.549 1.00 0.00 H new ATOM 0 HD3 PRO A 105 13.444 -14.564 -7.354 1.00 0.00 H new ATOM 1559 N SER A 106 10.334 -14.671 -10.612 1.00 0.00 N ATOM 1560 CA SER A 106 9.552 -15.071 -11.776 1.00 0.00 C ATOM 1561 C SER A 106 8.113 -14.579 -11.659 1.00 0.00 C ATOM 1562 O SER A 106 7.590 -14.410 -10.557 1.00 0.00 O ATOM 1563 CB SER A 106 9.571 -16.593 -11.932 1.00 0.00 C ATOM 1564 OG SER A 106 8.919 -16.992 -13.125 1.00 0.00 O ATOM 0 H SER A 106 10.907 -15.415 -10.213 1.00 0.00 H new ATOM 0 HA SER A 106 10.003 -14.617 -12.658 1.00 0.00 H new ATOM 0 HB2 SER A 106 10.602 -16.948 -11.941 1.00 0.00 H new ATOM 0 HB3 SER A 106 9.082 -17.056 -11.075 1.00 0.00 H new ATOM 0 HG SER A 106 8.946 -17.969 -13.202 1.00 0.00 H new ATOM 1570 N SER A 107 7.477 -14.349 -12.803 1.00 0.00 N ATOM 1571 CA SER A 107 6.099 -13.872 -12.830 1.00 0.00 C ATOM 1572 C SER A 107 5.410 -14.274 -14.131 1.00 0.00 C ATOM 1573 O SER A 107 6.003 -14.207 -15.207 1.00 0.00 O ATOM 1574 CB SER A 107 6.061 -12.351 -12.668 1.00 0.00 C ATOM 1575 OG SER A 107 4.817 -11.926 -12.139 1.00 0.00 O ATOM 0 H SER A 107 7.894 -14.485 -13.724 1.00 0.00 H new ATOM 0 HA SER A 107 5.564 -14.333 -11.999 1.00 0.00 H new ATOM 0 HB2 SER A 107 6.868 -12.032 -12.009 1.00 0.00 H new ATOM 0 HB3 SER A 107 6.231 -11.875 -13.634 1.00 0.00 H new ATOM 0 HG SER A 107 4.818 -10.951 -12.043 1.00 0.00 H new ATOM 1581 N GLY A 108 4.153 -14.693 -14.023 1.00 0.00 N ATOM 1582 CA GLY A 108 3.403 -15.100 -15.197 1.00 0.00 C ATOM 1583 C GLY A 108 1.912 -14.880 -15.037 1.00 0.00 C ATOM 1584 O GLY A 108 1.421 -13.763 -15.200 1.00 0.00 O ATOM 0 H GLY A 108 3.641 -14.758 -13.143 1.00 0.00 H new ATOM 0 HA2 GLY A 108 3.759 -14.542 -16.063 1.00 0.00 H new ATOM 0 HA3 GLY A 108 3.592 -16.155 -15.398 1.00 0.00 H new TER 1588 GLY A 108