USER MOD reduce.3.24.130724 H: found=0, std=0, add=819, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 817 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 28 SER OG : rot 140:sc= -0.0786 USER MOD Set 1.2: A 67 MET CE :methyl -160:sc= -1.52 (180deg=-2.66!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 THR OG1 : rot 85:sc= 1.08 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 CYS SG : rot 180:sc= 0 USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 48 ASN : amide:sc= -1.01 X(o=-1,f=-0.85) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 SER OG : rot -150:sc= -0.445! USER MOD Single : A 59 THR OG1 : rot 80:sc= 1.03 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot 54:sc= 1.11 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 87 SER OG : rot 81:sc= 0.0623 USER MOD Single : A 89 MET CE :methyl 143:sc= -0.442 (180deg=-3.94!) USER MOD Single : A 90 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -28.219 20.771 -3.648 1.00 0.00 N ATOM 2 CA MET A 1 -28.922 21.886 -3.038 1.00 0.00 C ATOM 3 C MET A 1 -30.283 21.445 -2.495 1.00 0.00 C ATOM 4 O MET A 1 -31.233 21.272 -3.257 1.00 0.00 O ATOM 5 CB MET A 1 -29.120 22.994 -4.074 1.00 0.00 C ATOM 6 CG MET A 1 -27.978 24.010 -4.015 1.00 0.00 C ATOM 7 SD MET A 1 -26.914 23.816 -5.435 1.00 0.00 S ATOM 8 CE MET A 1 -25.331 24.164 -4.687 1.00 0.00 C ATOM 0 H1 MET A 1 -27.299 21.096 -4.008 1.00 0.00 H new ATOM 0 H2 MET A 1 -28.069 20.025 -2.939 1.00 0.00 H new ATOM 0 H3 MET A 1 -28.785 20.392 -4.434 1.00 0.00 H new ATOM 0 HA MET A 1 -28.323 22.257 -2.207 1.00 0.00 H new ATOM 0 HB2 MET A 1 -29.173 22.559 -5.072 1.00 0.00 H new ATOM 0 HB3 MET A 1 -30.070 23.498 -3.895 1.00 0.00 H new ATOM 0 HG2 MET A 1 -28.382 25.022 -3.988 1.00 0.00 H new ATOM 0 HG3 MET A 1 -27.404 23.872 -3.099 1.00 0.00 H new ATOM 0 HE1 MET A 1 -24.547 24.086 -5.441 1.00 0.00 H new ATOM 0 HE2 MET A 1 -25.338 25.172 -4.273 1.00 0.00 H new ATOM 0 HE3 MET A 1 -25.140 23.446 -3.889 1.00 0.00 H new ATOM 18 N ASP A 2 -30.334 21.275 -1.182 1.00 0.00 N ATOM 19 CA ASP A 2 -31.562 20.858 -0.528 1.00 0.00 C ATOM 20 C ASP A 2 -31.507 21.247 0.950 1.00 0.00 C ATOM 21 O ASP A 2 -30.431 21.283 1.546 1.00 0.00 O ATOM 22 CB ASP A 2 -31.742 19.340 -0.611 1.00 0.00 C ATOM 23 CG ASP A 2 -32.456 18.842 -1.869 1.00 0.00 C ATOM 24 OD1 ASP A 2 -33.713 19.125 -1.931 1.00 0.00 O ATOM 25 OD2 ASP A 2 -31.843 18.214 -2.745 1.00 0.00 O ATOM 0 H ASP A 2 -29.544 21.419 -0.553 1.00 0.00 H new ATOM 0 HA ASP A 2 -32.395 21.349 -1.032 1.00 0.00 H new ATOM 0 HB2 ASP A 2 -30.760 18.869 -0.558 1.00 0.00 H new ATOM 0 HB3 ASP A 2 -32.303 19.007 0.263 1.00 0.00 H new ATOM 30 N LEU A 3 -32.679 21.529 1.500 1.00 0.00 N ATOM 31 CA LEU A 3 -32.777 21.914 2.897 1.00 0.00 C ATOM 32 C LEU A 3 -31.990 20.920 3.753 1.00 0.00 C ATOM 33 O LEU A 3 -31.012 21.290 4.400 1.00 0.00 O ATOM 34 CB LEU A 3 -34.242 22.057 3.312 1.00 0.00 C ATOM 35 CG LEU A 3 -34.868 23.438 3.100 1.00 0.00 C ATOM 36 CD1 LEU A 3 -36.379 23.328 2.887 1.00 0.00 C ATOM 37 CD2 LEU A 3 -34.518 24.381 4.254 1.00 0.00 C ATOM 0 H LEU A 3 -33.569 21.498 1.003 1.00 0.00 H new ATOM 0 HA LEU A 3 -32.328 22.895 3.053 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -34.829 21.325 2.758 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -34.327 21.800 4.368 1.00 0.00 H new ATOM 0 HG LEU A 3 -34.446 23.869 2.192 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -36.799 24.323 2.739 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -36.579 22.715 2.008 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -36.837 22.867 3.762 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -34.975 25.355 4.079 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -34.894 23.967 5.189 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -33.436 24.494 4.316 1.00 0.00 H new ATOM 49 N ILE A 4 -32.446 19.676 3.727 1.00 0.00 N ATOM 50 CA ILE A 4 -31.796 18.625 4.492 1.00 0.00 C ATOM 51 C ILE A 4 -30.283 18.705 4.279 1.00 0.00 C ATOM 52 O ILE A 4 -29.593 19.446 4.977 1.00 0.00 O ATOM 53 CB ILE A 4 -32.395 17.261 4.143 1.00 0.00 C ATOM 54 CG1 ILE A 4 -31.477 16.126 4.603 1.00 0.00 C ATOM 55 CG2 ILE A 4 -32.717 17.168 2.650 1.00 0.00 C ATOM 56 CD1 ILE A 4 -32.273 15.034 5.320 1.00 0.00 C ATOM 0 H ILE A 4 -33.257 19.372 3.189 1.00 0.00 H new ATOM 0 HA ILE A 4 -31.975 18.763 5.558 1.00 0.00 H new ATOM 0 HB ILE A 4 -33.336 17.154 4.682 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -30.961 15.700 3.743 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -30.711 16.521 5.271 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -33.141 16.188 2.430 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -33.436 17.943 2.384 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -31.804 17.306 2.071 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -31.597 14.240 5.637 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -32.768 15.459 6.193 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -33.022 14.625 4.642 1.00 0.00 H new ATOM 68 N GLY A 5 -29.812 17.933 3.311 1.00 0.00 N ATOM 69 CA GLY A 5 -28.394 17.907 2.998 1.00 0.00 C ATOM 70 C GLY A 5 -27.618 17.091 4.033 1.00 0.00 C ATOM 71 O GLY A 5 -26.931 16.132 3.685 1.00 0.00 O ATOM 0 H GLY A 5 -30.388 17.321 2.733 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -28.245 17.479 2.007 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -28.006 18.925 2.968 1.00 0.00 H new ATOM 75 N PHE A 6 -27.753 17.502 5.286 1.00 0.00 N ATOM 76 CA PHE A 6 -27.074 16.820 6.374 1.00 0.00 C ATOM 77 C PHE A 6 -27.444 15.336 6.409 1.00 0.00 C ATOM 78 O PHE A 6 -26.572 14.473 6.331 1.00 0.00 O ATOM 79 CB PHE A 6 -27.538 17.481 7.674 1.00 0.00 C ATOM 80 CG PHE A 6 -26.565 17.307 8.842 1.00 0.00 C ATOM 81 CD1 PHE A 6 -25.434 18.060 8.902 1.00 0.00 C ATOM 82 CD2 PHE A 6 -26.831 16.400 9.820 1.00 0.00 C ATOM 83 CE1 PHE A 6 -24.531 17.898 9.986 1.00 0.00 C ATOM 84 CE2 PHE A 6 -25.928 16.239 10.904 1.00 0.00 C ATOM 85 CZ PHE A 6 -24.797 16.992 10.964 1.00 0.00 C ATOM 0 H PHE A 6 -28.323 18.299 5.571 1.00 0.00 H new ATOM 0 HA PHE A 6 -25.994 16.893 6.243 1.00 0.00 H new ATOM 0 HB2 PHE A 6 -27.688 18.546 7.495 1.00 0.00 H new ATOM 0 HB3 PHE A 6 -28.506 17.066 7.956 1.00 0.00 H new ATOM 0 HD1 PHE A 6 -25.223 18.781 8.126 1.00 0.00 H new ATOM 0 HD2 PHE A 6 -27.729 15.802 9.772 1.00 0.00 H new ATOM 0 HE1 PHE A 6 -23.632 18.495 10.033 1.00 0.00 H new ATOM 0 HE2 PHE A 6 -26.139 15.519 11.681 1.00 0.00 H new ATOM 0 HZ PHE A 6 -24.110 16.870 11.789 1.00 0.00 H new ATOM 95 N GLY A 7 -28.740 15.086 6.527 1.00 0.00 N ATOM 96 CA GLY A 7 -29.237 13.721 6.573 1.00 0.00 C ATOM 97 C GLY A 7 -28.594 12.866 5.479 1.00 0.00 C ATOM 98 O GLY A 7 -28.044 11.802 5.761 1.00 0.00 O ATOM 0 H GLY A 7 -29.461 15.805 6.592 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -29.026 13.286 7.550 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -30.320 13.720 6.451 1.00 0.00 H new ATOM 102 N TYR A 8 -28.684 13.363 4.254 1.00 0.00 N ATOM 103 CA TYR A 8 -28.117 12.658 3.117 1.00 0.00 C ATOM 104 C TYR A 8 -26.687 12.202 3.412 1.00 0.00 C ATOM 105 O TYR A 8 -26.352 11.034 3.221 1.00 0.00 O ATOM 106 CB TYR A 8 -28.091 13.666 1.966 1.00 0.00 C ATOM 107 CG TYR A 8 -27.946 13.027 0.583 1.00 0.00 C ATOM 108 CD1 TYR A 8 -26.692 12.767 0.071 1.00 0.00 C ATOM 109 CD2 TYR A 8 -29.071 12.711 -0.152 1.00 0.00 C ATOM 110 CE1 TYR A 8 -26.555 12.167 -1.230 1.00 0.00 C ATOM 111 CE2 TYR A 8 -28.935 12.111 -1.454 1.00 0.00 C ATOM 112 CZ TYR A 8 -27.684 11.868 -1.929 1.00 0.00 C ATOM 113 OH TYR A 8 -27.555 11.301 -3.158 1.00 0.00 O ATOM 0 H TYR A 8 -29.141 14.245 4.024 1.00 0.00 H new ATOM 0 HA TYR A 8 -28.706 11.771 2.883 1.00 0.00 H new ATOM 0 HB2 TYR A 8 -29.009 14.253 1.989 1.00 0.00 H new ATOM 0 HB3 TYR A 8 -27.265 14.360 2.123 1.00 0.00 H new ATOM 0 HD1 TYR A 8 -25.812 13.014 0.647 1.00 0.00 H new ATOM 0 HD2 TYR A 8 -30.053 12.914 0.249 1.00 0.00 H new ATOM 0 HE1 TYR A 8 -25.579 11.959 -1.642 1.00 0.00 H new ATOM 0 HE2 TYR A 8 -29.807 11.860 -2.040 1.00 0.00 H new ATOM 0 HH TYR A 8 -28.443 11.142 -3.540 1.00 0.00 H new ATOM 123 N ALA A 9 -25.881 13.147 3.873 1.00 0.00 N ATOM 124 CA ALA A 9 -24.495 12.857 4.196 1.00 0.00 C ATOM 125 C ALA A 9 -24.441 11.962 5.435 1.00 0.00 C ATOM 126 O ALA A 9 -23.517 11.165 5.590 1.00 0.00 O ATOM 127 CB ALA A 9 -23.730 14.169 4.390 1.00 0.00 C ATOM 0 H ALA A 9 -26.162 14.115 4.031 1.00 0.00 H new ATOM 0 HA ALA A 9 -24.015 12.318 3.379 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -22.690 13.951 4.632 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -23.774 14.755 3.472 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -24.181 14.736 5.204 1.00 0.00 H new ATOM 133 N ALA A 10 -25.443 12.123 6.286 1.00 0.00 N ATOM 134 CA ALA A 10 -25.522 11.340 7.507 1.00 0.00 C ATOM 135 C ALA A 10 -25.655 9.858 7.149 1.00 0.00 C ATOM 136 O ALA A 10 -24.777 9.057 7.467 1.00 0.00 O ATOM 137 CB ALA A 10 -26.688 11.841 8.362 1.00 0.00 C ATOM 0 H ALA A 10 -26.208 12.785 6.154 1.00 0.00 H new ATOM 0 HA ALA A 10 -24.613 11.457 8.097 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -26.747 11.253 9.278 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -26.530 12.890 8.614 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -27.619 11.738 7.804 1.00 0.00 H new ATOM 143 N LEU A 11 -26.761 9.538 6.494 1.00 0.00 N ATOM 144 CA LEU A 11 -27.021 8.167 6.089 1.00 0.00 C ATOM 145 C LEU A 11 -25.853 7.659 5.242 1.00 0.00 C ATOM 146 O LEU A 11 -25.399 6.530 5.418 1.00 0.00 O ATOM 147 CB LEU A 11 -28.379 8.063 5.391 1.00 0.00 C ATOM 148 CG LEU A 11 -28.453 8.649 3.979 1.00 0.00 C ATOM 149 CD1 LEU A 11 -28.078 7.601 2.930 1.00 0.00 C ATOM 150 CD2 LEU A 11 -29.830 9.260 3.712 1.00 0.00 C ATOM 0 H LEU A 11 -27.488 10.205 6.234 1.00 0.00 H new ATOM 0 HA LEU A 11 -27.087 7.518 6.962 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -28.661 7.011 5.342 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -29.123 8.564 6.010 1.00 0.00 H new ATOM 0 HG LEU A 11 -27.722 9.454 3.904 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -28.139 8.043 1.936 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -27.061 7.253 3.111 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -28.767 6.759 2.995 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -29.857 9.670 2.702 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -30.595 8.490 3.812 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -30.020 10.056 4.432 1.00 0.00 H new ATOM 162 N VAL A 12 -25.400 8.518 4.341 1.00 0.00 N ATOM 163 CA VAL A 12 -24.293 8.171 3.466 1.00 0.00 C ATOM 164 C VAL A 12 -23.105 7.710 4.312 1.00 0.00 C ATOM 165 O VAL A 12 -22.506 6.672 4.034 1.00 0.00 O ATOM 166 CB VAL A 12 -23.955 9.353 2.555 1.00 0.00 C ATOM 167 CG1 VAL A 12 -22.577 9.175 1.914 1.00 0.00 C ATOM 168 CG2 VAL A 12 -25.034 9.550 1.489 1.00 0.00 C ATOM 0 H VAL A 12 -25.780 9.454 4.198 1.00 0.00 H new ATOM 0 HA VAL A 12 -24.568 7.343 2.813 1.00 0.00 H new ATOM 0 HB VAL A 12 -23.924 10.252 3.171 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -22.362 10.029 1.272 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -21.819 9.107 2.694 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -22.568 8.262 1.319 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -24.769 10.396 0.855 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -25.111 8.650 0.879 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -25.992 9.744 1.972 1.00 0.00 H new ATOM 178 N THR A 13 -22.799 8.503 5.328 1.00 0.00 N ATOM 179 CA THR A 13 -21.694 8.189 6.217 1.00 0.00 C ATOM 180 C THR A 13 -21.946 6.861 6.934 1.00 0.00 C ATOM 181 O THR A 13 -21.017 6.088 7.162 1.00 0.00 O ATOM 182 CB THR A 13 -21.505 9.369 7.172 1.00 0.00 C ATOM 183 OG1 THR A 13 -20.998 10.410 6.342 1.00 0.00 O ATOM 184 CG2 THR A 13 -20.388 9.126 8.189 1.00 0.00 C ATOM 0 H THR A 13 -23.298 9.363 5.555 1.00 0.00 H new ATOM 0 HA THR A 13 -20.767 8.051 5.661 1.00 0.00 H new ATOM 0 HB THR A 13 -22.440 9.563 7.699 1.00 0.00 H new ATOM 0 HG1 THR A 13 -21.744 10.880 5.914 1.00 0.00 H new ATOM 0 HG21 THR A 13 -20.296 9.994 8.842 1.00 0.00 H new ATOM 0 HG22 THR A 13 -20.625 8.246 8.786 1.00 0.00 H new ATOM 0 HG23 THR A 13 -19.446 8.965 7.664 1.00 0.00 H new ATOM 192 N PHE A 14 -23.208 6.637 7.269 1.00 0.00 N ATOM 193 CA PHE A 14 -23.595 5.416 7.956 1.00 0.00 C ATOM 194 C PHE A 14 -23.346 4.190 7.075 1.00 0.00 C ATOM 195 O PHE A 14 -22.689 3.240 7.499 1.00 0.00 O ATOM 196 CB PHE A 14 -25.093 5.523 8.249 1.00 0.00 C ATOM 197 CG PHE A 14 -25.569 4.621 9.390 1.00 0.00 C ATOM 198 CD1 PHE A 14 -25.077 4.796 10.646 1.00 0.00 C ATOM 199 CD2 PHE A 14 -26.484 3.645 9.147 1.00 0.00 C ATOM 200 CE1 PHE A 14 -25.520 3.959 11.704 1.00 0.00 C ATOM 201 CE2 PHE A 14 -26.927 2.808 10.206 1.00 0.00 C ATOM 202 CZ PHE A 14 -26.435 2.983 11.462 1.00 0.00 C ATOM 0 H PHE A 14 -23.976 7.280 7.078 1.00 0.00 H new ATOM 0 HA PHE A 14 -23.010 5.300 8.868 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -25.332 6.558 8.494 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -25.649 5.272 7.345 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -24.350 5.571 10.838 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -26.874 3.506 8.149 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -25.130 4.098 12.701 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -27.654 2.033 10.014 1.00 0.00 H new ATOM 0 HZ PHE A 14 -26.771 2.347 12.267 1.00 0.00 H new ATOM 212 N GLY A 15 -23.883 4.251 5.866 1.00 0.00 N ATOM 213 CA GLY A 15 -23.728 3.157 4.922 1.00 0.00 C ATOM 214 C GLY A 15 -22.261 2.980 4.525 1.00 0.00 C ATOM 215 O GLY A 15 -21.838 1.880 4.173 1.00 0.00 O ATOM 0 H GLY A 15 -24.426 5.041 5.518 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -24.103 2.234 5.365 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -24.328 3.351 4.033 1.00 0.00 H new ATOM 219 N SER A 16 -21.525 4.079 4.596 1.00 0.00 N ATOM 220 CA SER A 16 -20.114 4.059 4.248 1.00 0.00 C ATOM 221 C SER A 16 -19.328 3.274 5.299 1.00 0.00 C ATOM 222 O SER A 16 -18.550 2.383 4.960 1.00 0.00 O ATOM 223 CB SER A 16 -19.558 5.479 4.120 1.00 0.00 C ATOM 224 OG SER A 16 -18.923 5.692 2.863 1.00 0.00 O ATOM 0 H SER A 16 -21.879 4.989 4.889 1.00 0.00 H new ATOM 0 HA SER A 16 -20.007 3.568 3.281 1.00 0.00 H new ATOM 0 HB2 SER A 16 -20.368 6.198 4.243 1.00 0.00 H new ATOM 0 HB3 SER A 16 -18.844 5.662 4.923 1.00 0.00 H new ATOM 0 HG SER A 16 -18.583 6.610 2.820 1.00 0.00 H new ATOM 230 N ILE A 17 -19.557 3.632 6.554 1.00 0.00 N ATOM 231 CA ILE A 17 -18.880 2.972 7.657 1.00 0.00 C ATOM 232 C ILE A 17 -19.363 1.523 7.752 1.00 0.00 C ATOM 233 O ILE A 17 -18.596 0.592 7.512 1.00 0.00 O ATOM 234 CB ILE A 17 -19.062 3.767 8.951 1.00 0.00 C ATOM 235 CG1 ILE A 17 -18.425 5.154 8.836 1.00 0.00 C ATOM 236 CG2 ILE A 17 -18.525 2.988 10.153 1.00 0.00 C ATOM 237 CD1 ILE A 17 -16.952 5.049 8.436 1.00 0.00 C ATOM 0 H ILE A 17 -20.203 4.371 6.831 1.00 0.00 H new ATOM 0 HA ILE A 17 -17.805 2.940 7.479 1.00 0.00 H new ATOM 0 HB ILE A 17 -20.130 3.915 9.114 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -18.965 5.746 8.097 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -18.511 5.678 9.788 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -18.667 3.576 11.060 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -19.062 2.044 10.244 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -17.463 2.788 10.012 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -16.523 6.048 8.361 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -16.410 4.477 9.189 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -16.872 4.547 7.472 1.00 0.00 H new ATOM 249 N PHE A 18 -20.632 1.378 8.104 1.00 0.00 N ATOM 250 CA PHE A 18 -21.226 0.059 8.234 1.00 0.00 C ATOM 251 C PHE A 18 -20.942 -0.796 6.998 1.00 0.00 C ATOM 252 O PHE A 18 -20.620 -1.977 7.115 1.00 0.00 O ATOM 253 CB PHE A 18 -22.737 0.259 8.364 1.00 0.00 C ATOM 254 CG PHE A 18 -23.430 -0.782 9.245 1.00 0.00 C ATOM 255 CD1 PHE A 18 -23.306 -2.106 8.959 1.00 0.00 C ATOM 256 CD2 PHE A 18 -24.171 -0.384 10.314 1.00 0.00 C ATOM 257 CE1 PHE A 18 -23.949 -3.072 9.776 1.00 0.00 C ATOM 258 CE2 PHE A 18 -24.814 -1.351 11.132 1.00 0.00 C ATOM 259 CZ PHE A 18 -24.690 -2.674 10.846 1.00 0.00 C ATOM 0 H PHE A 18 -21.265 2.153 8.303 1.00 0.00 H new ATOM 0 HA PHE A 18 -20.807 -0.453 9.100 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -22.928 1.251 8.773 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -23.183 0.233 7.370 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -22.718 -2.422 8.110 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -24.270 0.667 10.541 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -23.850 -4.123 9.549 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -25.402 -1.035 11.981 1.00 0.00 H new ATOM 0 HZ PHE A 18 -25.179 -3.409 11.468 1.00 0.00 H new ATOM 269 N GLY A 19 -21.070 -0.165 5.840 1.00 0.00 N ATOM 270 CA GLY A 19 -20.831 -0.853 4.582 1.00 0.00 C ATOM 271 C GLY A 19 -19.365 -1.274 4.458 1.00 0.00 C ATOM 272 O GLY A 19 -19.040 -2.451 4.605 1.00 0.00 O ATOM 0 H GLY A 19 -21.336 0.815 5.746 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -21.472 -1.732 4.516 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -21.098 -0.201 3.750 1.00 0.00 H new ATOM 276 N TYR A 20 -18.520 -0.290 4.190 1.00 0.00 N ATOM 277 CA TYR A 20 -17.097 -0.544 4.045 1.00 0.00 C ATOM 278 C TYR A 20 -16.839 -1.653 3.022 1.00 0.00 C ATOM 279 O TYR A 20 -16.842 -2.833 3.368 1.00 0.00 O ATOM 280 CB TYR A 20 -16.609 -1.009 5.418 1.00 0.00 C ATOM 281 CG TYR A 20 -15.491 -0.146 6.007 1.00 0.00 C ATOM 282 CD1 TYR A 20 -15.782 1.099 6.526 1.00 0.00 C ATOM 283 CD2 TYR A 20 -14.193 -0.613 6.019 1.00 0.00 C ATOM 284 CE1 TYR A 20 -14.730 1.911 7.080 1.00 0.00 C ATOM 285 CE2 TYR A 20 -13.141 0.199 6.573 1.00 0.00 C ATOM 286 CZ TYR A 20 -13.461 1.421 7.076 1.00 0.00 C ATOM 287 OH TYR A 20 -12.468 2.188 7.599 1.00 0.00 O ATOM 0 H TYR A 20 -18.794 0.685 4.069 1.00 0.00 H new ATOM 0 HA TYR A 20 -16.581 0.352 3.700 1.00 0.00 H new ATOM 0 HB2 TYR A 20 -17.452 -1.014 6.109 1.00 0.00 H new ATOM 0 HB3 TYR A 20 -16.256 -2.037 5.338 1.00 0.00 H new ATOM 0 HD1 TYR A 20 -16.798 1.464 6.517 1.00 0.00 H new ATOM 0 HD2 TYR A 20 -13.966 -1.588 5.613 1.00 0.00 H new ATOM 0 HE1 TYR A 20 -14.944 2.887 7.490 1.00 0.00 H new ATOM 0 HE2 TYR A 20 -12.121 -0.155 6.589 1.00 0.00 H new ATOM 0 HH TYR A 20 -11.615 1.711 7.530 1.00 0.00 H new ATOM 297 N LYS A 21 -16.624 -1.234 1.784 1.00 0.00 N ATOM 298 CA LYS A 21 -16.365 -2.177 0.709 1.00 0.00 C ATOM 299 C LYS A 21 -15.248 -3.133 1.133 1.00 0.00 C ATOM 300 O LYS A 21 -14.146 -2.697 1.465 1.00 0.00 O ATOM 301 CB LYS A 21 -16.077 -1.435 -0.597 1.00 0.00 C ATOM 302 CG LYS A 21 -16.642 -2.198 -1.797 1.00 0.00 C ATOM 303 CD LYS A 21 -17.440 -1.268 -2.712 1.00 0.00 C ATOM 304 CE LYS A 21 -18.730 -1.939 -3.187 1.00 0.00 C ATOM 305 NZ LYS A 21 -19.908 -1.136 -2.793 1.00 0.00 N ATOM 0 H LYS A 21 -16.624 -0.254 1.501 1.00 0.00 H new ATOM 0 HA LYS A 21 -17.249 -2.785 0.515 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -16.515 -0.438 -0.557 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -15.001 -1.307 -0.717 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -15.827 -2.655 -2.358 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -17.282 -3.008 -1.448 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -17.680 -0.347 -2.180 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -16.832 -0.990 -3.573 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -18.708 -2.056 -4.271 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -18.805 -2.939 -2.760 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -20.775 -1.606 -3.123 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -19.936 -1.046 -1.757 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -19.842 -0.190 -3.221 1.00 0.00 H new ATOM 319 N ARG A 22 -15.570 -4.418 1.108 1.00 0.00 N ATOM 320 CA ARG A 22 -14.607 -5.438 1.485 1.00 0.00 C ATOM 321 C ARG A 22 -14.982 -6.781 0.855 1.00 0.00 C ATOM 322 O ARG A 22 -15.693 -7.580 1.463 1.00 0.00 O ATOM 323 CB ARG A 22 -14.540 -5.598 3.005 1.00 0.00 C ATOM 324 CG ARG A 22 -13.322 -4.872 3.580 1.00 0.00 C ATOM 325 CD ARG A 22 -13.503 -4.595 5.074 1.00 0.00 C ATOM 326 NE ARG A 22 -12.229 -4.829 5.790 1.00 0.00 N ATOM 327 CZ ARG A 22 -11.987 -4.426 7.044 1.00 0.00 C ATOM 328 NH1 ARG A 22 -12.931 -3.766 7.730 1.00 0.00 N ATOM 329 NH2 ARG A 22 -10.802 -4.682 7.614 1.00 0.00 N ATOM 0 H ARG A 22 -16.485 -4.776 0.832 1.00 0.00 H new ATOM 0 HA ARG A 22 -13.630 -5.121 1.121 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -15.450 -5.203 3.456 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -14.491 -6.656 3.261 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -12.428 -5.475 3.424 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -13.170 -3.933 3.048 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -13.831 -3.566 5.224 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -14.282 -5.240 5.480 1.00 0.00 H new ATOM 0 HE ARG A 22 -11.489 -5.329 5.297 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -13.834 -3.571 7.297 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -12.747 -3.459 8.685 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -10.083 -5.184 7.093 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -10.618 -4.375 8.569 1.00 0.00 H new ATOM 343 N ARG A 23 -14.488 -6.988 -0.357 1.00 0.00 N ATOM 344 CA ARG A 23 -14.763 -8.220 -1.077 1.00 0.00 C ATOM 345 C ARG A 23 -13.767 -9.307 -0.667 1.00 0.00 C ATOM 346 O ARG A 23 -14.164 -10.370 -0.191 1.00 0.00 O ATOM 347 CB ARG A 23 -14.679 -8.005 -2.589 1.00 0.00 C ATOM 348 CG ARG A 23 -15.960 -8.474 -3.282 1.00 0.00 C ATOM 349 CD ARG A 23 -15.680 -9.658 -4.210 1.00 0.00 C ATOM 350 NE ARG A 23 -15.854 -10.930 -3.475 1.00 0.00 N ATOM 351 CZ ARG A 23 -15.801 -12.141 -4.046 1.00 0.00 C ATOM 352 NH1 ARG A 23 -15.577 -12.252 -5.363 1.00 0.00 N ATOM 353 NH2 ARG A 23 -15.971 -13.241 -3.301 1.00 0.00 N ATOM 0 H ARG A 23 -13.899 -6.323 -0.859 1.00 0.00 H new ATOM 0 HA ARG A 23 -15.775 -8.534 -0.822 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -14.513 -6.949 -2.801 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -13.824 -8.549 -2.990 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -16.698 -8.761 -2.533 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -16.390 -7.652 -3.855 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -16.355 -9.628 -5.065 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -14.665 -9.591 -4.602 1.00 0.00 H new ATOM 0 HE ARG A 23 -16.025 -10.882 -2.471 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -15.447 -11.415 -5.931 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -15.537 -13.174 -5.798 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -16.141 -13.157 -2.299 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -15.931 -14.163 -3.736 1.00 0.00 H new ATOM 367 N GLY A 24 -12.493 -9.003 -0.867 1.00 0.00 N ATOM 368 CA GLY A 24 -11.437 -9.941 -0.525 1.00 0.00 C ATOM 369 C GLY A 24 -10.120 -9.554 -1.199 1.00 0.00 C ATOM 370 O GLY A 24 -9.806 -8.371 -1.324 1.00 0.00 O ATOM 0 H GLY A 24 -12.168 -8.120 -1.262 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -11.303 -9.964 0.556 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -11.725 -10.946 -0.832 1.00 0.00 H new ATOM 374 N GLY A 25 -9.384 -10.574 -1.617 1.00 0.00 N ATOM 375 CA GLY A 25 -8.108 -10.355 -2.276 1.00 0.00 C ATOM 376 C GLY A 25 -7.273 -11.637 -2.293 1.00 0.00 C ATOM 377 O GLY A 25 -6.166 -11.669 -1.757 1.00 0.00 O ATOM 0 H GLY A 25 -9.647 -11.554 -1.512 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -8.276 -10.013 -3.297 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -7.559 -9.566 -1.761 1.00 0.00 H new ATOM 381 N VAL A 26 -7.835 -12.663 -2.915 1.00 0.00 N ATOM 382 CA VAL A 26 -7.156 -13.944 -3.010 1.00 0.00 C ATOM 383 C VAL A 26 -5.896 -13.788 -3.863 1.00 0.00 C ATOM 384 O VAL A 26 -4.807 -14.177 -3.446 1.00 0.00 O ATOM 385 CB VAL A 26 -8.116 -15.007 -3.550 1.00 0.00 C ATOM 386 CG1 VAL A 26 -7.433 -15.876 -4.606 1.00 0.00 C ATOM 387 CG2 VAL A 26 -8.680 -15.864 -2.415 1.00 0.00 C ATOM 0 H VAL A 26 -8.753 -12.633 -3.358 1.00 0.00 H new ATOM 0 HA VAL A 26 -6.840 -14.282 -2.023 1.00 0.00 H new ATOM 0 HB VAL A 26 -8.950 -14.493 -4.028 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -8.137 -16.623 -4.973 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -7.103 -15.250 -5.435 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -6.571 -16.376 -4.164 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -9.359 -16.611 -2.826 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -7.862 -16.364 -1.895 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -9.221 -15.229 -1.714 1.00 0.00 H new ATOM 397 N PRO A 27 -6.092 -13.201 -5.075 1.00 0.00 N ATOM 398 CA PRO A 27 -4.985 -12.988 -5.991 1.00 0.00 C ATOM 399 C PRO A 27 -4.108 -11.822 -5.530 1.00 0.00 C ATOM 400 O PRO A 27 -4.323 -11.267 -4.453 1.00 0.00 O ATOM 401 CB PRO A 27 -5.634 -12.744 -7.343 1.00 0.00 C ATOM 402 CG PRO A 27 -7.078 -12.369 -7.051 1.00 0.00 C ATOM 403 CD PRO A 27 -7.368 -12.727 -5.602 1.00 0.00 C ATOM 0 HA PRO A 27 -4.308 -13.841 -6.037 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -5.125 -11.945 -7.882 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -5.581 -13.635 -7.968 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -7.238 -11.304 -7.221 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -7.754 -12.903 -7.719 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -7.730 -11.863 -5.045 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -8.137 -13.497 -5.530 1.00 0.00 H new ATOM 411 N SER A 28 -3.138 -11.486 -6.367 1.00 0.00 N ATOM 412 CA SER A 28 -2.228 -10.396 -6.059 1.00 0.00 C ATOM 413 C SER A 28 -2.566 -9.174 -6.914 1.00 0.00 C ATOM 414 O SER A 28 -2.392 -8.038 -6.476 1.00 0.00 O ATOM 415 CB SER A 28 -0.773 -10.814 -6.282 1.00 0.00 C ATOM 416 OG SER A 28 -0.349 -11.796 -5.340 1.00 0.00 O ATOM 0 H SER A 28 -2.962 -11.949 -7.258 1.00 0.00 H new ATOM 0 HA SER A 28 -2.347 -10.139 -5.007 1.00 0.00 H new ATOM 0 HB2 SER A 28 -0.660 -11.208 -7.292 1.00 0.00 H new ATOM 0 HB3 SER A 28 -0.129 -9.938 -6.207 1.00 0.00 H new ATOM 0 HG SER A 28 0.208 -12.464 -5.792 1.00 0.00 H new ATOM 422 N LEU A 29 -3.043 -9.448 -8.119 1.00 0.00 N ATOM 423 CA LEU A 29 -3.407 -8.385 -9.040 1.00 0.00 C ATOM 424 C LEU A 29 -4.329 -7.393 -8.328 1.00 0.00 C ATOM 425 O LEU A 29 -3.986 -6.222 -8.174 1.00 0.00 O ATOM 426 CB LEU A 29 -4.005 -8.968 -10.322 1.00 0.00 C ATOM 427 CG LEU A 29 -4.821 -10.252 -10.159 1.00 0.00 C ATOM 428 CD1 LEU A 29 -6.139 -10.166 -10.932 1.00 0.00 C ATOM 429 CD2 LEU A 29 -4.000 -11.479 -10.560 1.00 0.00 C ATOM 0 H LEU A 29 -3.186 -10.392 -8.479 1.00 0.00 H new ATOM 0 HA LEU A 29 -2.521 -7.831 -9.352 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -4.643 -8.211 -10.778 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -3.193 -9.164 -11.022 1.00 0.00 H new ATOM 0 HG LEU A 29 -5.073 -10.365 -9.105 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -6.700 -11.091 -10.799 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -6.727 -9.328 -10.557 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -5.930 -10.017 -11.991 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -4.604 -12.378 -10.434 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -3.696 -11.389 -11.603 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -3.114 -11.546 -9.929 1.00 0.00 H new ATOM 441 N ILE A 30 -5.481 -7.898 -7.912 1.00 0.00 N ATOM 442 CA ILE A 30 -6.455 -7.071 -7.220 1.00 0.00 C ATOM 443 C ILE A 30 -5.775 -6.365 -6.045 1.00 0.00 C ATOM 444 O ILE A 30 -6.259 -5.340 -5.568 1.00 0.00 O ATOM 445 CB ILE A 30 -7.674 -7.902 -6.816 1.00 0.00 C ATOM 446 CG1 ILE A 30 -8.893 -7.009 -6.579 1.00 0.00 C ATOM 447 CG2 ILE A 30 -7.361 -8.779 -5.601 1.00 0.00 C ATOM 448 CD1 ILE A 30 -8.714 -6.160 -5.319 1.00 0.00 C ATOM 0 H ILE A 30 -5.762 -8.870 -8.041 1.00 0.00 H new ATOM 0 HA ILE A 30 -6.834 -6.294 -7.883 1.00 0.00 H new ATOM 0 HB ILE A 30 -7.920 -8.570 -7.641 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -9.045 -6.359 -7.441 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -9.787 -7.626 -6.482 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -8.244 -9.360 -5.334 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -6.541 -9.456 -5.842 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -7.075 -8.147 -4.760 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -9.595 -5.534 -5.174 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -8.586 -6.813 -4.456 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -7.833 -5.527 -5.429 1.00 0.00 H new ATOM 460 N ALA A 31 -4.663 -6.942 -5.613 1.00 0.00 N ATOM 461 CA ALA A 31 -3.911 -6.381 -4.504 1.00 0.00 C ATOM 462 C ALA A 31 -3.252 -5.074 -4.949 1.00 0.00 C ATOM 463 O ALA A 31 -3.470 -4.026 -4.342 1.00 0.00 O ATOM 464 CB ALA A 31 -2.892 -7.408 -4.006 1.00 0.00 C ATOM 0 H ALA A 31 -4.265 -7.792 -6.011 1.00 0.00 H new ATOM 0 HA ALA A 31 -4.573 -6.149 -3.670 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -2.328 -6.987 -3.174 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -3.413 -8.306 -3.674 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -2.208 -7.664 -4.815 1.00 0.00 H new ATOM 470 N GLY A 32 -2.459 -5.178 -6.005 1.00 0.00 N ATOM 471 CA GLY A 32 -1.766 -4.017 -6.538 1.00 0.00 C ATOM 472 C GLY A 32 -2.760 -2.954 -7.009 1.00 0.00 C ATOM 473 O GLY A 32 -2.541 -1.761 -6.806 1.00 0.00 O ATOM 0 H GLY A 32 -2.281 -6.048 -6.506 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -1.113 -3.596 -5.773 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -1.130 -4.319 -7.370 1.00 0.00 H new ATOM 477 N LEU A 33 -3.832 -3.426 -7.629 1.00 0.00 N ATOM 478 CA LEU A 33 -4.861 -2.530 -8.130 1.00 0.00 C ATOM 479 C LEU A 33 -5.412 -1.695 -6.973 1.00 0.00 C ATOM 480 O LEU A 33 -5.308 -0.469 -6.983 1.00 0.00 O ATOM 481 CB LEU A 33 -5.933 -3.317 -8.887 1.00 0.00 C ATOM 482 CG LEU A 33 -7.272 -2.604 -9.086 1.00 0.00 C ATOM 483 CD1 LEU A 33 -7.477 -2.222 -10.554 1.00 0.00 C ATOM 484 CD2 LEU A 33 -8.429 -3.447 -8.547 1.00 0.00 C ATOM 0 H LEU A 33 -4.010 -4.416 -7.796 1.00 0.00 H new ATOM 0 HA LEU A 33 -4.440 -1.832 -8.854 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -5.536 -3.583 -9.867 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -6.116 -4.250 -8.353 1.00 0.00 H new ATOM 0 HG LEU A 33 -7.254 -1.678 -8.511 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -8.436 -1.717 -10.668 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -6.676 -1.555 -10.872 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -7.466 -3.122 -11.169 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -9.369 -2.916 -8.701 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -8.460 -4.401 -9.073 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -8.284 -3.625 -7.482 1.00 0.00 H new ATOM 496 N PHE A 34 -5.987 -2.391 -6.004 1.00 0.00 N ATOM 497 CA PHE A 34 -6.555 -1.729 -4.842 1.00 0.00 C ATOM 498 C PHE A 34 -5.574 -0.712 -4.256 1.00 0.00 C ATOM 499 O PHE A 34 -5.926 0.448 -4.051 1.00 0.00 O ATOM 500 CB PHE A 34 -6.831 -2.814 -3.799 1.00 0.00 C ATOM 501 CG PHE A 34 -7.954 -2.465 -2.820 1.00 0.00 C ATOM 502 CD1 PHE A 34 -9.224 -2.296 -3.275 1.00 0.00 C ATOM 503 CD2 PHE A 34 -7.682 -2.325 -1.495 1.00 0.00 C ATOM 504 CE1 PHE A 34 -10.267 -1.972 -2.367 1.00 0.00 C ATOM 505 CE2 PHE A 34 -8.724 -2.002 -0.587 1.00 0.00 C ATOM 506 CZ PHE A 34 -9.995 -1.832 -1.042 1.00 0.00 C ATOM 0 H PHE A 34 -6.072 -3.407 -6.000 1.00 0.00 H new ATOM 0 HA PHE A 34 -7.463 -1.196 -5.124 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -7.086 -3.741 -4.313 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -5.917 -3.003 -3.235 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -9.440 -2.408 -4.327 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -6.673 -2.460 -1.134 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -11.276 -1.837 -2.729 1.00 0.00 H new ATOM 0 HE2 PHE A 34 -8.508 -1.891 0.465 1.00 0.00 H new ATOM 0 HZ PHE A 34 -10.788 -1.586 -0.351 1.00 0.00 H new ATOM 516 N VAL A 35 -4.362 -1.185 -4.004 1.00 0.00 N ATOM 517 CA VAL A 35 -3.327 -0.331 -3.446 1.00 0.00 C ATOM 518 C VAL A 35 -3.188 0.925 -4.308 1.00 0.00 C ATOM 519 O VAL A 35 -2.997 2.022 -3.786 1.00 0.00 O ATOM 520 CB VAL A 35 -2.018 -1.113 -3.314 1.00 0.00 C ATOM 521 CG1 VAL A 35 -0.855 -0.181 -2.971 1.00 0.00 C ATOM 522 CG2 VAL A 35 -2.150 -2.231 -2.278 1.00 0.00 C ATOM 0 H VAL A 35 -4.074 -2.148 -4.176 1.00 0.00 H new ATOM 0 HA VAL A 35 -3.600 -0.007 -2.442 1.00 0.00 H new ATOM 0 HB VAL A 35 -1.804 -1.574 -4.278 1.00 0.00 H new ATOM 0 HG11 VAL A 35 0.063 -0.762 -2.883 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -0.740 0.562 -3.760 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -1.058 0.322 -2.025 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -1.206 -2.771 -2.203 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -2.399 -1.801 -1.308 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -2.939 -2.919 -2.583 1.00 0.00 H new ATOM 532 N GLY A 36 -3.291 0.723 -5.613 1.00 0.00 N ATOM 533 CA GLY A 36 -3.179 1.826 -6.553 1.00 0.00 C ATOM 534 C GLY A 36 -4.424 2.714 -6.505 1.00 0.00 C ATOM 535 O GLY A 36 -4.346 3.912 -6.773 1.00 0.00 O ATOM 0 H GLY A 36 -3.451 -0.188 -6.042 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -2.295 2.420 -6.319 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -3.044 1.437 -7.562 1.00 0.00 H new ATOM 539 N CYS A 37 -5.543 2.092 -6.163 1.00 0.00 N ATOM 540 CA CYS A 37 -6.802 2.812 -6.077 1.00 0.00 C ATOM 541 C CYS A 37 -6.724 3.778 -4.894 1.00 0.00 C ATOM 542 O CYS A 37 -6.981 4.971 -5.044 1.00 0.00 O ATOM 543 CB CYS A 37 -7.992 1.857 -5.957 1.00 0.00 C ATOM 544 SG CYS A 37 -9.324 2.369 -7.103 1.00 0.00 S ATOM 0 H CYS A 37 -5.604 1.098 -5.942 1.00 0.00 H new ATOM 0 HA CYS A 37 -6.964 3.377 -6.995 1.00 0.00 H new ATOM 0 HB2 CYS A 37 -7.676 0.839 -6.185 1.00 0.00 H new ATOM 0 HB3 CYS A 37 -8.364 1.853 -4.932 1.00 0.00 H new ATOM 0 HG CYS A 37 -10.328 1.550 -6.995 1.00 0.00 H new ATOM 550 N LEU A 38 -6.368 3.226 -3.743 1.00 0.00 N ATOM 551 CA LEU A 38 -6.253 4.024 -2.534 1.00 0.00 C ATOM 552 C LEU A 38 -5.063 4.977 -2.669 1.00 0.00 C ATOM 553 O LEU A 38 -5.115 6.111 -2.196 1.00 0.00 O ATOM 554 CB LEU A 38 -6.181 3.122 -1.301 1.00 0.00 C ATOM 555 CG LEU A 38 -4.791 2.604 -0.929 1.00 0.00 C ATOM 556 CD1 LEU A 38 -4.049 3.609 -0.046 1.00 0.00 C ATOM 557 CD2 LEU A 38 -4.877 1.222 -0.277 1.00 0.00 C ATOM 0 H LEU A 38 -6.155 2.236 -3.622 1.00 0.00 H new ATOM 0 HA LEU A 38 -7.142 4.640 -2.398 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -6.582 3.672 -0.449 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -6.835 2.265 -1.464 1.00 0.00 H new ATOM 0 HG LEU A 38 -4.212 2.492 -1.846 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -3.064 3.216 0.204 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -3.938 4.552 -0.582 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -4.616 3.777 0.870 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -3.875 0.877 -0.022 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -5.481 1.284 0.629 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -5.337 0.520 -0.972 1.00 0.00 H new ATOM 569 N ALA A 39 -4.020 4.481 -3.317 1.00 0.00 N ATOM 570 CA ALA A 39 -2.819 5.274 -3.520 1.00 0.00 C ATOM 571 C ALA A 39 -3.180 6.554 -4.277 1.00 0.00 C ATOM 572 O ALA A 39 -2.717 7.638 -3.927 1.00 0.00 O ATOM 573 CB ALA A 39 -1.772 4.436 -4.256 1.00 0.00 C ATOM 0 H ALA A 39 -3.981 3.540 -3.709 1.00 0.00 H new ATOM 0 HA ALA A 39 -2.387 5.568 -2.563 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -0.871 5.031 -4.408 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -1.529 3.555 -3.663 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -2.169 4.125 -5.222 1.00 0.00 H new ATOM 579 N GLY A 40 -4.003 6.384 -5.302 1.00 0.00 N ATOM 580 CA GLY A 40 -4.431 7.512 -6.112 1.00 0.00 C ATOM 581 C GLY A 40 -5.402 8.406 -5.337 1.00 0.00 C ATOM 582 O GLY A 40 -5.185 9.612 -5.225 1.00 0.00 O ATOM 0 H GLY A 40 -4.384 5.483 -5.590 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -3.562 8.094 -6.420 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -4.911 7.150 -7.021 1.00 0.00 H new ATOM 586 N TYR A 41 -6.451 7.781 -4.823 1.00 0.00 N ATOM 587 CA TYR A 41 -7.454 8.506 -4.062 1.00 0.00 C ATOM 588 C TYR A 41 -6.804 9.375 -2.985 1.00 0.00 C ATOM 589 O TYR A 41 -7.325 10.434 -2.639 1.00 0.00 O ATOM 590 CB TYR A 41 -8.321 7.441 -3.387 1.00 0.00 C ATOM 591 CG TYR A 41 -9.555 8.001 -2.678 1.00 0.00 C ATOM 592 CD1 TYR A 41 -10.663 8.376 -3.412 1.00 0.00 C ATOM 593 CD2 TYR A 41 -9.562 8.133 -1.304 1.00 0.00 C ATOM 594 CE1 TYR A 41 -11.824 8.903 -2.744 1.00 0.00 C ATOM 595 CE2 TYR A 41 -10.723 8.660 -0.636 1.00 0.00 C ATOM 596 CZ TYR A 41 -11.797 9.020 -1.389 1.00 0.00 C ATOM 597 OH TYR A 41 -12.894 9.518 -0.758 1.00 0.00 O ATOM 0 H TYR A 41 -6.628 6.781 -4.919 1.00 0.00 H new ATOM 0 HA TYR A 41 -8.030 9.163 -4.714 1.00 0.00 H new ATOM 0 HB2 TYR A 41 -8.642 6.719 -4.138 1.00 0.00 H new ATOM 0 HB3 TYR A 41 -7.714 6.898 -2.663 1.00 0.00 H new ATOM 0 HD1 TYR A 41 -10.658 8.274 -4.487 1.00 0.00 H new ATOM 0 HD2 TYR A 41 -8.695 7.841 -0.730 1.00 0.00 H new ATOM 0 HE1 TYR A 41 -12.697 9.199 -3.306 1.00 0.00 H new ATOM 0 HE2 TYR A 41 -10.741 8.767 0.439 1.00 0.00 H new ATOM 0 HH TYR A 41 -12.732 9.543 0.208 1.00 0.00 H new ATOM 607 N GLY A 42 -5.675 8.896 -2.484 1.00 0.00 N ATOM 608 CA GLY A 42 -4.948 9.616 -1.453 1.00 0.00 C ATOM 609 C GLY A 42 -4.027 10.673 -2.068 1.00 0.00 C ATOM 610 O GLY A 42 -4.083 11.843 -1.693 1.00 0.00 O ATOM 0 H GLY A 42 -5.246 8.017 -2.773 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -5.653 10.094 -0.773 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -4.359 8.915 -0.861 1.00 0.00 H new ATOM 614 N ALA A 43 -3.202 10.222 -3.001 1.00 0.00 N ATOM 615 CA ALA A 43 -2.271 11.114 -3.671 1.00 0.00 C ATOM 616 C ALA A 43 -3.010 12.380 -4.109 1.00 0.00 C ATOM 617 O ALA A 43 -2.413 13.452 -4.198 1.00 0.00 O ATOM 618 CB ALA A 43 -1.620 10.383 -4.847 1.00 0.00 C ATOM 0 H ALA A 43 -3.159 9.251 -3.309 1.00 0.00 H new ATOM 0 HA ALA A 43 -1.473 11.416 -2.993 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -0.922 11.052 -5.350 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -1.084 9.508 -4.480 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -2.390 10.067 -5.551 1.00 0.00 H new ATOM 624 N TYR A 44 -4.298 12.214 -4.371 1.00 0.00 N ATOM 625 CA TYR A 44 -5.125 13.331 -4.797 1.00 0.00 C ATOM 626 C TYR A 44 -4.711 14.622 -4.088 1.00 0.00 C ATOM 627 O TYR A 44 -4.213 15.550 -4.722 1.00 0.00 O ATOM 628 CB TYR A 44 -6.556 12.975 -4.390 1.00 0.00 C ATOM 629 CG TYR A 44 -7.590 13.191 -5.498 1.00 0.00 C ATOM 630 CD1 TYR A 44 -7.333 12.743 -6.778 1.00 0.00 C ATOM 631 CD2 TYR A 44 -8.778 13.833 -5.217 1.00 0.00 C ATOM 632 CE1 TYR A 44 -8.306 12.946 -7.820 1.00 0.00 C ATOM 633 CE2 TYR A 44 -9.751 14.036 -6.259 1.00 0.00 C ATOM 634 CZ TYR A 44 -9.467 13.582 -7.509 1.00 0.00 C ATOM 635 OH TYR A 44 -10.385 13.773 -8.494 1.00 0.00 O ATOM 0 H TYR A 44 -4.789 11.323 -4.297 1.00 0.00 H new ATOM 0 HA TYR A 44 -5.024 13.496 -5.870 1.00 0.00 H new ATOM 0 HB2 TYR A 44 -6.585 11.931 -4.078 1.00 0.00 H new ATOM 0 HB3 TYR A 44 -6.836 13.574 -3.524 1.00 0.00 H new ATOM 0 HD1 TYR A 44 -6.403 12.240 -6.998 1.00 0.00 H new ATOM 0 HD2 TYR A 44 -8.979 14.184 -4.215 1.00 0.00 H new ATOM 0 HE1 TYR A 44 -8.118 12.601 -8.826 1.00 0.00 H new ATOM 0 HE2 TYR A 44 -10.685 14.537 -6.052 1.00 0.00 H new ATOM 0 HH TYR A 44 -11.165 14.239 -8.128 1.00 0.00 H new ATOM 645 N ARG A 45 -4.933 14.638 -2.782 1.00 0.00 N ATOM 646 CA ARG A 45 -4.590 15.800 -1.979 1.00 0.00 C ATOM 647 C ARG A 45 -3.113 15.752 -1.581 1.00 0.00 C ATOM 648 O ARG A 45 -2.533 16.772 -1.213 1.00 0.00 O ATOM 649 CB ARG A 45 -5.449 15.870 -0.715 1.00 0.00 C ATOM 650 CG ARG A 45 -5.634 17.318 -0.257 1.00 0.00 C ATOM 651 CD ARG A 45 -6.971 17.499 0.463 1.00 0.00 C ATOM 652 NE ARG A 45 -6.741 17.970 1.848 1.00 0.00 N ATOM 653 CZ ARG A 45 -7.699 18.469 2.640 1.00 0.00 C ATOM 654 NH1 ARG A 45 -8.958 18.567 2.190 1.00 0.00 N ATOM 655 NH2 ARG A 45 -7.398 18.872 3.883 1.00 0.00 N ATOM 0 H ARG A 45 -5.346 13.865 -2.260 1.00 0.00 H new ATOM 0 HA ARG A 45 -4.780 16.688 -2.583 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -6.422 15.418 -0.907 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -4.980 15.290 0.080 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -4.818 17.600 0.408 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -5.588 17.984 -1.118 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -7.589 18.217 -0.076 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -7.517 16.555 0.477 1.00 0.00 H new ATOM 0 HE ARG A 45 -5.794 17.911 2.222 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -9.187 18.261 1.244 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -9.687 18.947 2.794 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -6.440 18.798 4.225 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -8.127 19.252 4.487 1.00 0.00 H new ATOM 669 N VAL A 46 -2.548 14.557 -1.668 1.00 0.00 N ATOM 670 CA VAL A 46 -1.150 14.363 -1.322 1.00 0.00 C ATOM 671 C VAL A 46 -1.006 14.333 0.201 1.00 0.00 C ATOM 672 O VAL A 46 0.093 14.146 0.721 1.00 0.00 O ATOM 673 CB VAL A 46 -0.293 15.445 -1.982 1.00 0.00 C ATOM 674 CG1 VAL A 46 0.427 16.292 -0.931 1.00 0.00 C ATOM 675 CG2 VAL A 46 0.704 14.829 -2.966 1.00 0.00 C ATOM 0 H VAL A 46 -3.033 13.713 -1.973 1.00 0.00 H new ATOM 0 HA VAL A 46 -0.791 13.406 -1.702 1.00 0.00 H new ATOM 0 HB VAL A 46 -0.957 16.102 -2.544 1.00 0.00 H new ATOM 0 HG11 VAL A 46 1.029 17.053 -1.427 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -0.308 16.774 -0.286 1.00 0.00 H new ATOM 0 HG13 VAL A 46 1.074 15.653 -0.330 1.00 0.00 H new ATOM 0 HG21 VAL A 46 1.301 15.619 -3.422 1.00 0.00 H new ATOM 0 HG22 VAL A 46 1.360 14.139 -2.435 1.00 0.00 H new ATOM 0 HG23 VAL A 46 0.162 14.290 -3.743 1.00 0.00 H new ATOM 685 N SER A 47 -2.132 14.521 0.874 1.00 0.00 N ATOM 686 CA SER A 47 -2.145 14.517 2.327 1.00 0.00 C ATOM 687 C SER A 47 -2.464 13.113 2.844 1.00 0.00 C ATOM 688 O SER A 47 -2.732 12.931 4.031 1.00 0.00 O ATOM 689 CB SER A 47 -3.158 15.526 2.871 1.00 0.00 C ATOM 690 OG SER A 47 -2.618 16.304 3.936 1.00 0.00 O ATOM 0 H SER A 47 -3.042 14.677 0.440 1.00 0.00 H new ATOM 0 HA SER A 47 -1.156 14.810 2.679 1.00 0.00 H new ATOM 0 HB2 SER A 47 -3.479 16.187 2.066 1.00 0.00 H new ATOM 0 HB3 SER A 47 -4.044 14.997 3.222 1.00 0.00 H new ATOM 0 HG SER A 47 -3.295 16.937 4.255 1.00 0.00 H new ATOM 696 N ASN A 48 -2.426 12.157 1.928 1.00 0.00 N ATOM 697 CA ASN A 48 -2.708 10.775 2.277 1.00 0.00 C ATOM 698 C ASN A 48 -1.442 10.128 2.843 1.00 0.00 C ATOM 699 O ASN A 48 -1.368 9.839 4.036 1.00 0.00 O ATOM 700 CB ASN A 48 -3.139 9.973 1.047 1.00 0.00 C ATOM 701 CG ASN A 48 -3.269 8.486 1.380 1.00 0.00 C ATOM 702 OD1 ASN A 48 -4.001 8.084 2.270 1.00 0.00 O ATOM 703 ND2 ASN A 48 -2.521 7.693 0.618 1.00 0.00 N ATOM 0 H ASN A 48 -2.204 12.312 0.945 1.00 0.00 H new ATOM 0 HA ASN A 48 -3.514 10.770 3.011 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -4.092 10.351 0.678 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -2.411 10.108 0.247 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -2.538 6.683 0.762 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -1.930 8.095 -0.110 1.00 0.00 H new ATOM 710 N ASP A 49 -0.477 9.919 1.959 1.00 0.00 N ATOM 711 CA ASP A 49 0.782 9.312 2.355 1.00 0.00 C ATOM 712 C ASP A 49 1.940 10.183 1.865 1.00 0.00 C ATOM 713 O ASP A 49 3.089 9.743 1.850 1.00 0.00 O ATOM 714 CB ASP A 49 0.941 7.921 1.737 1.00 0.00 C ATOM 715 CG ASP A 49 1.355 6.821 2.717 1.00 0.00 C ATOM 716 OD1 ASP A 49 2.551 6.600 2.961 1.00 0.00 O ATOM 717 OD2 ASP A 49 0.378 6.168 3.247 1.00 0.00 O ATOM 0 H ASP A 49 -0.542 10.159 0.970 1.00 0.00 H new ATOM 0 HA ASP A 49 0.788 9.227 3.442 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -0.003 7.636 1.272 1.00 0.00 H new ATOM 0 HB3 ASP A 49 1.684 7.976 0.941 1.00 0.00 H new ATOM 722 N LYS A 50 1.598 11.402 1.475 1.00 0.00 N ATOM 723 CA LYS A 50 2.596 12.338 0.986 1.00 0.00 C ATOM 724 C LYS A 50 3.067 11.895 -0.401 1.00 0.00 C ATOM 725 O LYS A 50 2.465 12.258 -1.410 1.00 0.00 O ATOM 726 CB LYS A 50 3.730 12.493 2.001 1.00 0.00 C ATOM 727 CG LYS A 50 3.610 13.816 2.759 1.00 0.00 C ATOM 728 CD LYS A 50 4.949 14.215 3.382 1.00 0.00 C ATOM 729 CE LYS A 50 4.818 15.513 4.181 1.00 0.00 C ATOM 730 NZ LYS A 50 5.338 15.332 5.554 1.00 0.00 N ATOM 0 H LYS A 50 0.644 11.763 1.488 1.00 0.00 H new ATOM 0 HA LYS A 50 2.163 13.332 0.874 1.00 0.00 H new ATOM 0 HB2 LYS A 50 3.708 11.662 2.706 1.00 0.00 H new ATOM 0 HB3 LYS A 50 4.691 12.450 1.488 1.00 0.00 H new ATOM 0 HG2 LYS A 50 3.273 14.599 2.080 1.00 0.00 H new ATOM 0 HG3 LYS A 50 2.855 13.725 3.540 1.00 0.00 H new ATOM 0 HD2 LYS A 50 5.303 13.417 4.034 1.00 0.00 H new ATOM 0 HD3 LYS A 50 5.696 14.340 2.598 1.00 0.00 H new ATOM 0 HE2 LYS A 50 5.366 16.312 3.681 1.00 0.00 H new ATOM 0 HE3 LYS A 50 3.773 15.819 4.219 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 5.241 16.223 6.082 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 4.798 14.584 6.034 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 6.341 15.061 5.512 1.00 0.00 H new ATOM 744 N ARG A 51 4.140 11.118 -0.405 1.00 0.00 N ATOM 745 CA ARG A 51 4.700 10.622 -1.651 1.00 0.00 C ATOM 746 C ARG A 51 3.580 10.228 -2.616 1.00 0.00 C ATOM 747 O ARG A 51 2.480 9.881 -2.188 1.00 0.00 O ATOM 748 CB ARG A 51 5.602 9.411 -1.406 1.00 0.00 C ATOM 749 CG ARG A 51 6.727 9.754 -0.427 1.00 0.00 C ATOM 750 CD ARG A 51 6.776 8.748 0.726 1.00 0.00 C ATOM 751 NE ARG A 51 7.070 7.395 0.204 1.00 0.00 N ATOM 752 CZ ARG A 51 7.609 6.409 0.935 1.00 0.00 C ATOM 753 NH1 ARG A 51 7.916 6.620 2.222 1.00 0.00 N ATOM 754 NH2 ARG A 51 7.841 5.213 0.378 1.00 0.00 N ATOM 0 H ARG A 51 4.637 10.820 0.435 1.00 0.00 H new ATOM 0 HA ARG A 51 5.297 11.422 -2.088 1.00 0.00 H new ATOM 0 HB2 ARG A 51 5.010 8.586 -1.010 1.00 0.00 H new ATOM 0 HB3 ARG A 51 6.028 9.073 -2.351 1.00 0.00 H new ATOM 0 HG2 ARG A 51 7.682 9.758 -0.952 1.00 0.00 H new ATOM 0 HG3 ARG A 51 6.576 10.759 -0.032 1.00 0.00 H new ATOM 0 HD2 ARG A 51 7.540 9.043 1.445 1.00 0.00 H new ATOM 0 HD3 ARG A 51 5.824 8.743 1.256 1.00 0.00 H new ATOM 0 HE ARG A 51 6.849 7.201 -0.773 1.00 0.00 H new ATOM 0 HH11 ARG A 51 7.740 7.531 2.646 1.00 0.00 H new ATOM 0 HH12 ARG A 51 8.326 5.870 2.778 1.00 0.00 H new ATOM 0 HH21 ARG A 51 7.608 5.053 -0.602 1.00 0.00 H new ATOM 0 HH22 ARG A 51 8.251 4.462 0.934 1.00 0.00 H new ATOM 768 N ASP A 52 3.899 10.295 -3.901 1.00 0.00 N ATOM 769 CA ASP A 52 2.933 9.950 -4.930 1.00 0.00 C ATOM 770 C ASP A 52 3.421 8.713 -5.686 1.00 0.00 C ATOM 771 O ASP A 52 2.794 7.656 -5.625 1.00 0.00 O ATOM 772 CB ASP A 52 2.773 11.089 -5.939 1.00 0.00 C ATOM 773 CG ASP A 52 1.348 11.301 -6.454 1.00 0.00 C ATOM 774 OD1 ASP A 52 0.908 10.376 -7.238 1.00 0.00 O ATOM 775 OD2 ASP A 52 0.692 12.300 -6.124 1.00 0.00 O ATOM 0 H ASP A 52 4.812 10.583 -4.252 1.00 0.00 H new ATOM 0 HA ASP A 52 1.975 9.761 -4.445 1.00 0.00 H new ATOM 0 HB2 ASP A 52 3.118 12.014 -5.477 1.00 0.00 H new ATOM 0 HB3 ASP A 52 3.426 10.895 -6.790 1.00 0.00 H new ATOM 780 N VAL A 53 4.535 8.885 -6.382 1.00 0.00 N ATOM 781 CA VAL A 53 5.114 7.795 -7.149 1.00 0.00 C ATOM 782 C VAL A 53 6.069 7.000 -6.257 1.00 0.00 C ATOM 783 O VAL A 53 6.306 5.817 -6.495 1.00 0.00 O ATOM 784 CB VAL A 53 5.789 8.343 -8.408 1.00 0.00 C ATOM 785 CG1 VAL A 53 6.268 7.205 -9.313 1.00 0.00 C ATOM 786 CG2 VAL A 53 4.854 9.288 -9.165 1.00 0.00 C ATOM 0 H VAL A 53 5.052 9.763 -6.431 1.00 0.00 H new ATOM 0 HA VAL A 53 4.336 7.109 -7.485 1.00 0.00 H new ATOM 0 HB VAL A 53 6.663 8.915 -8.097 1.00 0.00 H new ATOM 0 HG11 VAL A 53 6.744 7.622 -10.201 1.00 0.00 H new ATOM 0 HG12 VAL A 53 6.986 6.588 -8.772 1.00 0.00 H new ATOM 0 HG13 VAL A 53 5.416 6.594 -9.611 1.00 0.00 H new ATOM 0 HG21 VAL A 53 5.359 9.663 -10.055 1.00 0.00 H new ATOM 0 HG22 VAL A 53 3.952 8.750 -9.458 1.00 0.00 H new ATOM 0 HG23 VAL A 53 4.584 10.125 -8.521 1.00 0.00 H new ATOM 796 N LYS A 54 6.592 7.682 -5.248 1.00 0.00 N ATOM 797 CA LYS A 54 7.515 7.054 -4.319 1.00 0.00 C ATOM 798 C LYS A 54 6.804 5.910 -3.593 1.00 0.00 C ATOM 799 O LYS A 54 7.374 4.836 -3.410 1.00 0.00 O ATOM 800 CB LYS A 54 8.121 8.097 -3.378 1.00 0.00 C ATOM 801 CG LYS A 54 9.627 8.237 -3.610 1.00 0.00 C ATOM 802 CD LYS A 54 10.107 9.647 -3.262 1.00 0.00 C ATOM 803 CE LYS A 54 10.734 10.329 -4.479 1.00 0.00 C ATOM 804 NZ LYS A 54 10.440 11.780 -4.469 1.00 0.00 N ATOM 0 H LYS A 54 6.394 8.664 -5.054 1.00 0.00 H new ATOM 0 HA LYS A 54 8.356 6.616 -4.856 1.00 0.00 H new ATOM 0 HB2 LYS A 54 7.634 9.060 -3.535 1.00 0.00 H new ATOM 0 HB3 LYS A 54 7.934 7.810 -2.343 1.00 0.00 H new ATOM 0 HG2 LYS A 54 10.161 7.507 -3.002 1.00 0.00 H new ATOM 0 HG3 LYS A 54 9.860 8.016 -4.652 1.00 0.00 H new ATOM 0 HD2 LYS A 54 9.268 10.241 -2.900 1.00 0.00 H new ATOM 0 HD3 LYS A 54 10.836 9.598 -2.453 1.00 0.00 H new ATOM 0 HE2 LYS A 54 11.812 10.170 -4.477 1.00 0.00 H new ATOM 0 HE3 LYS A 54 10.348 9.880 -5.394 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 10.873 12.228 -5.302 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 9.411 11.926 -4.493 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 10.830 12.207 -3.605 1.00 0.00 H new ATOM 818 N VAL A 55 5.568 6.181 -3.199 1.00 0.00 N ATOM 819 CA VAL A 55 4.772 5.188 -2.498 1.00 0.00 C ATOM 820 C VAL A 55 4.341 4.098 -3.481 1.00 0.00 C ATOM 821 O VAL A 55 4.288 2.921 -3.126 1.00 0.00 O ATOM 822 CB VAL A 55 3.591 5.863 -1.798 1.00 0.00 C ATOM 823 CG1 VAL A 55 2.625 6.472 -2.817 1.00 0.00 C ATOM 824 CG2 VAL A 55 2.866 4.882 -0.875 1.00 0.00 C ATOM 0 H VAL A 55 5.099 7.074 -3.352 1.00 0.00 H new ATOM 0 HA VAL A 55 5.363 4.707 -1.719 1.00 0.00 H new ATOM 0 HB VAL A 55 3.985 6.672 -1.183 1.00 0.00 H new ATOM 0 HG11 VAL A 55 1.795 6.945 -2.293 1.00 0.00 H new ATOM 0 HG12 VAL A 55 3.149 7.217 -3.415 1.00 0.00 H new ATOM 0 HG13 VAL A 55 2.242 5.687 -3.470 1.00 0.00 H new ATOM 0 HG21 VAL A 55 2.031 5.388 -0.390 1.00 0.00 H new ATOM 0 HG22 VAL A 55 2.491 4.042 -1.459 1.00 0.00 H new ATOM 0 HG23 VAL A 55 3.558 4.516 -0.117 1.00 0.00 H new ATOM 834 N SER A 56 4.044 4.528 -4.699 1.00 0.00 N ATOM 835 CA SER A 56 3.619 3.603 -5.736 1.00 0.00 C ATOM 836 C SER A 56 4.639 2.472 -5.878 1.00 0.00 C ATOM 837 O SER A 56 4.303 1.302 -5.700 1.00 0.00 O ATOM 838 CB SER A 56 3.435 4.323 -7.073 1.00 0.00 C ATOM 839 OG SER A 56 2.291 3.851 -7.780 1.00 0.00 O ATOM 0 H SER A 56 4.089 5.504 -4.991 1.00 0.00 H new ATOM 0 HA SER A 56 2.657 3.181 -5.446 1.00 0.00 H new ATOM 0 HB2 SER A 56 3.336 5.394 -6.897 1.00 0.00 H new ATOM 0 HB3 SER A 56 4.325 4.181 -7.687 1.00 0.00 H new ATOM 0 HG SER A 56 2.442 3.942 -8.744 1.00 0.00 H new ATOM 845 N LEU A 57 5.865 2.860 -6.198 1.00 0.00 N ATOM 846 CA LEU A 57 6.936 1.893 -6.366 1.00 0.00 C ATOM 847 C LEU A 57 7.261 1.258 -5.013 1.00 0.00 C ATOM 848 O LEU A 57 7.079 0.056 -4.828 1.00 0.00 O ATOM 849 CB LEU A 57 8.143 2.543 -7.046 1.00 0.00 C ATOM 850 CG LEU A 57 9.361 1.642 -7.255 1.00 0.00 C ATOM 851 CD1 LEU A 57 9.865 1.727 -8.697 1.00 0.00 C ATOM 852 CD2 LEU A 57 10.462 1.964 -6.243 1.00 0.00 C ATOM 0 H LEU A 57 6.140 3.831 -6.345 1.00 0.00 H new ATOM 0 HA LEU A 57 6.621 1.087 -7.029 1.00 0.00 H new ATOM 0 HB2 LEU A 57 7.826 2.923 -8.017 1.00 0.00 H new ATOM 0 HB3 LEU A 57 8.450 3.403 -6.451 1.00 0.00 H new ATOM 0 HG LEU A 57 9.056 0.610 -7.081 1.00 0.00 H new ATOM 0 HD11 LEU A 57 10.731 1.077 -8.819 1.00 0.00 H new ATOM 0 HD12 LEU A 57 9.075 1.410 -9.378 1.00 0.00 H new ATOM 0 HD13 LEU A 57 10.148 2.755 -8.923 1.00 0.00 H new ATOM 0 HD21 LEU A 57 11.316 1.309 -6.414 1.00 0.00 H new ATOM 0 HD22 LEU A 57 10.772 3.002 -6.360 1.00 0.00 H new ATOM 0 HD23 LEU A 57 10.084 1.810 -5.232 1.00 0.00 H new ATOM 864 N PHE A 58 7.737 2.094 -4.102 1.00 0.00 N ATOM 865 CA PHE A 58 8.089 1.629 -2.771 1.00 0.00 C ATOM 866 C PHE A 58 7.104 0.564 -2.284 1.00 0.00 C ATOM 867 O PHE A 58 7.501 -0.407 -1.641 1.00 0.00 O ATOM 868 CB PHE A 58 8.014 2.840 -1.839 1.00 0.00 C ATOM 869 CG PHE A 58 8.319 2.519 -0.375 1.00 0.00 C ATOM 870 CD1 PHE A 58 9.605 2.339 0.029 1.00 0.00 C ATOM 871 CD2 PHE A 58 7.303 2.413 0.524 1.00 0.00 C ATOM 872 CE1 PHE A 58 9.888 2.041 1.388 1.00 0.00 C ATOM 873 CE2 PHE A 58 7.586 2.115 1.883 1.00 0.00 C ATOM 874 CZ PHE A 58 8.872 1.935 2.286 1.00 0.00 C ATOM 0 H PHE A 58 7.887 3.091 -4.259 1.00 0.00 H new ATOM 0 HA PHE A 58 9.085 1.186 -2.783 1.00 0.00 H new ATOM 0 HB2 PHE A 58 8.716 3.598 -2.188 1.00 0.00 H new ATOM 0 HB3 PHE A 58 7.017 3.275 -1.905 1.00 0.00 H new ATOM 0 HD1 PHE A 58 10.412 2.423 -0.684 1.00 0.00 H new ATOM 0 HD2 PHE A 58 6.281 2.556 0.204 1.00 0.00 H new ATOM 0 HE1 PHE A 58 10.909 1.899 1.709 1.00 0.00 H new ATOM 0 HE2 PHE A 58 6.780 2.031 2.597 1.00 0.00 H new ATOM 0 HZ PHE A 58 9.087 1.708 3.320 1.00 0.00 H new ATOM 884 N THR A 59 5.838 0.782 -2.608 1.00 0.00 N ATOM 885 CA THR A 59 4.793 -0.147 -2.212 1.00 0.00 C ATOM 886 C THR A 59 4.911 -1.451 -3.003 1.00 0.00 C ATOM 887 O THR A 59 5.107 -2.518 -2.422 1.00 0.00 O ATOM 888 CB THR A 59 3.445 0.553 -2.392 1.00 0.00 C ATOM 889 OG1 THR A 59 3.427 1.542 -1.366 1.00 0.00 O ATOM 890 CG2 THR A 59 2.263 -0.357 -2.053 1.00 0.00 C ATOM 0 H THR A 59 5.512 1.589 -3.140 1.00 0.00 H new ATOM 0 HA THR A 59 4.891 -0.429 -1.164 1.00 0.00 H new ATOM 0 HB THR A 59 3.352 0.901 -3.421 1.00 0.00 H new ATOM 0 HG1 THR A 59 3.956 2.317 -1.649 1.00 0.00 H new ATOM 0 HG21 THR A 59 1.331 0.189 -2.198 1.00 0.00 H new ATOM 0 HG22 THR A 59 2.277 -1.230 -2.705 1.00 0.00 H new ATOM 0 HG23 THR A 59 2.338 -0.679 -1.014 1.00 0.00 H new ATOM 898 N ALA A 60 4.787 -1.323 -4.316 1.00 0.00 N ATOM 899 CA ALA A 60 4.877 -2.479 -5.192 1.00 0.00 C ATOM 900 C ALA A 60 6.006 -3.392 -4.710 1.00 0.00 C ATOM 901 O ALA A 60 5.852 -4.612 -4.678 1.00 0.00 O ATOM 902 CB ALA A 60 5.081 -2.011 -6.634 1.00 0.00 C ATOM 0 H ALA A 60 4.625 -0.437 -4.794 1.00 0.00 H new ATOM 0 HA ALA A 60 3.952 -3.055 -5.164 1.00 0.00 H new ATOM 0 HB1 ALA A 60 5.149 -2.878 -7.292 1.00 0.00 H new ATOM 0 HB2 ALA A 60 4.238 -1.390 -6.938 1.00 0.00 H new ATOM 0 HB3 ALA A 60 6.002 -1.432 -6.702 1.00 0.00 H new ATOM 908 N PHE A 61 7.116 -2.766 -4.348 1.00 0.00 N ATOM 909 CA PHE A 61 8.271 -3.507 -3.869 1.00 0.00 C ATOM 910 C PHE A 61 7.999 -4.117 -2.493 1.00 0.00 C ATOM 911 O PHE A 61 8.353 -5.268 -2.239 1.00 0.00 O ATOM 912 CB PHE A 61 9.425 -2.510 -3.753 1.00 0.00 C ATOM 913 CG PHE A 61 10.425 -2.578 -4.909 1.00 0.00 C ATOM 914 CD1 PHE A 61 10.172 -1.911 -6.067 1.00 0.00 C ATOM 915 CD2 PHE A 61 11.567 -3.306 -4.779 1.00 0.00 C ATOM 916 CE1 PHE A 61 11.100 -1.974 -7.140 1.00 0.00 C ATOM 917 CE2 PHE A 61 12.495 -3.369 -5.852 1.00 0.00 C ATOM 918 CZ PHE A 61 12.242 -2.701 -7.010 1.00 0.00 C ATOM 0 H PHE A 61 7.240 -1.754 -4.377 1.00 0.00 H new ATOM 0 HA PHE A 61 8.503 -4.320 -4.557 1.00 0.00 H new ATOM 0 HB2 PHE A 61 9.016 -1.501 -3.699 1.00 0.00 H new ATOM 0 HB3 PHE A 61 9.954 -2.690 -2.817 1.00 0.00 H new ATOM 0 HD1 PHE A 61 9.265 -1.333 -6.170 1.00 0.00 H new ATOM 0 HD2 PHE A 61 11.768 -3.836 -3.860 1.00 0.00 H new ATOM 0 HE1 PHE A 61 10.899 -1.444 -8.060 1.00 0.00 H new ATOM 0 HE2 PHE A 61 13.401 -3.947 -5.749 1.00 0.00 H new ATOM 0 HZ PHE A 61 12.948 -2.748 -7.826 1.00 0.00 H new ATOM 928 N PHE A 62 7.373 -3.319 -1.640 1.00 0.00 N ATOM 929 CA PHE A 62 7.049 -3.766 -0.296 1.00 0.00 C ATOM 930 C PHE A 62 6.066 -4.938 -0.330 1.00 0.00 C ATOM 931 O PHE A 62 6.393 -6.040 0.110 1.00 0.00 O ATOM 932 CB PHE A 62 6.392 -2.586 0.422 1.00 0.00 C ATOM 933 CG PHE A 62 7.024 -2.250 1.774 1.00 0.00 C ATOM 934 CD1 PHE A 62 8.357 -1.995 1.857 1.00 0.00 C ATOM 935 CD2 PHE A 62 6.252 -2.205 2.893 1.00 0.00 C ATOM 936 CE1 PHE A 62 8.944 -1.684 3.112 1.00 0.00 C ATOM 937 CE2 PHE A 62 6.839 -1.894 4.148 1.00 0.00 C ATOM 938 CZ PHE A 62 8.172 -1.639 4.231 1.00 0.00 C ATOM 0 H PHE A 62 7.082 -2.365 -1.854 1.00 0.00 H new ATOM 0 HA PHE A 62 7.953 -4.100 0.213 1.00 0.00 H new ATOM 0 HB2 PHE A 62 6.446 -1.707 -0.221 1.00 0.00 H new ATOM 0 HB3 PHE A 62 5.335 -2.808 0.572 1.00 0.00 H new ATOM 0 HD1 PHE A 62 8.970 -2.029 0.968 1.00 0.00 H new ATOM 0 HD2 PHE A 62 5.193 -2.406 2.827 1.00 0.00 H new ATOM 0 HE1 PHE A 62 10.003 -1.483 3.178 1.00 0.00 H new ATOM 0 HE2 PHE A 62 6.226 -1.860 5.037 1.00 0.00 H new ATOM 0 HZ PHE A 62 8.618 -1.401 5.185 1.00 0.00 H new ATOM 948 N LEU A 63 4.882 -4.662 -0.856 1.00 0.00 N ATOM 949 CA LEU A 63 3.850 -5.679 -0.953 1.00 0.00 C ATOM 950 C LEU A 63 4.416 -6.907 -1.669 1.00 0.00 C ATOM 951 O LEU A 63 4.140 -8.040 -1.278 1.00 0.00 O ATOM 952 CB LEU A 63 2.594 -5.107 -1.613 1.00 0.00 C ATOM 953 CG LEU A 63 1.308 -5.185 -0.788 1.00 0.00 C ATOM 954 CD1 LEU A 63 0.500 -3.892 -0.908 1.00 0.00 C ATOM 955 CD2 LEU A 63 0.482 -6.415 -1.174 1.00 0.00 C ATOM 0 H LEU A 63 4.614 -3.747 -1.220 1.00 0.00 H new ATOM 0 HA LEU A 63 3.540 -6.003 0.041 1.00 0.00 H new ATOM 0 HB2 LEU A 63 2.781 -4.062 -1.860 1.00 0.00 H new ATOM 0 HB3 LEU A 63 2.431 -5.632 -2.554 1.00 0.00 H new ATOM 0 HG LEU A 63 1.582 -5.297 0.261 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -0.409 -3.974 -0.312 1.00 0.00 H new ATOM 0 HD12 LEU A 63 1.097 -3.055 -0.546 1.00 0.00 H new ATOM 0 HD13 LEU A 63 0.235 -3.724 -1.952 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -0.427 -6.446 -0.573 1.00 0.00 H new ATOM 0 HD22 LEU A 63 0.217 -6.358 -2.230 1.00 0.00 H new ATOM 0 HD23 LEU A 63 1.067 -7.317 -0.995 1.00 0.00 H new ATOM 967 N ALA A 64 5.197 -6.640 -2.705 1.00 0.00 N ATOM 968 CA ALA A 64 5.805 -7.709 -3.480 1.00 0.00 C ATOM 969 C ALA A 64 6.565 -8.646 -2.539 1.00 0.00 C ATOM 970 O ALA A 64 6.333 -9.854 -2.539 1.00 0.00 O ATOM 971 CB ALA A 64 6.707 -7.109 -4.559 1.00 0.00 C ATOM 0 H ALA A 64 5.423 -5.699 -3.026 1.00 0.00 H new ATOM 0 HA ALA A 64 5.041 -8.299 -3.986 1.00 0.00 H new ATOM 0 HB1 ALA A 64 7.163 -7.911 -5.140 1.00 0.00 H new ATOM 0 HB2 ALA A 64 6.114 -6.475 -5.218 1.00 0.00 H new ATOM 0 HB3 ALA A 64 7.489 -6.512 -4.089 1.00 0.00 H new ATOM 977 N THR A 65 7.457 -8.054 -1.759 1.00 0.00 N ATOM 978 CA THR A 65 8.253 -8.821 -0.815 1.00 0.00 C ATOM 979 C THR A 65 7.351 -9.484 0.227 1.00 0.00 C ATOM 980 O THR A 65 7.335 -10.708 0.351 1.00 0.00 O ATOM 981 CB THR A 65 9.298 -7.883 -0.207 1.00 0.00 C ATOM 982 OG1 THR A 65 10.365 -7.893 -1.151 1.00 0.00 O ATOM 983 CG2 THR A 65 9.923 -8.453 1.068 1.00 0.00 C ATOM 0 H THR A 65 7.647 -7.052 -1.761 1.00 0.00 H new ATOM 0 HA THR A 65 8.778 -9.638 -1.311 1.00 0.00 H new ATOM 0 HB THR A 65 8.838 -6.920 0.013 1.00 0.00 H new ATOM 0 HG1 THR A 65 11.086 -7.308 -0.836 1.00 0.00 H new ATOM 0 HG21 THR A 65 10.657 -7.749 1.459 1.00 0.00 H new ATOM 0 HG22 THR A 65 9.144 -8.617 1.813 1.00 0.00 H new ATOM 0 HG23 THR A 65 10.413 -9.400 0.841 1.00 0.00 H new ATOM 991 N ILE A 66 6.621 -8.647 0.950 1.00 0.00 N ATOM 992 CA ILE A 66 5.719 -9.137 1.978 1.00 0.00 C ATOM 993 C ILE A 66 5.021 -10.402 1.477 1.00 0.00 C ATOM 994 O ILE A 66 5.001 -11.420 2.168 1.00 0.00 O ATOM 995 CB ILE A 66 4.753 -8.033 2.414 1.00 0.00 C ATOM 996 CG1 ILE A 66 5.499 -6.899 3.120 1.00 0.00 C ATOM 997 CG2 ILE A 66 3.625 -8.601 3.277 1.00 0.00 C ATOM 998 CD1 ILE A 66 5.796 -7.261 4.577 1.00 0.00 C ATOM 0 H ILE A 66 6.636 -7.633 0.844 1.00 0.00 H new ATOM 0 HA ILE A 66 6.276 -9.413 2.873 1.00 0.00 H new ATOM 0 HB ILE A 66 4.293 -7.609 1.521 1.00 0.00 H new ATOM 0 HG12 ILE A 66 6.432 -6.691 2.596 1.00 0.00 H new ATOM 0 HG13 ILE A 66 4.902 -5.988 3.082 1.00 0.00 H new ATOM 0 HG21 ILE A 66 2.953 -7.796 3.573 1.00 0.00 H new ATOM 0 HG22 ILE A 66 3.070 -9.346 2.706 1.00 0.00 H new ATOM 0 HG23 ILE A 66 4.047 -9.067 4.167 1.00 0.00 H new ATOM 0 HD11 ILE A 66 6.327 -6.438 5.055 1.00 0.00 H new ATOM 0 HD12 ILE A 66 4.860 -7.445 5.104 1.00 0.00 H new ATOM 0 HD13 ILE A 66 6.413 -8.159 4.610 1.00 0.00 H new ATOM 1010 N MET A 67 4.464 -10.297 0.279 1.00 0.00 N ATOM 1011 CA MET A 67 3.766 -11.421 -0.322 1.00 0.00 C ATOM 1012 C MET A 67 4.702 -12.619 -0.496 1.00 0.00 C ATOM 1013 O MET A 67 4.494 -13.668 0.111 1.00 0.00 O ATOM 1014 CB MET A 67 3.210 -11.006 -1.686 1.00 0.00 C ATOM 1015 CG MET A 67 2.072 -9.995 -1.529 1.00 0.00 C ATOM 1016 SD MET A 67 0.572 -10.650 -2.241 1.00 0.00 S ATOM 1017 CE MET A 67 0.304 -9.462 -3.546 1.00 0.00 C ATOM 0 H MET A 67 4.482 -9.451 -0.291 1.00 0.00 H new ATOM 0 HA MET A 67 2.951 -11.714 0.340 1.00 0.00 H new ATOM 0 HB2 MET A 67 4.006 -10.572 -2.291 1.00 0.00 H new ATOM 0 HB3 MET A 67 2.849 -11.886 -2.219 1.00 0.00 H new ATOM 0 HG2 MET A 67 1.916 -9.771 -0.474 1.00 0.00 H new ATOM 0 HG3 MET A 67 2.337 -9.057 -2.018 1.00 0.00 H new ATOM 0 HE1 MET A 67 -0.739 -9.495 -3.859 1.00 0.00 H new ATOM 0 HE2 MET A 67 0.542 -8.462 -3.183 1.00 0.00 H new ATOM 0 HE3 MET A 67 0.945 -9.702 -4.394 1.00 0.00 H new ATOM 1027 N GLY A 68 5.715 -12.422 -1.328 1.00 0.00 N ATOM 1028 CA GLY A 68 6.684 -13.473 -1.589 1.00 0.00 C ATOM 1029 C GLY A 68 6.198 -14.401 -2.704 1.00 0.00 C ATOM 1030 O GLY A 68 6.449 -15.605 -2.667 1.00 0.00 O ATOM 0 H GLY A 68 5.885 -11.550 -1.830 1.00 0.00 H new ATOM 0 HA2 GLY A 68 7.640 -13.030 -1.870 1.00 0.00 H new ATOM 0 HA3 GLY A 68 6.855 -14.049 -0.680 1.00 0.00 H new ATOM 1034 N VAL A 69 5.512 -13.807 -3.669 1.00 0.00 N ATOM 1035 CA VAL A 69 4.990 -14.566 -4.792 1.00 0.00 C ATOM 1036 C VAL A 69 6.148 -15.237 -5.532 1.00 0.00 C ATOM 1037 O VAL A 69 5.978 -16.303 -6.124 1.00 0.00 O ATOM 1038 CB VAL A 69 4.152 -13.657 -5.694 1.00 0.00 C ATOM 1039 CG1 VAL A 69 3.619 -14.426 -6.905 1.00 0.00 C ATOM 1040 CG2 VAL A 69 3.008 -13.010 -4.909 1.00 0.00 C ATOM 0 H VAL A 69 5.306 -12.808 -3.696 1.00 0.00 H new ATOM 0 HA VAL A 69 4.326 -15.357 -4.442 1.00 0.00 H new ATOM 0 HB VAL A 69 4.800 -12.861 -6.061 1.00 0.00 H new ATOM 0 HG11 VAL A 69 3.027 -13.757 -7.529 1.00 0.00 H new ATOM 0 HG12 VAL A 69 4.455 -14.818 -7.484 1.00 0.00 H new ATOM 0 HG13 VAL A 69 2.995 -15.252 -6.565 1.00 0.00 H new ATOM 0 HG21 VAL A 69 2.428 -12.369 -5.573 1.00 0.00 H new ATOM 0 HG22 VAL A 69 2.363 -13.787 -4.500 1.00 0.00 H new ATOM 0 HG23 VAL A 69 3.418 -12.412 -4.095 1.00 0.00 H new ATOM 1050 N ARG A 70 7.301 -14.587 -5.475 1.00 0.00 N ATOM 1051 CA ARG A 70 8.488 -15.108 -6.132 1.00 0.00 C ATOM 1052 C ARG A 70 8.844 -16.486 -5.571 1.00 0.00 C ATOM 1053 O ARG A 70 9.360 -16.593 -4.459 1.00 0.00 O ATOM 1054 CB ARG A 70 9.679 -14.166 -5.946 1.00 0.00 C ATOM 1055 CG ARG A 70 10.862 -14.599 -6.814 1.00 0.00 C ATOM 1056 CD ARG A 70 12.185 -14.415 -6.069 1.00 0.00 C ATOM 1057 NE ARG A 70 12.942 -15.687 -6.059 1.00 0.00 N ATOM 1058 CZ ARG A 70 13.639 -16.154 -7.104 1.00 0.00 C ATOM 1059 NH1 ARG A 70 13.680 -15.458 -8.248 1.00 0.00 N ATOM 1060 NH2 ARG A 70 14.295 -17.318 -7.005 1.00 0.00 N ATOM 0 H ARG A 70 7.439 -13.704 -4.984 1.00 0.00 H new ATOM 0 HA ARG A 70 8.268 -15.191 -7.196 1.00 0.00 H new ATOM 0 HB2 ARG A 70 9.386 -13.149 -6.205 1.00 0.00 H new ATOM 0 HB3 ARG A 70 9.978 -14.154 -4.898 1.00 0.00 H new ATOM 0 HG2 ARG A 70 10.744 -15.644 -7.100 1.00 0.00 H new ATOM 0 HG3 ARG A 70 10.875 -14.016 -7.735 1.00 0.00 H new ATOM 0 HD2 ARG A 70 12.776 -13.634 -6.548 1.00 0.00 H new ATOM 0 HD3 ARG A 70 11.994 -14.088 -5.047 1.00 0.00 H new ATOM 0 HE ARG A 70 12.933 -16.243 -5.204 1.00 0.00 H new ATOM 0 HH11 ARG A 70 13.180 -14.572 -8.324 1.00 0.00 H new ATOM 0 HH12 ARG A 70 14.211 -15.814 -9.043 1.00 0.00 H new ATOM 0 HH21 ARG A 70 14.264 -17.849 -6.134 1.00 0.00 H new ATOM 0 HH22 ARG A 70 14.826 -17.674 -7.800 1.00 0.00 H new ATOM 1074 N PHE A 71 8.554 -17.506 -6.366 1.00 0.00 N ATOM 1075 CA PHE A 71 8.837 -18.873 -5.962 1.00 0.00 C ATOM 1076 C PHE A 71 8.731 -19.829 -7.152 1.00 0.00 C ATOM 1077 O PHE A 71 8.050 -20.850 -7.074 1.00 0.00 O ATOM 1078 CB PHE A 71 7.786 -19.258 -4.919 1.00 0.00 C ATOM 1079 CG PHE A 71 8.250 -20.337 -3.938 1.00 0.00 C ATOM 1080 CD1 PHE A 71 9.312 -20.102 -3.122 1.00 0.00 C ATOM 1081 CD2 PHE A 71 7.600 -21.530 -3.882 1.00 0.00 C ATOM 1082 CE1 PHE A 71 9.743 -21.104 -2.211 1.00 0.00 C ATOM 1083 CE2 PHE A 71 8.030 -22.531 -2.972 1.00 0.00 C ATOM 1084 CZ PHE A 71 9.092 -22.297 -2.155 1.00 0.00 C ATOM 0 H PHE A 71 8.126 -17.413 -7.287 1.00 0.00 H new ATOM 0 HA PHE A 71 9.849 -18.941 -5.564 1.00 0.00 H new ATOM 0 HB2 PHE A 71 7.503 -18.368 -4.357 1.00 0.00 H new ATOM 0 HB3 PHE A 71 6.891 -19.609 -5.432 1.00 0.00 H new ATOM 0 HD1 PHE A 71 9.828 -19.154 -3.166 1.00 0.00 H new ATOM 0 HD2 PHE A 71 6.756 -21.716 -4.530 1.00 0.00 H new ATOM 0 HE1 PHE A 71 10.587 -20.918 -1.563 1.00 0.00 H new ATOM 0 HE2 PHE A 71 7.514 -23.479 -2.928 1.00 0.00 H new ATOM 0 HZ PHE A 71 9.418 -23.058 -1.462 1.00 0.00 H new ATOM 1094 N LYS A 72 9.415 -19.464 -8.227 1.00 0.00 N ATOM 1095 CA LYS A 72 9.406 -20.276 -9.431 1.00 0.00 C ATOM 1096 C LYS A 72 10.026 -19.481 -10.582 1.00 0.00 C ATOM 1097 O LYS A 72 10.509 -18.367 -10.382 1.00 0.00 O ATOM 1098 CB LYS A 72 7.993 -20.783 -9.725 1.00 0.00 C ATOM 1099 CG LYS A 72 7.830 -22.239 -9.283 1.00 0.00 C ATOM 1100 CD LYS A 72 7.325 -23.109 -10.436 1.00 0.00 C ATOM 1101 CE LYS A 72 6.745 -24.426 -9.917 1.00 0.00 C ATOM 1102 NZ LYS A 72 5.354 -24.231 -9.449 1.00 0.00 N ATOM 0 H LYS A 72 9.979 -18.616 -8.289 1.00 0.00 H new ATOM 0 HA LYS A 72 10.017 -21.168 -9.293 1.00 0.00 H new ATOM 0 HB2 LYS A 72 7.264 -20.159 -9.209 1.00 0.00 H new ATOM 0 HB3 LYS A 72 7.787 -20.698 -10.792 1.00 0.00 H new ATOM 0 HG2 LYS A 72 8.785 -22.623 -8.924 1.00 0.00 H new ATOM 0 HG3 LYS A 72 7.131 -22.293 -8.448 1.00 0.00 H new ATOM 0 HD2 LYS A 72 6.563 -22.568 -10.997 1.00 0.00 H new ATOM 0 HD3 LYS A 72 8.143 -23.315 -11.126 1.00 0.00 H new ATOM 0 HE2 LYS A 72 6.767 -25.176 -10.707 1.00 0.00 H new ATOM 0 HE3 LYS A 72 7.360 -24.804 -9.101 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 4.975 -25.135 -9.100 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 5.341 -23.530 -8.681 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 4.767 -23.891 -10.237 1.00 0.00 H new ATOM 1116 N ARG A 73 9.991 -20.083 -11.762 1.00 0.00 N ATOM 1117 CA ARG A 73 10.543 -19.445 -12.944 1.00 0.00 C ATOM 1118 C ARG A 73 9.605 -18.342 -13.439 1.00 0.00 C ATOM 1119 O ARG A 73 9.150 -18.374 -14.581 1.00 0.00 O ATOM 1120 CB ARG A 73 10.761 -20.461 -14.067 1.00 0.00 C ATOM 1121 CG ARG A 73 12.031 -20.141 -14.857 1.00 0.00 C ATOM 1122 CD ARG A 73 13.021 -21.307 -14.798 1.00 0.00 C ATOM 1123 NE ARG A 73 14.116 -20.993 -13.854 1.00 0.00 N ATOM 1124 CZ ARG A 73 15.216 -20.301 -14.181 1.00 0.00 C ATOM 1125 NH1 ARG A 73 15.373 -19.846 -15.432 1.00 0.00 N ATOM 1126 NH2 ARG A 73 16.158 -20.064 -13.259 1.00 0.00 N ATOM 0 H ARG A 73 9.589 -21.006 -11.924 1.00 0.00 H new ATOM 0 HA ARG A 73 11.505 -19.012 -12.669 1.00 0.00 H new ATOM 0 HB2 ARG A 73 10.833 -21.464 -13.646 1.00 0.00 H new ATOM 0 HB3 ARG A 73 9.901 -20.458 -14.737 1.00 0.00 H new ATOM 0 HG2 ARG A 73 11.774 -19.929 -15.895 1.00 0.00 H new ATOM 0 HG3 ARG A 73 12.498 -19.242 -14.454 1.00 0.00 H new ATOM 0 HD2 ARG A 73 12.507 -22.215 -14.483 1.00 0.00 H new ATOM 0 HD3 ARG A 73 13.429 -21.499 -15.790 1.00 0.00 H new ATOM 0 HE ARG A 73 14.028 -21.324 -12.893 1.00 0.00 H new ATOM 0 HH11 ARG A 73 14.656 -20.027 -16.134 1.00 0.00 H new ATOM 0 HH12 ARG A 73 16.210 -19.319 -15.682 1.00 0.00 H new ATOM 0 HH21 ARG A 73 16.038 -20.410 -12.307 1.00 0.00 H new ATOM 0 HH22 ARG A 73 16.995 -19.537 -13.509 1.00 0.00 H new ATOM 1140 N SER A 74 9.344 -17.391 -12.554 1.00 0.00 N ATOM 1141 CA SER A 74 8.469 -16.279 -12.886 1.00 0.00 C ATOM 1142 C SER A 74 8.096 -15.510 -11.618 1.00 0.00 C ATOM 1143 O SER A 74 7.568 -16.088 -10.669 1.00 0.00 O ATOM 1144 CB SER A 74 7.207 -16.767 -13.602 1.00 0.00 C ATOM 1145 OG SER A 74 7.349 -16.728 -15.019 1.00 0.00 O ATOM 0 H SER A 74 9.723 -17.367 -11.607 1.00 0.00 H new ATOM 0 HA SER A 74 9.004 -15.613 -13.563 1.00 0.00 H new ATOM 0 HB2 SER A 74 6.983 -17.786 -13.288 1.00 0.00 H new ATOM 0 HB3 SER A 74 6.360 -16.149 -13.305 1.00 0.00 H new ATOM 0 HG SER A 74 8.157 -17.217 -15.280 1.00 0.00 H new ATOM 1151 N LYS A 75 8.384 -14.217 -11.642 1.00 0.00 N ATOM 1152 CA LYS A 75 8.086 -13.362 -10.505 1.00 0.00 C ATOM 1153 C LYS A 75 6.968 -12.389 -10.884 1.00 0.00 C ATOM 1154 O LYS A 75 5.988 -12.248 -10.154 1.00 0.00 O ATOM 1155 CB LYS A 75 9.357 -12.673 -10.004 1.00 0.00 C ATOM 1156 CG LYS A 75 9.036 -11.670 -8.895 1.00 0.00 C ATOM 1157 CD LYS A 75 9.942 -10.440 -8.989 1.00 0.00 C ATOM 1158 CE LYS A 75 9.174 -9.165 -8.634 1.00 0.00 C ATOM 1159 NZ LYS A 75 10.109 -8.098 -8.213 1.00 0.00 N ATOM 0 H LYS A 75 8.821 -13.740 -12.431 1.00 0.00 H new ATOM 0 HA LYS A 75 7.722 -13.956 -9.667 1.00 0.00 H new ATOM 0 HB2 LYS A 75 10.057 -13.421 -9.632 1.00 0.00 H new ATOM 0 HB3 LYS A 75 9.848 -12.161 -10.832 1.00 0.00 H new ATOM 0 HG2 LYS A 75 7.992 -11.364 -8.968 1.00 0.00 H new ATOM 0 HG3 LYS A 75 9.162 -12.145 -7.922 1.00 0.00 H new ATOM 0 HD2 LYS A 75 10.791 -10.557 -8.315 1.00 0.00 H new ATOM 0 HD3 LYS A 75 10.345 -10.357 -9.998 1.00 0.00 H new ATOM 0 HE2 LYS A 75 8.595 -8.831 -9.495 1.00 0.00 H new ATOM 0 HE3 LYS A 75 8.464 -9.372 -7.833 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 9.572 -7.240 -7.976 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 10.643 -8.414 -7.379 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 10.770 -7.889 -8.989 1.00 0.00 H new ATOM 1173 N LYS A 76 7.151 -11.743 -12.027 1.00 0.00 N ATOM 1174 CA LYS A 76 6.170 -10.787 -12.511 1.00 0.00 C ATOM 1175 C LYS A 76 5.097 -11.527 -13.313 1.00 0.00 C ATOM 1176 O LYS A 76 4.873 -11.224 -14.484 1.00 0.00 O ATOM 1177 CB LYS A 76 6.856 -9.664 -13.292 1.00 0.00 C ATOM 1178 CG LYS A 76 5.825 -8.740 -13.943 1.00 0.00 C ATOM 1179 CD LYS A 76 5.878 -8.847 -15.468 1.00 0.00 C ATOM 1180 CE LYS A 76 5.778 -7.466 -16.119 1.00 0.00 C ATOM 1181 NZ LYS A 76 4.445 -7.278 -16.734 1.00 0.00 N ATOM 0 H LYS A 76 7.964 -11.863 -12.631 1.00 0.00 H new ATOM 0 HA LYS A 76 5.667 -10.301 -11.675 1.00 0.00 H new ATOM 0 HB2 LYS A 76 7.494 -9.088 -12.622 1.00 0.00 H new ATOM 0 HB3 LYS A 76 7.502 -10.091 -14.059 1.00 0.00 H new ATOM 0 HG2 LYS A 76 4.826 -8.999 -13.591 1.00 0.00 H new ATOM 0 HG3 LYS A 76 6.013 -7.710 -13.640 1.00 0.00 H new ATOM 0 HD2 LYS A 76 6.808 -9.329 -15.770 1.00 0.00 H new ATOM 0 HD3 LYS A 76 5.063 -9.479 -15.820 1.00 0.00 H new ATOM 0 HE2 LYS A 76 5.953 -6.692 -15.372 1.00 0.00 H new ATOM 0 HE3 LYS A 76 6.553 -7.358 -16.877 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 4.394 -6.336 -17.171 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 4.292 -8.006 -17.461 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 3.710 -7.360 -16.002 1.00 0.00 H new ATOM 1195 N ILE A 77 4.462 -12.482 -12.650 1.00 0.00 N ATOM 1196 CA ILE A 77 3.418 -13.267 -13.286 1.00 0.00 C ATOM 1197 C ILE A 77 2.105 -13.074 -12.525 1.00 0.00 C ATOM 1198 O ILE A 77 1.097 -12.677 -13.108 1.00 0.00 O ATOM 1199 CB ILE A 77 3.847 -14.730 -13.409 1.00 0.00 C ATOM 1200 CG1 ILE A 77 2.873 -15.515 -14.291 1.00 0.00 C ATOM 1201 CG2 ILE A 77 4.015 -15.370 -12.030 1.00 0.00 C ATOM 1202 CD1 ILE A 77 3.384 -15.601 -15.730 1.00 0.00 C ATOM 0 H ILE A 77 4.650 -12.730 -11.679 1.00 0.00 H new ATOM 0 HA ILE A 77 3.250 -12.921 -14.306 1.00 0.00 H new ATOM 0 HB ILE A 77 4.820 -14.760 -13.898 1.00 0.00 H new ATOM 0 HG12 ILE A 77 2.740 -16.519 -13.888 1.00 0.00 H new ATOM 0 HG13 ILE A 77 1.895 -15.034 -14.277 1.00 0.00 H new ATOM 0 HG21 ILE A 77 4.320 -16.410 -12.146 1.00 0.00 H new ATOM 0 HG22 ILE A 77 4.776 -14.829 -11.468 1.00 0.00 H new ATOM 0 HG23 ILE A 77 3.068 -15.328 -11.492 1.00 0.00 H new ATOM 0 HD11 ILE A 77 2.673 -16.164 -16.335 1.00 0.00 H new ATOM 0 HD12 ILE A 77 3.493 -14.596 -16.138 1.00 0.00 H new ATOM 0 HD13 ILE A 77 4.351 -16.104 -15.743 1.00 0.00 H new ATOM 1214 N MET A 78 2.159 -13.363 -11.233 1.00 0.00 N ATOM 1215 CA MET A 78 0.986 -13.226 -10.386 1.00 0.00 C ATOM 1216 C MET A 78 0.767 -11.766 -9.985 1.00 0.00 C ATOM 1217 O MET A 78 -0.324 -11.227 -10.162 1.00 0.00 O ATOM 1218 CB MET A 78 1.162 -14.080 -9.128 1.00 0.00 C ATOM 1219 CG MET A 78 0.148 -15.225 -9.096 1.00 0.00 C ATOM 1220 SD MET A 78 -0.719 -15.229 -7.536 1.00 0.00 S ATOM 1221 CE MET A 78 -2.237 -16.029 -8.027 1.00 0.00 C ATOM 0 H MET A 78 2.996 -13.691 -10.752 1.00 0.00 H new ATOM 0 HA MET A 78 0.115 -13.564 -10.947 1.00 0.00 H new ATOM 0 HB2 MET A 78 2.174 -14.485 -9.097 1.00 0.00 H new ATOM 0 HB3 MET A 78 1.041 -13.457 -8.242 1.00 0.00 H new ATOM 0 HG2 MET A 78 -0.562 -15.116 -9.916 1.00 0.00 H new ATOM 0 HG3 MET A 78 0.658 -16.177 -9.241 1.00 0.00 H new ATOM 0 HE1 MET A 78 -2.899 -16.113 -7.165 1.00 0.00 H new ATOM 0 HE2 MET A 78 -2.725 -15.439 -8.803 1.00 0.00 H new ATOM 0 HE3 MET A 78 -2.016 -17.024 -8.413 1.00 0.00 H new ATOM 1231 N PRO A 79 1.850 -11.151 -9.437 1.00 0.00 N ATOM 1232 CA PRO A 79 1.787 -9.764 -9.010 1.00 0.00 C ATOM 1233 C PRO A 79 1.814 -8.818 -10.212 1.00 0.00 C ATOM 1234 O PRO A 79 2.668 -7.937 -10.293 1.00 0.00 O ATOM 1235 CB PRO A 79 2.978 -9.583 -8.084 1.00 0.00 C ATOM 1236 CG PRO A 79 3.923 -10.733 -8.391 1.00 0.00 C ATOM 1237 CD PRO A 79 3.158 -11.759 -9.212 1.00 0.00 C ATOM 0 HA PRO A 79 0.858 -9.525 -8.493 1.00 0.00 H new ATOM 0 HB2 PRO A 79 3.463 -8.622 -8.255 1.00 0.00 H new ATOM 0 HB3 PRO A 79 2.667 -9.601 -7.039 1.00 0.00 H new ATOM 0 HG2 PRO A 79 4.793 -10.375 -8.942 1.00 0.00 H new ATOM 0 HG3 PRO A 79 4.292 -11.181 -7.468 1.00 0.00 H new ATOM 0 HD2 PRO A 79 3.664 -11.970 -10.154 1.00 0.00 H new ATOM 0 HD3 PRO A 79 3.069 -12.706 -8.679 1.00 0.00 H new ATOM 1245 N ALA A 80 0.870 -9.034 -11.116 1.00 0.00 N ATOM 1246 CA ALA A 80 0.775 -8.211 -12.310 1.00 0.00 C ATOM 1247 C ALA A 80 0.215 -6.838 -11.935 1.00 0.00 C ATOM 1248 O ALA A 80 0.752 -5.811 -12.346 1.00 0.00 O ATOM 1249 CB ALA A 80 -0.084 -8.926 -13.355 1.00 0.00 C ATOM 0 H ALA A 80 0.164 -9.767 -11.046 1.00 0.00 H new ATOM 0 HA ALA A 80 1.761 -8.056 -12.749 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -0.156 -8.309 -14.251 1.00 0.00 H new ATOM 0 HB2 ALA A 80 0.373 -9.883 -13.609 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -1.082 -9.096 -12.951 1.00 0.00 H new ATOM 1255 N GLY A 81 -0.858 -6.864 -11.158 1.00 0.00 N ATOM 1256 CA GLY A 81 -1.497 -5.633 -10.724 1.00 0.00 C ATOM 1257 C GLY A 81 -0.580 -4.840 -9.791 1.00 0.00 C ATOM 1258 O GLY A 81 -0.830 -3.666 -9.520 1.00 0.00 O ATOM 0 H GLY A 81 -1.301 -7.718 -10.818 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -1.752 -5.025 -11.592 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -2.431 -5.865 -10.212 1.00 0.00 H new ATOM 1262 N LEU A 82 0.462 -5.512 -9.324 1.00 0.00 N ATOM 1263 CA LEU A 82 1.417 -4.884 -8.427 1.00 0.00 C ATOM 1264 C LEU A 82 2.096 -3.718 -9.148 1.00 0.00 C ATOM 1265 O LEU A 82 1.750 -2.559 -8.923 1.00 0.00 O ATOM 1266 CB LEU A 82 2.398 -5.922 -7.877 1.00 0.00 C ATOM 1267 CG LEU A 82 3.485 -5.388 -6.943 1.00 0.00 C ATOM 1268 CD1 LEU A 82 3.349 -5.989 -5.543 1.00 0.00 C ATOM 1269 CD2 LEU A 82 4.878 -5.620 -7.533 1.00 0.00 C ATOM 0 H LEU A 82 0.666 -6.486 -9.550 1.00 0.00 H new ATOM 0 HA LEU A 82 0.907 -4.469 -7.558 1.00 0.00 H new ATOM 0 HB2 LEU A 82 1.829 -6.683 -7.343 1.00 0.00 H new ATOM 0 HB3 LEU A 82 2.881 -6.418 -8.719 1.00 0.00 H new ATOM 0 HG LEU A 82 3.352 -4.311 -6.845 1.00 0.00 H new ATOM 0 HD11 LEU A 82 4.134 -5.593 -4.899 1.00 0.00 H new ATOM 0 HD12 LEU A 82 2.375 -5.730 -5.129 1.00 0.00 H new ATOM 0 HD13 LEU A 82 3.441 -7.073 -5.602 1.00 0.00 H new ATOM 0 HD21 LEU A 82 5.632 -5.231 -6.849 1.00 0.00 H new ATOM 0 HD22 LEU A 82 5.038 -6.688 -7.680 1.00 0.00 H new ATOM 0 HD23 LEU A 82 4.958 -5.106 -8.491 1.00 0.00 H new ATOM 1281 N VAL A 83 3.050 -4.064 -9.999 1.00 0.00 N ATOM 1282 CA VAL A 83 3.781 -3.060 -10.754 1.00 0.00 C ATOM 1283 C VAL A 83 2.824 -2.357 -11.718 1.00 0.00 C ATOM 1284 O VAL A 83 2.920 -1.148 -11.923 1.00 0.00 O ATOM 1285 CB VAL A 83 4.976 -3.704 -11.460 1.00 0.00 C ATOM 1286 CG1 VAL A 83 6.141 -3.909 -10.490 1.00 0.00 C ATOM 1287 CG2 VAL A 83 4.575 -5.023 -12.123 1.00 0.00 C ATOM 0 H VAL A 83 3.334 -5.026 -10.183 1.00 0.00 H new ATOM 0 HA VAL A 83 4.186 -2.300 -10.087 1.00 0.00 H new ATOM 0 HB VAL A 83 5.309 -3.023 -12.243 1.00 0.00 H new ATOM 0 HG11 VAL A 83 6.977 -4.368 -11.017 1.00 0.00 H new ATOM 0 HG12 VAL A 83 6.452 -2.946 -10.086 1.00 0.00 H new ATOM 0 HG13 VAL A 83 5.825 -4.560 -9.674 1.00 0.00 H new ATOM 0 HG21 VAL A 83 5.442 -5.460 -12.618 1.00 0.00 H new ATOM 0 HG22 VAL A 83 4.203 -5.713 -11.365 1.00 0.00 H new ATOM 0 HG23 VAL A 83 3.793 -4.837 -12.859 1.00 0.00 H new ATOM 1297 N ALA A 84 1.921 -3.144 -12.285 1.00 0.00 N ATOM 1298 CA ALA A 84 0.947 -2.612 -13.223 1.00 0.00 C ATOM 1299 C ALA A 84 0.099 -1.549 -12.523 1.00 0.00 C ATOM 1300 O ALA A 84 -0.365 -0.603 -13.157 1.00 0.00 O ATOM 1301 CB ALA A 84 0.101 -3.757 -13.784 1.00 0.00 C ATOM 0 H ALA A 84 1.844 -4.146 -12.113 1.00 0.00 H new ATOM 0 HA ALA A 84 1.447 -2.133 -14.065 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -0.630 -3.358 -14.488 1.00 0.00 H new ATOM 0 HB2 ALA A 84 0.747 -4.470 -14.297 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -0.418 -4.260 -12.968 1.00 0.00 H new ATOM 1307 N GLY A 85 -0.077 -1.739 -11.223 1.00 0.00 N ATOM 1308 CA GLY A 85 -0.861 -0.808 -10.430 1.00 0.00 C ATOM 1309 C GLY A 85 -0.063 0.462 -10.128 1.00 0.00 C ATOM 1310 O GLY A 85 -0.568 1.571 -10.297 1.00 0.00 O ATOM 0 H GLY A 85 0.310 -2.524 -10.700 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -1.775 -0.549 -10.965 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -1.162 -1.283 -9.496 1.00 0.00 H new ATOM 1314 N LEU A 86 1.170 0.258 -9.688 1.00 0.00 N ATOM 1315 CA LEU A 86 2.042 1.373 -9.361 1.00 0.00 C ATOM 1316 C LEU A 86 2.165 2.292 -10.578 1.00 0.00 C ATOM 1317 O LEU A 86 2.224 3.513 -10.435 1.00 0.00 O ATOM 1318 CB LEU A 86 3.387 0.865 -8.836 1.00 0.00 C ATOM 1319 CG LEU A 86 4.585 1.051 -9.770 1.00 0.00 C ATOM 1320 CD1 LEU A 86 5.183 2.451 -9.623 1.00 0.00 C ATOM 1321 CD2 LEU A 86 5.629 -0.045 -9.546 1.00 0.00 C ATOM 0 H LEU A 86 1.586 -0.663 -9.550 1.00 0.00 H new ATOM 0 HA LEU A 86 1.614 1.967 -8.554 1.00 0.00 H new ATOM 0 HB2 LEU A 86 3.603 1.372 -7.896 1.00 0.00 H new ATOM 0 HB3 LEU A 86 3.289 -0.197 -8.610 1.00 0.00 H new ATOM 0 HG LEU A 86 4.235 0.958 -10.798 1.00 0.00 H new ATOM 0 HD11 LEU A 86 6.033 2.556 -10.298 1.00 0.00 H new ATOM 0 HD12 LEU A 86 4.428 3.197 -9.871 1.00 0.00 H new ATOM 0 HD13 LEU A 86 5.515 2.599 -8.595 1.00 0.00 H new ATOM 0 HD21 LEU A 86 6.470 0.110 -10.222 1.00 0.00 H new ATOM 0 HD22 LEU A 86 5.980 -0.007 -8.515 1.00 0.00 H new ATOM 0 HD23 LEU A 86 5.181 -1.019 -9.741 1.00 0.00 H new ATOM 1333 N SER A 87 2.199 1.671 -11.748 1.00 0.00 N ATOM 1334 CA SER A 87 2.313 2.419 -12.989 1.00 0.00 C ATOM 1335 C SER A 87 1.000 3.145 -13.285 1.00 0.00 C ATOM 1336 O SER A 87 0.996 4.348 -13.542 1.00 0.00 O ATOM 1337 CB SER A 87 2.686 1.499 -14.153 1.00 0.00 C ATOM 1338 OG SER A 87 4.000 0.967 -14.014 1.00 0.00 O ATOM 0 H SER A 87 2.150 0.659 -11.863 1.00 0.00 H new ATOM 0 HA SER A 87 3.109 3.155 -12.874 1.00 0.00 H new ATOM 0 HB2 SER A 87 1.968 0.681 -14.213 1.00 0.00 H new ATOM 0 HB3 SER A 87 2.616 2.053 -15.089 1.00 0.00 H new ATOM 0 HG SER A 87 3.982 0.208 -13.395 1.00 0.00 H new ATOM 1344 N LEU A 88 -0.084 2.384 -13.239 1.00 0.00 N ATOM 1345 CA LEU A 88 -1.400 2.940 -13.500 1.00 0.00 C ATOM 1346 C LEU A 88 -1.658 4.102 -12.538 1.00 0.00 C ATOM 1347 O LEU A 88 -2.463 4.986 -12.828 1.00 0.00 O ATOM 1348 CB LEU A 88 -2.466 1.845 -13.440 1.00 0.00 C ATOM 1349 CG LEU A 88 -3.374 1.724 -14.665 1.00 0.00 C ATOM 1350 CD1 LEU A 88 -4.207 2.993 -14.858 1.00 0.00 C ATOM 1351 CD2 LEU A 88 -2.564 1.375 -15.915 1.00 0.00 C ATOM 0 H LEU A 88 -0.077 1.387 -13.025 1.00 0.00 H new ATOM 0 HA LEU A 88 -1.448 3.345 -14.511 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -1.967 0.888 -13.287 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -3.091 2.022 -12.565 1.00 0.00 H new ATOM 0 HG LEU A 88 -4.071 0.904 -14.493 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -4.844 2.880 -15.736 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -4.828 3.158 -13.978 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -3.543 3.846 -14.998 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -3.233 1.295 -16.772 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -1.828 2.157 -16.102 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -2.053 0.424 -15.764 1.00 0.00 H new ATOM 1363 N MET A 89 -0.959 4.063 -11.413 1.00 0.00 N ATOM 1364 CA MET A 89 -1.102 5.102 -10.407 1.00 0.00 C ATOM 1365 C MET A 89 -0.306 6.351 -10.791 1.00 0.00 C ATOM 1366 O MET A 89 -0.887 7.382 -11.127 1.00 0.00 O ATOM 1367 CB MET A 89 -0.608 4.577 -9.057 1.00 0.00 C ATOM 1368 CG MET A 89 -1.573 4.958 -7.934 1.00 0.00 C ATOM 1369 SD MET A 89 -0.799 6.134 -6.836 1.00 0.00 S ATOM 1370 CE MET A 89 -0.845 7.593 -7.863 1.00 0.00 C ATOM 0 H MET A 89 -0.292 3.328 -11.176 1.00 0.00 H new ATOM 0 HA MET A 89 -2.156 5.372 -10.339 1.00 0.00 H new ATOM 0 HB2 MET A 89 -0.505 3.493 -9.100 1.00 0.00 H new ATOM 0 HB3 MET A 89 0.381 4.983 -8.845 1.00 0.00 H new ATOM 0 HG2 MET A 89 -2.483 5.385 -8.355 1.00 0.00 H new ATOM 0 HG3 MET A 89 -1.867 4.068 -7.378 1.00 0.00 H new ATOM 0 HE1 MET A 89 -1.043 8.468 -7.244 1.00 0.00 H new ATOM 0 HE2 MET A 89 0.114 7.714 -8.366 1.00 0.00 H new ATOM 0 HE3 MET A 89 -1.634 7.489 -8.607 1.00 0.00 H new ATOM 1380 N MET A 90 1.010 6.217 -10.729 1.00 0.00 N ATOM 1381 CA MET A 90 1.891 7.322 -11.067 1.00 0.00 C ATOM 1382 C MET A 90 1.493 7.952 -12.403 1.00 0.00 C ATOM 1383 O MET A 90 1.785 9.121 -12.653 1.00 0.00 O ATOM 1384 CB MET A 90 3.334 6.818 -11.150 1.00 0.00 C ATOM 1385 CG MET A 90 3.539 5.945 -12.389 1.00 0.00 C ATOM 1386 SD MET A 90 4.564 6.800 -13.575 1.00 0.00 S ATOM 1387 CE MET A 90 5.658 5.473 -14.053 1.00 0.00 C ATOM 0 H MET A 90 1.488 5.360 -10.450 1.00 0.00 H new ATOM 0 HA MET A 90 1.806 8.081 -10.289 1.00 0.00 H new ATOM 0 HB2 MET A 90 4.018 7.666 -11.181 1.00 0.00 H new ATOM 0 HB3 MET A 90 3.575 6.246 -10.254 1.00 0.00 H new ATOM 0 HG2 MET A 90 4.006 5.001 -12.106 1.00 0.00 H new ATOM 0 HG3 MET A 90 2.575 5.702 -12.837 1.00 0.00 H new ATOM 0 HE1 MET A 90 6.369 5.837 -14.795 1.00 0.00 H new ATOM 0 HE2 MET A 90 6.199 5.114 -13.177 1.00 0.00 H new ATOM 0 HE3 MET A 90 5.075 4.656 -14.479 1.00 0.00 H new ATOM 1397 N ILE A 91 0.833 7.151 -13.226 1.00 0.00 N ATOM 1398 CA ILE A 91 0.392 7.616 -14.530 1.00 0.00 C ATOM 1399 C ILE A 91 -0.984 8.271 -14.394 1.00 0.00 C ATOM 1400 O ILE A 91 -1.235 9.322 -14.981 1.00 0.00 O ATOM 1401 CB ILE A 91 0.431 6.474 -15.547 1.00 0.00 C ATOM 1402 CG1 ILE A 91 0.839 6.985 -16.930 1.00 0.00 C ATOM 1403 CG2 ILE A 91 -0.903 5.726 -15.583 1.00 0.00 C ATOM 1404 CD1 ILE A 91 2.055 6.222 -17.460 1.00 0.00 C ATOM 0 H ILE A 91 0.593 6.182 -13.015 1.00 0.00 H new ATOM 0 HA ILE A 91 1.072 8.377 -14.913 1.00 0.00 H new ATOM 0 HB ILE A 91 1.192 5.761 -15.230 1.00 0.00 H new ATOM 0 HG12 ILE A 91 0.005 6.874 -17.623 1.00 0.00 H new ATOM 0 HG13 ILE A 91 1.068 8.049 -16.875 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -0.848 4.919 -16.314 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -1.113 5.309 -14.598 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -1.699 6.416 -15.863 1.00 0.00 H new ATOM 0 HD11 ILE A 91 2.324 6.605 -18.444 1.00 0.00 H new ATOM 0 HD12 ILE A 91 2.894 6.355 -16.777 1.00 0.00 H new ATOM 0 HD13 ILE A 91 1.814 5.162 -17.537 1.00 0.00 H new ATOM 1416 N LEU A 92 -1.839 7.624 -13.615 1.00 0.00 N ATOM 1417 CA LEU A 92 -3.182 8.131 -13.395 1.00 0.00 C ATOM 1418 C LEU A 92 -3.101 9.562 -12.858 1.00 0.00 C ATOM 1419 O LEU A 92 -3.994 10.371 -13.102 1.00 0.00 O ATOM 1420 CB LEU A 92 -3.973 7.180 -12.494 1.00 0.00 C ATOM 1421 CG LEU A 92 -5.138 7.802 -11.722 1.00 0.00 C ATOM 1422 CD1 LEU A 92 -6.256 6.781 -11.502 1.00 0.00 C ATOM 1423 CD2 LEU A 92 -4.658 8.418 -10.406 1.00 0.00 C ATOM 0 H LEU A 92 -1.627 6.753 -13.129 1.00 0.00 H new ATOM 0 HA LEU A 92 -3.732 8.173 -14.335 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -4.362 6.369 -13.109 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -3.284 6.734 -11.776 1.00 0.00 H new ATOM 0 HG LEU A 92 -5.553 8.611 -12.323 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -7.072 7.248 -10.951 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -6.623 6.430 -12.466 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -5.870 5.936 -10.932 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -5.506 8.853 -9.877 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -4.202 7.645 -9.787 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -3.923 9.195 -10.615 1.00 0.00 H new ATOM 1435 N ARG A 93 -2.022 9.829 -12.138 1.00 0.00 N ATOM 1436 CA ARG A 93 -1.812 11.147 -11.564 1.00 0.00 C ATOM 1437 C ARG A 93 -0.987 12.015 -12.517 1.00 0.00 C ATOM 1438 O ARG A 93 -1.309 13.182 -12.735 1.00 0.00 O ATOM 1439 CB ARG A 93 -1.093 11.054 -10.217 1.00 0.00 C ATOM 1440 CG ARG A 93 -2.014 11.482 -9.073 1.00 0.00 C ATOM 1441 CD ARG A 93 -1.856 12.974 -8.771 1.00 0.00 C ATOM 1442 NE ARG A 93 -3.140 13.531 -8.288 1.00 0.00 N ATOM 1443 CZ ARG A 93 -3.283 14.768 -7.794 1.00 0.00 C ATOM 1444 NH1 ARG A 93 -2.224 15.585 -7.715 1.00 0.00 N ATOM 1445 NH2 ARG A 93 -4.486 15.189 -7.379 1.00 0.00 N ATOM 0 H ARG A 93 -1.283 9.155 -11.939 1.00 0.00 H new ATOM 0 HA ARG A 93 -2.791 11.601 -11.409 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -0.753 10.032 -10.052 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -0.205 11.687 -10.230 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -3.050 11.268 -9.336 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -1.785 10.900 -8.180 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -1.080 13.121 -8.019 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -1.535 13.503 -9.668 1.00 0.00 H new ATOM 0 HE ARG A 93 -3.967 12.936 -8.334 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -1.308 15.265 -8.031 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -2.333 16.527 -7.339 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -5.293 14.568 -7.439 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -4.595 16.131 -7.003 1.00 0.00 H new ATOM 1459 N LEU A 94 0.061 11.412 -13.058 1.00 0.00 N ATOM 1460 CA LEU A 94 0.934 12.116 -13.982 1.00 0.00 C ATOM 1461 C LEU A 94 0.161 12.439 -15.262 1.00 0.00 C ATOM 1462 O LEU A 94 0.598 13.263 -16.064 1.00 0.00 O ATOM 1463 CB LEU A 94 2.215 11.315 -14.223 1.00 0.00 C ATOM 1464 CG LEU A 94 3.196 11.907 -15.237 1.00 0.00 C ATOM 1465 CD1 LEU A 94 4.575 12.118 -14.608 1.00 0.00 C ATOM 1466 CD2 LEU A 94 3.267 11.045 -16.499 1.00 0.00 C ATOM 0 H LEU A 94 0.325 10.444 -12.874 1.00 0.00 H new ATOM 0 HA LEU A 94 1.254 13.066 -13.555 1.00 0.00 H new ATOM 0 HB2 LEU A 94 2.733 11.201 -13.271 1.00 0.00 H new ATOM 0 HB3 LEU A 94 1.937 10.315 -14.557 1.00 0.00 H new ATOM 0 HG LEU A 94 2.826 12.887 -15.537 1.00 0.00 H new ATOM 0 HD11 LEU A 94 5.253 12.540 -15.350 1.00 0.00 H new ATOM 0 HD12 LEU A 94 4.489 12.803 -13.764 1.00 0.00 H new ATOM 0 HD13 LEU A 94 4.967 11.162 -14.261 1.00 0.00 H new ATOM 0 HD21 LEU A 94 3.971 11.488 -17.203 1.00 0.00 H new ATOM 0 HD22 LEU A 94 3.600 10.041 -16.236 1.00 0.00 H new ATOM 0 HD23 LEU A 94 2.280 10.991 -16.959 1.00 0.00 H new ATOM 1478 N VAL A 95 -0.974 11.773 -15.414 1.00 0.00 N ATOM 1479 CA VAL A 95 -1.812 11.979 -16.583 1.00 0.00 C ATOM 1480 C VAL A 95 -2.560 13.306 -16.442 1.00 0.00 C ATOM 1481 O VAL A 95 -2.301 14.251 -17.186 1.00 0.00 O ATOM 1482 CB VAL A 95 -2.747 10.783 -16.774 1.00 0.00 C ATOM 1483 CG1 VAL A 95 -3.992 11.182 -17.569 1.00 0.00 C ATOM 1484 CG2 VAL A 95 -2.018 9.618 -17.446 1.00 0.00 C ATOM 0 H VAL A 95 -1.333 11.090 -14.747 1.00 0.00 H new ATOM 0 HA VAL A 95 -1.201 12.044 -17.484 1.00 0.00 H new ATOM 0 HB VAL A 95 -3.071 10.451 -15.788 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -4.640 10.314 -17.691 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -4.530 11.964 -17.034 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -3.694 11.553 -18.550 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -2.706 8.781 -17.570 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -1.651 9.933 -18.423 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -1.177 9.308 -16.825 1.00 0.00 H new ATOM 1494 N LEU A 96 -3.472 13.335 -15.481 1.00 0.00 N ATOM 1495 CA LEU A 96 -4.260 14.531 -15.233 1.00 0.00 C ATOM 1496 C LEU A 96 -3.323 15.732 -15.090 1.00 0.00 C ATOM 1497 O LEU A 96 -3.689 16.854 -15.435 1.00 0.00 O ATOM 1498 CB LEU A 96 -5.183 14.324 -14.031 1.00 0.00 C ATOM 1499 CG LEU A 96 -4.583 14.646 -12.661 1.00 0.00 C ATOM 1500 CD1 LEU A 96 -5.242 15.885 -12.051 1.00 0.00 C ATOM 1501 CD2 LEU A 96 -4.665 13.436 -11.728 1.00 0.00 C ATOM 0 H LEU A 96 -3.683 12.550 -14.865 1.00 0.00 H new ATOM 0 HA LEU A 96 -4.917 14.737 -16.078 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -6.072 14.940 -14.170 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -5.513 13.285 -14.026 1.00 0.00 H new ATOM 0 HG LEU A 96 -3.526 14.877 -12.797 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -4.797 16.092 -11.078 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -5.088 16.740 -12.709 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -6.311 15.707 -11.931 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -4.232 13.692 -10.761 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -5.708 13.150 -11.594 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -4.114 12.603 -12.164 1.00 0.00 H new ATOM 1513 N LEU A 97 -2.132 15.455 -14.579 1.00 0.00 N ATOM 1514 CA LEU A 97 -1.140 16.500 -14.385 1.00 0.00 C ATOM 1515 C LEU A 97 -1.834 17.772 -13.894 1.00 0.00 C ATOM 1516 O LEU A 97 -1.649 18.844 -14.466 1.00 0.00 O ATOM 1517 CB LEU A 97 -0.318 16.701 -15.660 1.00 0.00 C ATOM 1518 CG LEU A 97 1.075 17.304 -15.471 1.00 0.00 C ATOM 1519 CD1 LEU A 97 2.000 16.919 -16.627 1.00 0.00 C ATOM 1520 CD2 LEU A 97 0.995 18.820 -15.282 1.00 0.00 C ATOM 0 H LEU A 97 -1.832 14.523 -14.294 1.00 0.00 H new ATOM 0 HA LEU A 97 -0.426 16.209 -13.615 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -0.210 15.736 -16.155 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -0.882 17.344 -16.335 1.00 0.00 H new ATOM 0 HG LEU A 97 1.507 16.888 -14.561 1.00 0.00 H new ATOM 0 HD11 LEU A 97 2.984 17.360 -16.468 1.00 0.00 H new ATOM 0 HD12 LEU A 97 2.092 15.834 -16.673 1.00 0.00 H new ATOM 0 HD13 LEU A 97 1.584 17.288 -17.564 1.00 0.00 H new ATOM 0 HD21 LEU A 97 1.999 19.224 -15.150 1.00 0.00 H new ATOM 0 HD22 LEU A 97 0.535 19.272 -16.160 1.00 0.00 H new ATOM 0 HD23 LEU A 97 0.394 19.046 -14.401 1.00 0.00 H new ATOM 1532 N LEU A 98 -2.619 17.610 -12.838 1.00 0.00 N ATOM 1533 CA LEU A 98 -3.341 18.731 -12.264 1.00 0.00 C ATOM 1534 C LEU A 98 -3.830 19.647 -13.388 1.00 0.00 C ATOM 1535 O LEU A 98 -3.729 20.869 -13.286 1.00 0.00 O ATOM 1536 CB LEU A 98 -2.480 19.445 -11.220 1.00 0.00 C ATOM 1537 CG LEU A 98 -1.446 18.579 -10.498 1.00 0.00 C ATOM 1538 CD1 LEU A 98 -0.026 18.930 -10.947 1.00 0.00 C ATOM 1539 CD2 LEU A 98 -1.608 18.682 -8.980 1.00 0.00 C ATOM 0 H LEU A 98 -2.770 16.719 -12.366 1.00 0.00 H new ATOM 0 HA LEU A 98 -4.225 18.381 -11.730 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -1.958 20.267 -11.709 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -3.140 19.886 -10.473 1.00 0.00 H new ATOM 0 HG LEU A 98 -1.622 17.539 -10.771 1.00 0.00 H new ATOM 0 HD11 LEU A 98 0.689 18.300 -10.418 1.00 0.00 H new ATOM 0 HD12 LEU A 98 0.068 18.764 -12.020 1.00 0.00 H new ATOM 0 HD13 LEU A 98 0.178 19.977 -10.723 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -0.861 18.057 -8.491 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -1.474 19.718 -8.669 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -2.605 18.344 -8.697 1.00 0.00 H new ATOM 1551 N LEU A 99 -4.350 19.022 -14.434 1.00 0.00 N ATOM 1552 CA LEU A 99 -4.854 19.765 -15.575 1.00 0.00 C ATOM 1553 C LEU A 99 -5.596 21.009 -15.081 1.00 0.00 C ATOM 1554 O LEU A 99 -5.213 22.133 -15.401 1.00 0.00 O ATOM 1555 CB LEU A 99 -5.701 18.860 -16.472 1.00 0.00 C ATOM 1556 CG LEU A 99 -7.213 19.092 -16.424 1.00 0.00 C ATOM 1557 CD1 LEU A 99 -7.605 20.322 -17.246 1.00 0.00 C ATOM 1558 CD2 LEU A 99 -7.974 17.841 -16.866 1.00 0.00 C ATOM 0 H LEU A 99 -4.433 18.009 -14.515 1.00 0.00 H new ATOM 0 HA LEU A 99 -4.029 20.111 -16.198 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -5.367 18.987 -17.502 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -5.504 17.824 -16.198 1.00 0.00 H new ATOM 0 HG LEU A 99 -7.495 19.292 -15.390 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -8.684 20.465 -17.195 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -7.103 21.203 -16.845 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -7.307 20.176 -18.284 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -9.046 18.033 -16.823 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -7.692 17.586 -17.887 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -7.727 17.012 -16.203 1.00 0.00 H new TER 1570 LEU A 99