USER MOD reduce.3.24.130724 H: found=0, std=0, add=819, rem=0, adj=17 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 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 88:sc= 0.505 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 28 SER OG : rot -173:sc= 1.11 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= -0.268 K(o=-0.27,f=-2.6!) 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 -163:sc= -0.0855 USER MOD Single : A 59 THR OG1 : rot 100:sc= 1.02 USER MOD Single : A 65 THR OG1 : rot 85:sc= 0.0871 USER MOD Single : A 67 MET CE :methyl 174:sc= 0 (180deg=-0.0449) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot 180:sc= 0 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 -158:sc= -0.094 (180deg=-0.49) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 89 MET CE :methyl 151:sc=-0.00936 (180deg=-1.43) USER MOD Single : A 90 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -26.474 -32.793 13.173 1.00 0.00 N ATOM 2 CA MET A 1 -27.642 -33.634 12.971 1.00 0.00 C ATOM 3 C MET A 1 -28.793 -33.203 13.882 1.00 0.00 C ATOM 4 O MET A 1 -28.628 -33.114 15.098 1.00 0.00 O ATOM 5 CB MET A 1 -27.278 -35.091 13.264 1.00 0.00 C ATOM 6 CG MET A 1 -26.749 -35.787 12.008 1.00 0.00 C ATOM 7 SD MET A 1 -27.409 -37.442 11.903 1.00 0.00 S ATOM 8 CE MET A 1 -27.784 -37.517 10.160 1.00 0.00 C ATOM 0 H1 MET A 1 -25.708 -33.106 12.543 1.00 0.00 H new ATOM 0 H2 MET A 1 -26.716 -31.805 12.958 1.00 0.00 H new ATOM 0 H3 MET A 1 -26.161 -32.866 14.162 1.00 0.00 H new ATOM 0 HA MET A 1 -27.965 -33.531 11.935 1.00 0.00 H new ATOM 0 HB2 MET A 1 -26.524 -35.130 14.051 1.00 0.00 H new ATOM 0 HB3 MET A 1 -28.155 -35.621 13.636 1.00 0.00 H new ATOM 0 HG2 MET A 1 -27.029 -35.218 11.122 1.00 0.00 H new ATOM 0 HG3 MET A 1 -25.660 -35.822 12.033 1.00 0.00 H new ATOM 0 HE1 MET A 1 -28.208 -38.492 9.921 1.00 0.00 H new ATOM 0 HE2 MET A 1 -28.503 -36.737 9.909 1.00 0.00 H new ATOM 0 HE3 MET A 1 -26.870 -37.368 9.585 1.00 0.00 H new ATOM 18 N ASP A 2 -29.933 -32.945 13.258 1.00 0.00 N ATOM 19 CA ASP A 2 -31.112 -32.524 13.997 1.00 0.00 C ATOM 20 C ASP A 2 -32.344 -32.654 13.100 1.00 0.00 C ATOM 21 O ASP A 2 -32.240 -33.095 11.957 1.00 0.00 O ATOM 22 CB ASP A 2 -30.996 -31.062 14.433 1.00 0.00 C ATOM 23 CG ASP A 2 -31.238 -30.810 15.922 1.00 0.00 C ATOM 24 OD1 ASP A 2 -32.424 -31.103 16.339 1.00 0.00 O ATOM 25 OD2 ASP A 2 -30.340 -30.357 16.648 1.00 0.00 O ATOM 0 H ASP A 2 -30.066 -33.019 12.249 1.00 0.00 H new ATOM 0 HA ASP A 2 -31.201 -33.157 14.880 1.00 0.00 H new ATOM 0 HB2 ASP A 2 -30.001 -30.700 14.176 1.00 0.00 H new ATOM 0 HB3 ASP A 2 -31.709 -30.470 13.859 1.00 0.00 H new ATOM 30 N LEU A 3 -33.483 -32.263 13.653 1.00 0.00 N ATOM 31 CA LEU A 3 -34.734 -32.330 12.917 1.00 0.00 C ATOM 32 C LEU A 3 -34.558 -31.649 11.558 1.00 0.00 C ATOM 33 O LEU A 3 -34.389 -32.320 10.541 1.00 0.00 O ATOM 34 CB LEU A 3 -35.878 -31.751 13.752 1.00 0.00 C ATOM 35 CG LEU A 3 -36.584 -32.729 14.692 1.00 0.00 C ATOM 36 CD1 LEU A 3 -35.964 -32.691 16.090 1.00 0.00 C ATOM 37 CD2 LEU A 3 -38.091 -32.466 14.726 1.00 0.00 C ATOM 0 H LEU A 3 -33.566 -31.899 14.602 1.00 0.00 H new ATOM 0 HA LEU A 3 -35.006 -33.367 12.721 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -35.486 -30.926 14.346 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -36.620 -31.331 13.073 1.00 0.00 H new ATOM 0 HG LEU A 3 -36.442 -33.738 14.304 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -36.485 -33.396 16.738 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -34.911 -32.965 16.028 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -36.054 -31.685 16.501 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -38.569 -33.175 15.402 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -38.275 -31.450 15.076 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -38.504 -32.585 13.724 1.00 0.00 H new ATOM 49 N ILE A 4 -34.605 -30.326 11.584 1.00 0.00 N ATOM 50 CA ILE A 4 -34.453 -29.547 10.367 1.00 0.00 C ATOM 51 C ILE A 4 -33.357 -30.170 9.501 1.00 0.00 C ATOM 52 O ILE A 4 -33.639 -30.997 8.636 1.00 0.00 O ATOM 53 CB ILE A 4 -34.211 -28.074 10.700 1.00 0.00 C ATOM 54 CG1 ILE A 4 -33.632 -27.327 9.496 1.00 0.00 C ATOM 55 CG2 ILE A 4 -33.328 -27.930 11.942 1.00 0.00 C ATOM 56 CD1 ILE A 4 -33.949 -25.832 9.574 1.00 0.00 C ATOM 0 H ILE A 4 -34.746 -29.773 12.429 1.00 0.00 H new ATOM 0 HA ILE A 4 -35.373 -29.570 9.783 1.00 0.00 H new ATOM 0 HB ILE A 4 -35.172 -27.615 10.933 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -32.552 -27.472 9.458 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -34.042 -27.742 8.575 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -33.172 -26.873 12.157 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -33.817 -28.405 12.793 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -32.366 -28.410 11.762 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -33.526 -25.325 8.707 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -35.030 -25.689 9.587 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -33.517 -25.416 10.484 1.00 0.00 H new ATOM 68 N GLY A 5 -32.128 -29.750 9.765 1.00 0.00 N ATOM 69 CA GLY A 5 -30.988 -30.257 9.021 1.00 0.00 C ATOM 70 C GLY A 5 -30.755 -29.438 7.750 1.00 0.00 C ATOM 71 O GLY A 5 -29.635 -29.004 7.483 1.00 0.00 O ATOM 0 H GLY A 5 -31.897 -29.064 10.484 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -30.097 -30.224 9.647 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -31.156 -31.302 8.759 1.00 0.00 H new ATOM 75 N PHE A 6 -31.830 -29.251 6.999 1.00 0.00 N ATOM 76 CA PHE A 6 -31.757 -28.492 5.762 1.00 0.00 C ATOM 77 C PHE A 6 -31.226 -27.080 6.017 1.00 0.00 C ATOM 78 O PHE A 6 -30.192 -26.694 5.473 1.00 0.00 O ATOM 79 CB PHE A 6 -33.181 -28.397 5.211 1.00 0.00 C ATOM 80 CG PHE A 6 -33.249 -28.184 3.697 1.00 0.00 C ATOM 81 CD1 PHE A 6 -32.763 -29.134 2.855 1.00 0.00 C ATOM 82 CD2 PHE A 6 -33.797 -27.045 3.195 1.00 0.00 C ATOM 83 CE1 PHE A 6 -32.826 -28.937 1.450 1.00 0.00 C ATOM 84 CE2 PHE A 6 -33.860 -26.848 1.790 1.00 0.00 C ATOM 85 CZ PHE A 6 -33.374 -27.798 0.947 1.00 0.00 C ATOM 0 H PHE A 6 -32.757 -29.612 7.223 1.00 0.00 H new ATOM 0 HA PHE A 6 -31.082 -28.984 5.062 1.00 0.00 H new ATOM 0 HB2 PHE A 6 -33.719 -29.311 5.464 1.00 0.00 H new ATOM 0 HB3 PHE A 6 -33.698 -27.575 5.707 1.00 0.00 H new ATOM 0 HD1 PHE A 6 -32.329 -30.039 3.254 1.00 0.00 H new ATOM 0 HD2 PHE A 6 -34.184 -26.291 3.864 1.00 0.00 H new ATOM 0 HE1 PHE A 6 -32.439 -29.691 0.781 1.00 0.00 H new ATOM 0 HE2 PHE A 6 -34.294 -25.943 1.391 1.00 0.00 H new ATOM 0 HZ PHE A 6 -33.423 -27.648 -0.121 1.00 0.00 H new ATOM 95 N GLY A 7 -31.957 -26.347 6.843 1.00 0.00 N ATOM 96 CA GLY A 7 -31.573 -24.986 7.176 1.00 0.00 C ATOM 97 C GLY A 7 -30.107 -24.921 7.612 1.00 0.00 C ATOM 98 O GLY A 7 -29.355 -24.065 7.149 1.00 0.00 O ATOM 0 H GLY A 7 -32.814 -26.670 7.292 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -31.728 -24.339 6.313 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -32.211 -24.610 7.976 1.00 0.00 H new ATOM 102 N TYR A 8 -29.746 -25.838 8.498 1.00 0.00 N ATOM 103 CA TYR A 8 -28.384 -25.896 9.002 1.00 0.00 C ATOM 104 C TYR A 8 -27.386 -26.101 7.861 1.00 0.00 C ATOM 105 O TYR A 8 -26.346 -25.446 7.816 1.00 0.00 O ATOM 106 CB TYR A 8 -28.331 -27.107 9.935 1.00 0.00 C ATOM 107 CG TYR A 8 -27.210 -27.043 10.975 1.00 0.00 C ATOM 108 CD1 TYR A 8 -27.377 -26.297 12.124 1.00 0.00 C ATOM 109 CD2 TYR A 8 -26.033 -27.731 10.763 1.00 0.00 C ATOM 110 CE1 TYR A 8 -26.322 -26.237 13.102 1.00 0.00 C ATOM 111 CE2 TYR A 8 -24.978 -27.671 11.741 1.00 0.00 C ATOM 112 CZ TYR A 8 -25.174 -26.927 12.863 1.00 0.00 C ATOM 113 OH TYR A 8 -24.178 -26.870 13.787 1.00 0.00 O ATOM 0 H TYR A 8 -30.373 -26.547 8.880 1.00 0.00 H new ATOM 0 HA TYR A 8 -28.122 -24.967 9.508 1.00 0.00 H new ATOM 0 HB2 TYR A 8 -29.287 -27.197 10.451 1.00 0.00 H new ATOM 0 HB3 TYR A 8 -28.206 -28.009 9.336 1.00 0.00 H new ATOM 0 HD1 TYR A 8 -28.298 -25.759 12.289 1.00 0.00 H new ATOM 0 HD2 TYR A 8 -25.903 -28.315 9.864 1.00 0.00 H new ATOM 0 HE1 TYR A 8 -26.439 -25.657 14.005 1.00 0.00 H new ATOM 0 HE2 TYR A 8 -24.052 -28.205 11.587 1.00 0.00 H new ATOM 0 HH TYR A 8 -23.419 -27.411 13.484 1.00 0.00 H new ATOM 123 N ALA A 9 -27.737 -27.014 6.968 1.00 0.00 N ATOM 124 CA ALA A 9 -26.885 -27.314 5.830 1.00 0.00 C ATOM 125 C ALA A 9 -26.910 -26.136 4.854 1.00 0.00 C ATOM 126 O ALA A 9 -25.948 -25.911 4.122 1.00 0.00 O ATOM 127 CB ALA A 9 -27.343 -28.621 5.179 1.00 0.00 C ATOM 0 H ALA A 9 -28.600 -27.556 7.009 1.00 0.00 H new ATOM 0 HA ALA A 9 -25.853 -27.454 6.151 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -26.704 -28.846 4.325 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -27.277 -29.432 5.905 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -28.375 -28.518 4.843 1.00 0.00 H new ATOM 133 N ALA A 10 -28.022 -25.416 4.875 1.00 0.00 N ATOM 134 CA ALA A 10 -28.185 -24.266 4.002 1.00 0.00 C ATOM 135 C ALA A 10 -27.140 -23.208 4.358 1.00 0.00 C ATOM 136 O ALA A 10 -26.278 -22.883 3.543 1.00 0.00 O ATOM 137 CB ALA A 10 -29.616 -23.736 4.118 1.00 0.00 C ATOM 0 H ALA A 10 -28.819 -25.607 5.483 1.00 0.00 H new ATOM 0 HA ALA A 10 -28.025 -24.548 2.961 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -29.739 -22.873 3.463 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -30.318 -24.517 3.825 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -29.812 -23.440 5.149 1.00 0.00 H new ATOM 143 N LEU A 11 -27.251 -22.699 5.576 1.00 0.00 N ATOM 144 CA LEU A 11 -26.326 -21.683 6.050 1.00 0.00 C ATOM 145 C LEU A 11 -24.895 -22.217 5.952 1.00 0.00 C ATOM 146 O LEU A 11 -23.989 -21.500 5.532 1.00 0.00 O ATOM 147 CB LEU A 11 -26.714 -21.218 7.455 1.00 0.00 C ATOM 148 CG LEU A 11 -26.514 -22.238 8.578 1.00 0.00 C ATOM 149 CD1 LEU A 11 -25.137 -22.077 9.225 1.00 0.00 C ATOM 150 CD2 LEU A 11 -27.644 -22.151 9.606 1.00 0.00 C ATOM 0 H LEU A 11 -27.967 -22.971 6.249 1.00 0.00 H new ATOM 0 HA LEU A 11 -26.380 -20.795 5.420 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -26.135 -20.326 7.694 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -27.763 -20.923 7.442 1.00 0.00 H new ATOM 0 HG LEU A 11 -26.551 -23.237 8.143 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -25.020 -22.814 10.020 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -24.362 -22.228 8.474 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -25.046 -21.074 9.643 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -27.477 -22.886 10.393 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -27.664 -21.152 10.041 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -28.597 -22.353 9.117 1.00 0.00 H new ATOM 162 N VAL A 12 -24.738 -23.472 6.347 1.00 0.00 N ATOM 163 CA VAL A 12 -23.433 -24.110 6.309 1.00 0.00 C ATOM 164 C VAL A 12 -22.847 -23.981 4.902 1.00 0.00 C ATOM 165 O VAL A 12 -21.696 -23.581 4.739 1.00 0.00 O ATOM 166 CB VAL A 12 -23.547 -25.562 6.779 1.00 0.00 C ATOM 167 CG1 VAL A 12 -22.365 -26.394 6.278 1.00 0.00 C ATOM 168 CG2 VAL A 12 -23.665 -25.638 8.302 1.00 0.00 C ATOM 0 H VAL A 12 -25.492 -24.064 6.695 1.00 0.00 H new ATOM 0 HA VAL A 12 -22.745 -23.614 6.994 1.00 0.00 H new ATOM 0 HB VAL A 12 -24.458 -25.982 6.352 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -22.470 -27.422 6.626 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -22.346 -26.380 5.188 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -21.436 -25.974 6.663 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -23.745 -26.681 8.609 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -22.781 -25.192 8.758 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -24.553 -25.096 8.626 1.00 0.00 H new ATOM 178 N THR A 13 -23.667 -24.327 3.920 1.00 0.00 N ATOM 179 CA THR A 13 -23.245 -24.255 2.532 1.00 0.00 C ATOM 180 C THR A 13 -22.903 -22.813 2.153 1.00 0.00 C ATOM 181 O THR A 13 -21.962 -22.572 1.399 1.00 0.00 O ATOM 182 CB THR A 13 -24.352 -24.865 1.669 1.00 0.00 C ATOM 183 OG1 THR A 13 -24.213 -26.269 1.868 1.00 0.00 O ATOM 184 CG2 THR A 13 -24.099 -24.673 0.172 1.00 0.00 C ATOM 0 H THR A 13 -24.622 -24.658 4.059 1.00 0.00 H new ATOM 0 HA THR A 13 -22.332 -24.826 2.366 1.00 0.00 H new ATOM 0 HB THR A 13 -25.309 -24.417 1.936 1.00 0.00 H new ATOM 0 HG1 THR A 13 -24.734 -26.541 2.652 1.00 0.00 H new ATOM 0 HG21 THR A 13 -24.913 -25.124 -0.395 1.00 0.00 H new ATOM 0 HG22 THR A 13 -24.045 -23.608 -0.054 1.00 0.00 H new ATOM 0 HG23 THR A 13 -23.158 -25.150 -0.102 1.00 0.00 H new ATOM 192 N PHE A 14 -23.688 -21.891 2.692 1.00 0.00 N ATOM 193 CA PHE A 14 -23.480 -20.479 2.420 1.00 0.00 C ATOM 194 C PHE A 14 -22.114 -20.017 2.931 1.00 0.00 C ATOM 195 O PHE A 14 -21.318 -19.465 2.173 1.00 0.00 O ATOM 196 CB PHE A 14 -24.575 -19.714 3.166 1.00 0.00 C ATOM 197 CG PHE A 14 -24.971 -18.392 2.505 1.00 0.00 C ATOM 198 CD1 PHE A 14 -25.450 -18.385 1.232 1.00 0.00 C ATOM 199 CD2 PHE A 14 -24.844 -17.224 3.191 1.00 0.00 C ATOM 200 CE1 PHE A 14 -25.817 -17.158 0.619 1.00 0.00 C ATOM 201 CE2 PHE A 14 -25.211 -15.997 2.578 1.00 0.00 C ATOM 202 CZ PHE A 14 -25.690 -15.990 1.305 1.00 0.00 C ATOM 0 H PHE A 14 -24.469 -22.095 3.316 1.00 0.00 H new ATOM 0 HA PHE A 14 -23.516 -20.298 1.346 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -25.458 -20.348 3.244 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -24.236 -19.513 4.182 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -25.551 -19.312 0.688 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -24.464 -17.230 4.202 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -26.197 -17.152 -0.392 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -25.110 -15.070 3.122 1.00 0.00 H new ATOM 0 HZ PHE A 14 -25.970 -15.057 0.839 1.00 0.00 H new ATOM 212 N GLY A 15 -21.884 -20.261 4.213 1.00 0.00 N ATOM 213 CA GLY A 15 -20.627 -19.877 4.833 1.00 0.00 C ATOM 214 C GLY A 15 -19.452 -20.626 4.202 1.00 0.00 C ATOM 215 O GLY A 15 -18.327 -20.130 4.194 1.00 0.00 O ATOM 0 H GLY A 15 -22.546 -20.719 4.839 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -20.478 -18.803 4.725 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -20.665 -20.088 5.902 1.00 0.00 H new ATOM 219 N SER A 16 -19.754 -21.809 3.688 1.00 0.00 N ATOM 220 CA SER A 16 -18.737 -22.632 3.056 1.00 0.00 C ATOM 221 C SER A 16 -18.297 -21.998 1.735 1.00 0.00 C ATOM 222 O SER A 16 -17.102 -21.889 1.462 1.00 0.00 O ATOM 223 CB SER A 16 -19.248 -24.054 2.817 1.00 0.00 C ATOM 224 OG SER A 16 -18.468 -25.025 3.510 1.00 0.00 O ATOM 0 H SER A 16 -20.689 -22.217 3.696 1.00 0.00 H new ATOM 0 HA SER A 16 -17.880 -22.691 3.727 1.00 0.00 H new ATOM 0 HB2 SER A 16 -20.286 -24.125 3.140 1.00 0.00 H new ATOM 0 HB3 SER A 16 -19.231 -24.271 1.749 1.00 0.00 H new ATOM 0 HG SER A 16 -18.827 -25.920 3.333 1.00 0.00 H new ATOM 230 N ILE A 17 -19.285 -21.596 0.950 1.00 0.00 N ATOM 231 CA ILE A 17 -19.015 -20.975 -0.335 1.00 0.00 C ATOM 232 C ILE A 17 -18.404 -19.590 -0.110 1.00 0.00 C ATOM 233 O ILE A 17 -17.228 -19.373 -0.398 1.00 0.00 O ATOM 234 CB ILE A 17 -20.279 -20.956 -1.197 1.00 0.00 C ATOM 235 CG1 ILE A 17 -20.749 -22.378 -1.512 1.00 0.00 C ATOM 236 CG2 ILE A 17 -20.066 -20.128 -2.466 1.00 0.00 C ATOM 237 CD1 ILE A 17 -19.640 -23.184 -2.191 1.00 0.00 C ATOM 0 H ILE A 17 -20.275 -21.688 1.179 1.00 0.00 H new ATOM 0 HA ILE A 17 -18.284 -21.559 -0.894 1.00 0.00 H new ATOM 0 HB ILE A 17 -21.073 -20.473 -0.628 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -21.054 -22.876 -0.592 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -21.625 -22.340 -2.160 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -20.980 -20.131 -3.060 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -19.814 -19.103 -2.194 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -19.252 -20.559 -3.049 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -20.000 -24.191 -2.404 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -19.354 -22.696 -3.123 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -18.775 -23.240 -1.531 1.00 0.00 H new ATOM 249 N PHE A 18 -19.230 -18.690 0.402 1.00 0.00 N ATOM 250 CA PHE A 18 -18.786 -17.333 0.669 1.00 0.00 C ATOM 251 C PHE A 18 -17.507 -17.330 1.510 1.00 0.00 C ATOM 252 O PHE A 18 -16.552 -16.624 1.191 1.00 0.00 O ATOM 253 CB PHE A 18 -19.901 -16.644 1.458 1.00 0.00 C ATOM 254 CG PHE A 18 -20.716 -15.642 0.637 1.00 0.00 C ATOM 255 CD1 PHE A 18 -21.462 -16.072 -0.416 1.00 0.00 C ATOM 256 CD2 PHE A 18 -20.694 -14.321 0.960 1.00 0.00 C ATOM 257 CE1 PHE A 18 -22.218 -15.143 -1.178 1.00 0.00 C ATOM 258 CE2 PHE A 18 -21.450 -13.391 0.198 1.00 0.00 C ATOM 259 CZ PHE A 18 -22.196 -13.822 -0.855 1.00 0.00 C ATOM 0 H PHE A 18 -20.205 -18.874 0.639 1.00 0.00 H new ATOM 0 HA PHE A 18 -18.574 -16.820 -0.269 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -20.573 -17.404 1.856 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -19.462 -16.127 2.312 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -21.479 -17.121 -0.673 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -20.102 -13.979 1.796 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -22.810 -15.485 -2.014 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -21.433 -12.342 0.454 1.00 0.00 H new ATOM 0 HZ PHE A 18 -22.771 -13.115 -1.435 1.00 0.00 H new ATOM 269 N GLY A 19 -17.530 -18.128 2.567 1.00 0.00 N ATOM 270 CA GLY A 19 -16.385 -18.227 3.456 1.00 0.00 C ATOM 271 C GLY A 19 -15.765 -16.850 3.706 1.00 0.00 C ATOM 272 O GLY A 19 -14.584 -16.639 3.436 1.00 0.00 O ATOM 0 H GLY A 19 -18.324 -18.713 2.828 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -16.693 -18.669 4.404 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -15.639 -18.892 3.022 1.00 0.00 H new ATOM 276 N TYR A 20 -16.590 -15.950 4.220 1.00 0.00 N ATOM 277 CA TYR A 20 -16.138 -14.600 4.510 1.00 0.00 C ATOM 278 C TYR A 20 -15.411 -13.995 3.308 1.00 0.00 C ATOM 279 O TYR A 20 -14.203 -14.172 3.155 1.00 0.00 O ATOM 280 CB TYR A 20 -15.155 -14.725 5.676 1.00 0.00 C ATOM 281 CG TYR A 20 -15.766 -14.409 7.042 1.00 0.00 C ATOM 282 CD1 TYR A 20 -15.745 -13.117 7.525 1.00 0.00 C ATOM 283 CD2 TYR A 20 -16.339 -15.417 7.791 1.00 0.00 C ATOM 284 CE1 TYR A 20 -16.320 -12.819 8.811 1.00 0.00 C ATOM 285 CE2 TYR A 20 -16.914 -15.119 9.078 1.00 0.00 C ATOM 286 CZ TYR A 20 -16.876 -13.835 9.524 1.00 0.00 C ATOM 287 OH TYR A 20 -17.420 -13.554 10.739 1.00 0.00 O ATOM 0 H TYR A 20 -17.569 -16.129 4.443 1.00 0.00 H new ATOM 0 HA TYR A 20 -16.984 -13.954 4.744 1.00 0.00 H new ATOM 0 HB2 TYR A 20 -14.756 -15.739 5.694 1.00 0.00 H new ATOM 0 HB3 TYR A 20 -14.314 -14.054 5.502 1.00 0.00 H new ATOM 0 HD1 TYR A 20 -15.297 -12.329 6.938 1.00 0.00 H new ATOM 0 HD2 TYR A 20 -16.356 -16.428 7.413 1.00 0.00 H new ATOM 0 HE1 TYR A 20 -16.310 -11.812 9.200 1.00 0.00 H new ATOM 0 HE2 TYR A 20 -17.365 -15.898 9.675 1.00 0.00 H new ATOM 0 HH TYR A 20 -17.781 -14.375 11.134 1.00 0.00 H new ATOM 297 N LYS A 21 -16.176 -13.294 2.484 1.00 0.00 N ATOM 298 CA LYS A 21 -15.619 -12.663 1.300 1.00 0.00 C ATOM 299 C LYS A 21 -14.448 -11.767 1.708 1.00 0.00 C ATOM 300 O LYS A 21 -14.645 -10.730 2.339 1.00 0.00 O ATOM 301 CB LYS A 21 -16.712 -11.928 0.520 1.00 0.00 C ATOM 302 CG LYS A 21 -16.381 -11.878 -0.972 1.00 0.00 C ATOM 303 CD LYS A 21 -17.342 -10.948 -1.716 1.00 0.00 C ATOM 304 CE LYS A 21 -18.081 -11.698 -2.826 1.00 0.00 C ATOM 305 NZ LYS A 21 -18.982 -10.781 -3.560 1.00 0.00 N ATOM 0 H LYS A 21 -17.177 -13.149 2.613 1.00 0.00 H new ATOM 0 HA LYS A 21 -15.223 -13.416 0.618 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -17.669 -12.429 0.667 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -16.820 -10.915 0.906 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -15.356 -11.533 -1.109 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -16.439 -12.881 -1.395 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -18.062 -10.527 -1.015 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -16.788 -10.113 -2.143 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -17.362 -12.140 -3.516 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -18.657 -12.518 -2.398 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -19.476 -11.306 -4.310 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -19.680 -10.379 -2.902 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -18.424 -10.013 -3.985 1.00 0.00 H new ATOM 319 N ARG A 22 -13.254 -12.201 1.331 1.00 0.00 N ATOM 320 CA ARG A 22 -12.051 -11.452 1.650 1.00 0.00 C ATOM 321 C ARG A 22 -10.818 -12.164 1.090 1.00 0.00 C ATOM 322 O ARG A 22 -9.829 -12.349 1.798 1.00 0.00 O ATOM 323 CB ARG A 22 -11.891 -11.283 3.162 1.00 0.00 C ATOM 324 CG ARG A 22 -11.309 -9.910 3.502 1.00 0.00 C ATOM 325 CD ARG A 22 -10.200 -10.029 4.551 1.00 0.00 C ATOM 326 NE ARG A 22 -10.502 -9.156 5.707 1.00 0.00 N ATOM 327 CZ ARG A 22 -11.554 -9.324 6.521 1.00 0.00 C ATOM 328 NH1 ARG A 22 -12.410 -10.332 6.309 1.00 0.00 N ATOM 329 NH2 ARG A 22 -11.749 -8.483 7.546 1.00 0.00 N ATOM 0 H ARG A 22 -13.094 -13.062 0.808 1.00 0.00 H new ATOM 0 HA ARG A 22 -12.144 -10.466 1.194 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -12.859 -11.402 3.649 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -11.239 -12.065 3.552 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -10.912 -9.445 2.599 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -12.099 -9.258 3.875 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -10.109 -11.064 4.880 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -9.242 -9.748 4.113 1.00 0.00 H new ATOM 0 HE ARG A 22 -9.870 -8.378 5.896 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -12.261 -10.972 5.528 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -13.210 -10.460 6.928 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -11.097 -7.715 7.707 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -12.549 -8.611 8.165 1.00 0.00 H new ATOM 343 N ARG A 23 -10.917 -12.545 -0.175 1.00 0.00 N ATOM 344 CA ARG A 23 -9.822 -13.233 -0.838 1.00 0.00 C ATOM 345 C ARG A 23 -8.567 -12.359 -0.835 1.00 0.00 C ATOM 346 O ARG A 23 -8.374 -11.546 0.068 1.00 0.00 O ATOM 347 CB ARG A 23 -10.187 -13.585 -2.282 1.00 0.00 C ATOM 348 CG ARG A 23 -9.668 -14.975 -2.654 1.00 0.00 C ATOM 349 CD ARG A 23 -9.654 -15.166 -4.173 1.00 0.00 C ATOM 350 NE ARG A 23 -10.917 -15.798 -4.615 1.00 0.00 N ATOM 351 CZ ARG A 23 -11.097 -16.352 -5.822 1.00 0.00 C ATOM 352 NH1 ARG A 23 -10.097 -16.355 -6.714 1.00 0.00 N ATOM 353 NH2 ARG A 23 -12.277 -16.903 -6.137 1.00 0.00 N ATOM 0 H ARG A 23 -11.739 -12.390 -0.759 1.00 0.00 H new ATOM 0 HA ARG A 23 -9.628 -14.155 -0.289 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -11.269 -13.552 -2.406 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -9.766 -12.842 -2.959 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -8.662 -15.110 -2.258 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -10.297 -15.737 -2.194 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -9.527 -14.203 -4.668 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -8.806 -15.787 -4.462 1.00 0.00 H new ATOM 0 HE ARG A 23 -11.699 -15.813 -3.960 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -9.199 -15.936 -6.474 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -10.234 -16.777 -7.633 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -13.038 -16.901 -5.458 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -12.414 -17.325 -7.056 1.00 0.00 H new ATOM 367 N GLY A 24 -7.745 -12.555 -1.856 1.00 0.00 N ATOM 368 CA GLY A 24 -6.513 -11.795 -1.982 1.00 0.00 C ATOM 369 C GLY A 24 -5.291 -12.695 -1.789 1.00 0.00 C ATOM 370 O GLY A 24 -4.987 -13.104 -0.669 1.00 0.00 O ATOM 0 H GLY A 24 -7.908 -13.229 -2.604 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -6.471 -11.324 -2.964 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -6.499 -10.993 -1.244 1.00 0.00 H new ATOM 374 N GLY A 25 -4.623 -12.978 -2.898 1.00 0.00 N ATOM 375 CA GLY A 25 -3.441 -13.822 -2.865 1.00 0.00 C ATOM 376 C GLY A 25 -3.042 -14.262 -4.275 1.00 0.00 C ATOM 377 O GLY A 25 -2.043 -13.791 -4.817 1.00 0.00 O ATOM 0 H GLY A 25 -4.878 -12.638 -3.825 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -2.616 -13.281 -2.402 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -3.633 -14.699 -2.247 1.00 0.00 H new ATOM 381 N VAL A 26 -3.843 -15.161 -4.829 1.00 0.00 N ATOM 382 CA VAL A 26 -3.586 -15.670 -6.165 1.00 0.00 C ATOM 383 C VAL A 26 -3.824 -14.554 -7.185 1.00 0.00 C ATOM 384 O VAL A 26 -2.965 -14.280 -8.022 1.00 0.00 O ATOM 385 CB VAL A 26 -4.442 -16.911 -6.426 1.00 0.00 C ATOM 386 CG1 VAL A 26 -5.069 -16.861 -7.821 1.00 0.00 C ATOM 387 CG2 VAL A 26 -3.624 -18.190 -6.237 1.00 0.00 C ATOM 0 H VAL A 26 -4.670 -15.550 -4.376 1.00 0.00 H new ATOM 0 HA VAL A 26 -2.546 -15.983 -6.261 1.00 0.00 H new ATOM 0 HB VAL A 26 -5.251 -16.920 -5.696 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -5.672 -17.755 -7.981 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -5.701 -15.977 -7.904 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -4.281 -16.816 -8.573 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -4.256 -19.057 -6.428 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -2.785 -18.191 -6.933 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -3.248 -18.234 -5.215 1.00 0.00 H new ATOM 397 N PRO A 27 -5.025 -13.925 -7.079 1.00 0.00 N ATOM 398 CA PRO A 27 -5.387 -12.846 -7.983 1.00 0.00 C ATOM 399 C PRO A 27 -4.642 -11.559 -7.625 1.00 0.00 C ATOM 400 O PRO A 27 -4.772 -11.051 -6.512 1.00 0.00 O ATOM 401 CB PRO A 27 -6.896 -12.714 -7.854 1.00 0.00 C ATOM 402 CG PRO A 27 -7.264 -13.402 -6.550 1.00 0.00 C ATOM 403 CD PRO A 27 -6.067 -14.223 -6.101 1.00 0.00 C ATOM 0 HA PRO A 27 -5.105 -13.050 -9.016 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -7.197 -11.666 -7.841 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -7.403 -13.181 -8.699 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -7.528 -12.665 -5.791 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -8.135 -14.042 -6.689 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -5.754 -13.949 -5.093 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -6.301 -15.287 -6.084 1.00 0.00 H new ATOM 411 N SER A 28 -3.877 -11.068 -8.589 1.00 0.00 N ATOM 412 CA SER A 28 -3.111 -9.849 -8.390 1.00 0.00 C ATOM 413 C SER A 28 -3.957 -8.631 -8.766 1.00 0.00 C ATOM 414 O SER A 28 -3.669 -7.515 -8.338 1.00 0.00 O ATOM 415 CB SER A 28 -1.819 -9.871 -9.209 1.00 0.00 C ATOM 416 OG SER A 28 -1.185 -11.147 -9.173 1.00 0.00 O ATOM 0 H SER A 28 -3.771 -11.492 -9.510 1.00 0.00 H new ATOM 0 HA SER A 28 -2.841 -9.784 -7.336 1.00 0.00 H new ATOM 0 HB2 SER A 28 -2.041 -9.605 -10.243 1.00 0.00 H new ATOM 0 HB3 SER A 28 -1.134 -9.115 -8.826 1.00 0.00 H new ATOM 0 HG SER A 28 -0.315 -11.093 -9.620 1.00 0.00 H new ATOM 422 N LEU A 29 -4.985 -8.888 -9.562 1.00 0.00 N ATOM 423 CA LEU A 29 -5.875 -7.827 -10.001 1.00 0.00 C ATOM 424 C LEU A 29 -6.249 -6.953 -8.802 1.00 0.00 C ATOM 425 O LEU A 29 -6.141 -5.729 -8.863 1.00 0.00 O ATOM 426 CB LEU A 29 -7.083 -8.410 -10.737 1.00 0.00 C ATOM 427 CG LEU A 29 -7.698 -9.670 -10.123 1.00 0.00 C ATOM 428 CD1 LEU A 29 -9.186 -9.467 -9.832 1.00 0.00 C ATOM 429 CD2 LEU A 29 -7.449 -10.890 -11.012 1.00 0.00 C ATOM 0 H LEU A 29 -5.221 -9.816 -9.914 1.00 0.00 H new ATOM 0 HA LEU A 29 -5.372 -7.183 -10.722 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -7.855 -7.643 -10.792 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -6.785 -8.637 -11.761 1.00 0.00 H new ATOM 0 HG LEU A 29 -7.206 -9.861 -9.169 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -9.599 -10.377 -9.396 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -9.310 -8.641 -9.132 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -9.710 -9.239 -10.760 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -7.896 -11.772 -10.553 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -7.897 -10.724 -11.992 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -6.376 -11.045 -11.126 1.00 0.00 H new ATOM 441 N ILE A 30 -6.682 -7.616 -7.739 1.00 0.00 N ATOM 442 CA ILE A 30 -7.073 -6.915 -6.528 1.00 0.00 C ATOM 443 C ILE A 30 -5.868 -6.150 -5.975 1.00 0.00 C ATOM 444 O ILE A 30 -6.024 -5.086 -5.378 1.00 0.00 O ATOM 445 CB ILE A 30 -7.698 -7.886 -5.524 1.00 0.00 C ATOM 446 CG1 ILE A 30 -8.275 -7.136 -4.322 1.00 0.00 C ATOM 447 CG2 ILE A 30 -6.693 -8.959 -5.102 1.00 0.00 C ATOM 448 CD1 ILE A 30 -9.098 -5.927 -4.773 1.00 0.00 C ATOM 0 H ILE A 30 -6.770 -8.631 -7.692 1.00 0.00 H new ATOM 0 HA ILE A 30 -7.846 -6.179 -6.747 1.00 0.00 H new ATOM 0 HB ILE A 30 -8.528 -8.396 -6.013 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -8.901 -7.808 -3.736 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -7.465 -6.807 -3.671 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -7.162 -9.636 -4.388 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -6.372 -9.521 -5.979 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -5.828 -8.485 -4.638 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -9.497 -5.412 -3.899 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -8.463 -5.245 -5.338 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -9.922 -6.262 -5.403 1.00 0.00 H new ATOM 460 N ALA A 31 -4.693 -6.723 -6.193 1.00 0.00 N ATOM 461 CA ALA A 31 -3.463 -6.108 -5.725 1.00 0.00 C ATOM 462 C ALA A 31 -3.312 -4.726 -6.363 1.00 0.00 C ATOM 463 O ALA A 31 -3.088 -3.738 -5.667 1.00 0.00 O ATOM 464 CB ALA A 31 -2.281 -7.028 -6.039 1.00 0.00 C ATOM 0 H ALA A 31 -4.567 -7.606 -6.687 1.00 0.00 H new ATOM 0 HA ALA A 31 -3.491 -5.969 -4.644 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -1.358 -6.567 -5.688 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -2.422 -7.985 -5.537 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -2.220 -7.188 -7.116 1.00 0.00 H new ATOM 470 N GLY A 32 -3.442 -4.701 -7.682 1.00 0.00 N ATOM 471 CA GLY A 32 -3.323 -3.457 -8.422 1.00 0.00 C ATOM 472 C GLY A 32 -4.391 -2.453 -7.982 1.00 0.00 C ATOM 473 O GLY A 32 -4.070 -1.334 -7.586 1.00 0.00 O ATOM 0 H GLY A 32 -3.629 -5.523 -8.257 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -2.332 -3.031 -8.267 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -3.422 -3.654 -9.490 1.00 0.00 H new ATOM 477 N LEU A 33 -5.639 -2.890 -8.066 1.00 0.00 N ATOM 478 CA LEU A 33 -6.755 -2.044 -7.682 1.00 0.00 C ATOM 479 C LEU A 33 -6.460 -1.401 -6.325 1.00 0.00 C ATOM 480 O LEU A 33 -6.672 -0.204 -6.142 1.00 0.00 O ATOM 481 CB LEU A 33 -8.064 -2.836 -7.715 1.00 0.00 C ATOM 482 CG LEU A 33 -9.271 -2.166 -7.055 1.00 0.00 C ATOM 483 CD1 LEU A 33 -10.309 -1.755 -8.101 1.00 0.00 C ATOM 484 CD2 LEU A 33 -9.872 -3.063 -5.972 1.00 0.00 C ATOM 0 H LEU A 33 -5.901 -3.819 -8.395 1.00 0.00 H new ATOM 0 HA LEU A 33 -6.881 -1.233 -8.399 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -8.313 -3.044 -8.755 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -7.896 -3.797 -7.229 1.00 0.00 H new ATOM 0 HG LEU A 33 -8.930 -1.254 -6.564 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -11.157 -1.281 -7.606 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -9.860 -1.052 -8.803 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -10.651 -2.638 -8.641 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -10.728 -2.563 -5.519 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -10.195 -4.004 -6.417 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -9.122 -3.262 -5.207 1.00 0.00 H new ATOM 496 N PHE A 34 -5.974 -2.226 -5.409 1.00 0.00 N ATOM 497 CA PHE A 34 -5.647 -1.753 -4.075 1.00 0.00 C ATOM 498 C PHE A 34 -4.609 -0.631 -4.130 1.00 0.00 C ATOM 499 O PHE A 34 -4.813 0.438 -3.557 1.00 0.00 O ATOM 500 CB PHE A 34 -5.057 -2.941 -3.312 1.00 0.00 C ATOM 501 CG PHE A 34 -5.140 -2.806 -1.790 1.00 0.00 C ATOM 502 CD1 PHE A 34 -6.348 -2.859 -1.168 1.00 0.00 C ATOM 503 CD2 PHE A 34 -4.006 -2.634 -1.059 1.00 0.00 C ATOM 504 CE1 PHE A 34 -6.425 -2.734 0.245 1.00 0.00 C ATOM 505 CE2 PHE A 34 -4.083 -2.509 0.353 1.00 0.00 C ATOM 506 CZ PHE A 34 -5.291 -2.561 0.975 1.00 0.00 C ATOM 0 H PHE A 34 -5.799 -3.219 -5.565 1.00 0.00 H new ATOM 0 HA PHE A 34 -6.541 -1.361 -3.590 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -5.578 -3.849 -3.615 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -4.013 -3.062 -3.599 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -7.249 -2.996 -1.748 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -3.046 -2.592 -1.553 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -7.384 -2.776 0.739 1.00 0.00 H new ATOM 0 HE2 PHE A 34 -3.182 -2.373 0.933 1.00 0.00 H new ATOM 0 HZ PHE A 34 -5.350 -2.465 2.049 1.00 0.00 H new ATOM 516 N VAL A 35 -3.516 -0.912 -4.825 1.00 0.00 N ATOM 517 CA VAL A 35 -2.446 0.060 -4.963 1.00 0.00 C ATOM 518 C VAL A 35 -3.032 1.397 -5.421 1.00 0.00 C ATOM 519 O VAL A 35 -2.603 2.456 -4.967 1.00 0.00 O ATOM 520 CB VAL A 35 -1.370 -0.476 -5.909 1.00 0.00 C ATOM 521 CG1 VAL A 35 -0.556 0.667 -6.519 1.00 0.00 C ATOM 522 CG2 VAL A 35 -0.459 -1.476 -5.194 1.00 0.00 C ATOM 0 H VAL A 35 -3.349 -1.800 -5.299 1.00 0.00 H new ATOM 0 HA VAL A 35 -1.960 0.230 -4.002 1.00 0.00 H new ATOM 0 HB VAL A 35 -1.872 -1.001 -6.722 1.00 0.00 H new ATOM 0 HG11 VAL A 35 0.202 0.258 -7.187 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -1.218 1.326 -7.081 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -0.071 1.233 -5.724 1.00 0.00 H new ATOM 0 HG21 VAL A 35 0.297 -1.841 -5.889 1.00 0.00 H new ATOM 0 HG22 VAL A 35 0.029 -0.986 -4.352 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -1.053 -2.314 -4.831 1.00 0.00 H new ATOM 532 N GLY A 36 -4.005 1.304 -6.316 1.00 0.00 N ATOM 533 CA GLY A 36 -4.655 2.493 -6.841 1.00 0.00 C ATOM 534 C GLY A 36 -5.567 3.129 -5.789 1.00 0.00 C ATOM 535 O GLY A 36 -5.653 4.352 -5.696 1.00 0.00 O ATOM 0 H GLY A 36 -4.359 0.424 -6.691 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -3.901 3.214 -7.158 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -5.239 2.233 -7.724 1.00 0.00 H new ATOM 539 N CYS A 37 -6.224 2.269 -5.024 1.00 0.00 N ATOM 540 CA CYS A 37 -7.125 2.732 -3.983 1.00 0.00 C ATOM 541 C CYS A 37 -6.319 3.563 -2.983 1.00 0.00 C ATOM 542 O CYS A 37 -6.688 4.693 -2.669 1.00 0.00 O ATOM 543 CB CYS A 37 -7.850 1.568 -3.305 1.00 0.00 C ATOM 544 SG CYS A 37 -9.657 1.726 -3.552 1.00 0.00 S ATOM 0 H CYS A 37 -6.150 1.255 -5.105 1.00 0.00 H new ATOM 0 HA CYS A 37 -7.905 3.353 -4.423 1.00 0.00 H new ATOM 0 HB2 CYS A 37 -7.500 0.621 -3.717 1.00 0.00 H new ATOM 0 HB3 CYS A 37 -7.620 1.557 -2.240 1.00 0.00 H new ATOM 0 HG CYS A 37 -10.263 0.731 -2.974 1.00 0.00 H new ATOM 550 N LEU A 38 -5.232 2.970 -2.510 1.00 0.00 N ATOM 551 CA LEU A 38 -4.371 3.641 -1.552 1.00 0.00 C ATOM 552 C LEU A 38 -3.712 4.848 -2.223 1.00 0.00 C ATOM 553 O LEU A 38 -3.447 5.857 -1.572 1.00 0.00 O ATOM 554 CB LEU A 38 -3.372 2.653 -0.946 1.00 0.00 C ATOM 555 CG LEU A 38 -2.357 2.045 -1.916 1.00 0.00 C ATOM 556 CD1 LEU A 38 -1.240 3.040 -2.236 1.00 0.00 C ATOM 557 CD2 LEU A 38 -1.809 0.722 -1.378 1.00 0.00 C ATOM 0 H LEU A 38 -4.928 2.032 -2.773 1.00 0.00 H new ATOM 0 HA LEU A 38 -4.956 4.021 -0.715 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -2.826 3.161 -0.151 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -3.931 1.841 -0.480 1.00 0.00 H new ATOM 0 HG LEU A 38 -2.869 1.824 -2.852 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -0.532 2.583 -2.927 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -1.668 3.933 -2.692 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -0.723 3.315 -1.317 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -1.090 0.311 -2.087 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -1.317 0.894 -0.421 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -2.629 0.017 -1.243 1.00 0.00 H new ATOM 569 N ALA A 39 -3.465 4.703 -3.517 1.00 0.00 N ATOM 570 CA ALA A 39 -2.842 5.769 -4.284 1.00 0.00 C ATOM 571 C ALA A 39 -3.712 7.024 -4.204 1.00 0.00 C ATOM 572 O ALA A 39 -3.200 8.129 -4.031 1.00 0.00 O ATOM 573 CB ALA A 39 -2.623 5.301 -5.724 1.00 0.00 C ATOM 0 H ALA A 39 -3.685 3.864 -4.053 1.00 0.00 H new ATOM 0 HA ALA A 39 -1.865 6.019 -3.871 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -2.156 6.100 -6.299 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -1.975 4.425 -5.727 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -3.582 5.044 -6.173 1.00 0.00 H new ATOM 579 N GLY A 40 -5.014 6.813 -4.335 1.00 0.00 N ATOM 580 CA GLY A 40 -5.960 7.914 -4.280 1.00 0.00 C ATOM 581 C GLY A 40 -6.090 8.454 -2.854 1.00 0.00 C ATOM 582 O GLY A 40 -5.783 9.617 -2.597 1.00 0.00 O ATOM 0 H GLY A 40 -5.436 5.895 -4.479 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -5.634 8.712 -4.947 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -6.934 7.579 -4.636 1.00 0.00 H new ATOM 586 N TYR A 41 -6.547 7.585 -1.965 1.00 0.00 N ATOM 587 CA TYR A 41 -6.721 7.960 -0.572 1.00 0.00 C ATOM 588 C TYR A 41 -5.507 8.736 -0.057 1.00 0.00 C ATOM 589 O TYR A 41 -5.649 9.655 0.747 1.00 0.00 O ATOM 590 CB TYR A 41 -6.842 6.649 0.206 1.00 0.00 C ATOM 591 CG TYR A 41 -7.039 6.835 1.712 1.00 0.00 C ATOM 592 CD1 TYR A 41 -8.307 7.016 2.225 1.00 0.00 C ATOM 593 CD2 TYR A 41 -5.948 6.822 2.557 1.00 0.00 C ATOM 594 CE1 TYR A 41 -8.493 7.191 3.642 1.00 0.00 C ATOM 595 CE2 TYR A 41 -6.133 6.997 3.974 1.00 0.00 C ATOM 596 CZ TYR A 41 -7.396 7.173 4.447 1.00 0.00 C ATOM 597 OH TYR A 41 -7.571 7.338 5.785 1.00 0.00 O ATOM 0 H TYR A 41 -6.802 6.622 -2.182 1.00 0.00 H new ATOM 0 HA TYR A 41 -7.596 8.598 -0.453 1.00 0.00 H new ATOM 0 HB2 TYR A 41 -7.681 6.078 -0.192 1.00 0.00 H new ATOM 0 HB3 TYR A 41 -5.944 6.055 0.038 1.00 0.00 H new ATOM 0 HD1 TYR A 41 -9.160 7.026 1.563 1.00 0.00 H new ATOM 0 HD2 TYR A 41 -4.955 6.681 2.155 1.00 0.00 H new ATOM 0 HE1 TYR A 41 -9.480 7.333 4.056 1.00 0.00 H new ATOM 0 HE2 TYR A 41 -5.288 6.989 4.646 1.00 0.00 H new ATOM 0 HH TYR A 41 -6.701 7.302 6.236 1.00 0.00 H new ATOM 607 N GLY A 42 -4.341 8.336 -0.542 1.00 0.00 N ATOM 608 CA GLY A 42 -3.103 8.982 -0.141 1.00 0.00 C ATOM 609 C GLY A 42 -2.837 10.231 -0.984 1.00 0.00 C ATOM 610 O GLY A 42 -2.250 11.197 -0.500 1.00 0.00 O ATOM 0 H GLY A 42 -4.227 7.573 -1.209 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -3.156 9.255 0.913 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -2.273 8.283 -0.248 1.00 0.00 H new ATOM 614 N ALA A 43 -3.283 10.170 -2.230 1.00 0.00 N ATOM 615 CA ALA A 43 -3.100 11.283 -3.145 1.00 0.00 C ATOM 616 C ALA A 43 -3.935 12.473 -2.667 1.00 0.00 C ATOM 617 O ALA A 43 -3.659 13.615 -3.029 1.00 0.00 O ATOM 618 CB ALA A 43 -3.470 10.845 -4.564 1.00 0.00 C ATOM 0 H ALA A 43 -3.771 9.367 -2.627 1.00 0.00 H new ATOM 0 HA ALA A 43 -2.056 11.597 -3.162 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -3.333 11.681 -5.250 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -2.830 10.017 -4.868 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -4.512 10.525 -4.586 1.00 0.00 H new ATOM 624 N TYR A 44 -4.939 12.164 -1.859 1.00 0.00 N ATOM 625 CA TYR A 44 -5.816 13.193 -1.327 1.00 0.00 C ATOM 626 C TYR A 44 -5.063 14.110 -0.362 1.00 0.00 C ATOM 627 O TYR A 44 -5.394 15.287 -0.232 1.00 0.00 O ATOM 628 CB TYR A 44 -6.914 12.455 -0.559 1.00 0.00 C ATOM 629 CG TYR A 44 -8.291 13.117 -0.653 1.00 0.00 C ATOM 630 CD1 TYR A 44 -8.514 14.334 -0.043 1.00 0.00 C ATOM 631 CD2 TYR A 44 -9.309 12.496 -1.347 1.00 0.00 C ATOM 632 CE1 TYR A 44 -9.810 14.957 -0.131 1.00 0.00 C ATOM 633 CE2 TYR A 44 -10.605 13.118 -1.435 1.00 0.00 C ATOM 634 CZ TYR A 44 -10.791 14.318 -0.823 1.00 0.00 C ATOM 635 OH TYR A 44 -12.015 14.906 -0.906 1.00 0.00 O ATOM 0 H TYR A 44 -5.164 11.215 -1.560 1.00 0.00 H new ATOM 0 HA TYR A 44 -6.213 13.813 -2.131 1.00 0.00 H new ATOM 0 HB2 TYR A 44 -6.986 11.435 -0.938 1.00 0.00 H new ATOM 0 HB3 TYR A 44 -6.626 12.386 0.490 1.00 0.00 H new ATOM 0 HD1 TYR A 44 -7.717 14.820 0.501 1.00 0.00 H new ATOM 0 HD2 TYR A 44 -9.134 11.543 -1.824 1.00 0.00 H new ATOM 0 HE1 TYR A 44 -9.998 15.910 0.342 1.00 0.00 H new ATOM 0 HE2 TYR A 44 -11.411 12.642 -1.975 1.00 0.00 H new ATOM 0 HH TYR A 44 -12.616 14.337 -1.431 1.00 0.00 H new ATOM 645 N ARG A 45 -4.063 13.535 0.291 1.00 0.00 N ATOM 646 CA ARG A 45 -3.260 14.286 1.241 1.00 0.00 C ATOM 647 C ARG A 45 -1.920 14.673 0.613 1.00 0.00 C ATOM 648 O ARG A 45 -1.067 15.264 1.275 1.00 0.00 O ATOM 649 CB ARG A 45 -3.004 13.472 2.511 1.00 0.00 C ATOM 650 CG ARG A 45 -3.678 14.119 3.722 1.00 0.00 C ATOM 651 CD ARG A 45 -3.114 13.557 5.029 1.00 0.00 C ATOM 652 NE ARG A 45 -4.220 13.197 5.944 1.00 0.00 N ATOM 653 CZ ARG A 45 -4.068 12.982 7.258 1.00 0.00 C ATOM 654 NH1 ARG A 45 -2.855 13.089 7.818 1.00 0.00 N ATOM 655 NH2 ARG A 45 -5.128 12.660 8.011 1.00 0.00 N ATOM 0 H ARG A 45 -3.791 12.558 0.181 1.00 0.00 H new ATOM 0 HA ARG A 45 -3.815 15.186 1.506 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -3.381 12.458 2.379 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -1.931 13.393 2.687 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -3.529 15.198 3.692 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -4.753 13.944 3.681 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -2.501 12.679 4.823 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -2.465 14.295 5.502 1.00 0.00 H new ATOM 0 HE ARG A 45 -5.156 13.107 5.550 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -2.048 13.334 7.244 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -2.739 12.925 8.818 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -6.051 12.578 7.584 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -5.012 12.496 9.011 1.00 0.00 H new ATOM 669 N VAL A 46 -1.775 14.326 -0.657 1.00 0.00 N ATOM 670 CA VAL A 46 -0.553 14.630 -1.382 1.00 0.00 C ATOM 671 C VAL A 46 -0.563 16.103 -1.796 1.00 0.00 C ATOM 672 O VAL A 46 0.378 16.581 -2.427 1.00 0.00 O ATOM 673 CB VAL A 46 -0.396 13.676 -2.568 1.00 0.00 C ATOM 674 CG1 VAL A 46 0.414 14.327 -3.691 1.00 0.00 C ATOM 675 CG2 VAL A 46 0.237 12.355 -2.129 1.00 0.00 C ATOM 0 H VAL A 46 -2.484 13.837 -1.203 1.00 0.00 H new ATOM 0 HA VAL A 46 0.317 14.478 -0.743 1.00 0.00 H new ATOM 0 HB VAL A 46 -1.391 13.457 -2.956 1.00 0.00 H new ATOM 0 HG11 VAL A 46 0.511 13.628 -4.522 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -0.096 15.228 -4.032 1.00 0.00 H new ATOM 0 HG13 VAL A 46 1.405 14.589 -3.320 1.00 0.00 H new ATOM 0 HG21 VAL A 46 0.337 11.695 -2.991 1.00 0.00 H new ATOM 0 HG22 VAL A 46 1.222 12.547 -1.703 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -0.396 11.879 -1.380 1.00 0.00 H new ATOM 685 N SER A 47 -1.639 16.781 -1.424 1.00 0.00 N ATOM 686 CA SER A 47 -1.785 18.190 -1.749 1.00 0.00 C ATOM 687 C SER A 47 -0.438 18.902 -1.605 1.00 0.00 C ATOM 688 O SER A 47 0.449 18.423 -0.901 1.00 0.00 O ATOM 689 CB SER A 47 -2.835 18.855 -0.857 1.00 0.00 C ATOM 690 OG SER A 47 -3.358 20.043 -1.444 1.00 0.00 O ATOM 0 H SER A 47 -2.418 16.381 -0.901 1.00 0.00 H new ATOM 0 HA SER A 47 -2.123 18.270 -2.782 1.00 0.00 H new ATOM 0 HB2 SER A 47 -3.649 18.154 -0.670 1.00 0.00 H new ATOM 0 HB3 SER A 47 -2.391 19.093 0.110 1.00 0.00 H new ATOM 0 HG SER A 47 -4.026 20.437 -0.845 1.00 0.00 H new ATOM 696 N ASN A 48 -0.329 20.035 -2.284 1.00 0.00 N ATOM 697 CA ASN A 48 0.895 20.818 -2.240 1.00 0.00 C ATOM 698 C ASN A 48 1.920 20.208 -3.199 1.00 0.00 C ATOM 699 O ASN A 48 2.218 20.785 -4.243 1.00 0.00 O ATOM 700 CB ASN A 48 1.501 20.815 -0.836 1.00 0.00 C ATOM 701 CG ASN A 48 1.954 22.219 -0.431 1.00 0.00 C ATOM 702 OD1 ASN A 48 1.553 23.219 -1.005 1.00 0.00 O ATOM 703 ND2 ASN A 48 2.811 22.239 0.586 1.00 0.00 N ATOM 0 H ASN A 48 -1.067 20.429 -2.867 1.00 0.00 H new ATOM 0 HA ASN A 48 0.651 21.841 -2.525 1.00 0.00 H new ATOM 0 HB2 ASN A 48 0.767 20.445 -0.120 1.00 0.00 H new ATOM 0 HB3 ASN A 48 2.350 20.132 -0.804 1.00 0.00 H new ATOM 0 HD21 ASN A 48 3.173 23.128 0.930 1.00 0.00 H new ATOM 0 HD22 ASN A 48 3.106 21.365 1.022 1.00 0.00 H new ATOM 710 N ASP A 49 2.430 19.049 -2.809 1.00 0.00 N ATOM 711 CA ASP A 49 3.415 18.355 -3.620 1.00 0.00 C ATOM 712 C ASP A 49 3.455 16.880 -3.216 1.00 0.00 C ATOM 713 O ASP A 49 3.078 16.008 -3.998 1.00 0.00 O ATOM 714 CB ASP A 49 4.813 18.940 -3.410 1.00 0.00 C ATOM 715 CG ASP A 49 5.750 18.827 -4.615 1.00 0.00 C ATOM 716 OD1 ASP A 49 6.078 17.720 -5.066 1.00 0.00 O ATOM 717 OD2 ASP A 49 6.152 19.952 -5.101 1.00 0.00 O ATOM 0 H ASP A 49 2.179 18.573 -1.942 1.00 0.00 H new ATOM 0 HA ASP A 49 3.130 18.468 -4.666 1.00 0.00 H new ATOM 0 HB2 ASP A 49 4.714 19.992 -3.144 1.00 0.00 H new ATOM 0 HB3 ASP A 49 5.276 18.438 -2.560 1.00 0.00 H new ATOM 722 N LYS A 50 3.914 16.646 -1.996 1.00 0.00 N ATOM 723 CA LYS A 50 4.008 15.292 -1.478 1.00 0.00 C ATOM 724 C LYS A 50 4.718 14.406 -2.504 1.00 0.00 C ATOM 725 O LYS A 50 5.387 14.908 -3.405 1.00 0.00 O ATOM 726 CB LYS A 50 2.626 14.776 -1.073 1.00 0.00 C ATOM 727 CG LYS A 50 2.631 14.270 0.371 1.00 0.00 C ATOM 728 CD LYS A 50 1.944 15.269 1.305 1.00 0.00 C ATOM 729 CE LYS A 50 2.965 15.968 2.205 1.00 0.00 C ATOM 730 NZ LYS A 50 2.554 17.366 2.466 1.00 0.00 N ATOM 0 H LYS A 50 4.225 17.372 -1.350 1.00 0.00 H new ATOM 0 HA LYS A 50 4.609 15.273 -0.569 1.00 0.00 H new ATOM 0 HB2 LYS A 50 1.890 15.573 -1.180 1.00 0.00 H new ATOM 0 HB3 LYS A 50 2.324 13.971 -1.743 1.00 0.00 H new ATOM 0 HG2 LYS A 50 2.122 13.308 0.425 1.00 0.00 H new ATOM 0 HG3 LYS A 50 3.657 14.107 0.699 1.00 0.00 H new ATOM 0 HD2 LYS A 50 1.404 16.011 0.716 1.00 0.00 H new ATOM 0 HD3 LYS A 50 1.207 14.751 1.919 1.00 0.00 H new ATOM 0 HE2 LYS A 50 3.058 15.428 3.147 1.00 0.00 H new ATOM 0 HE3 LYS A 50 3.947 15.954 1.731 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 3.258 17.826 3.078 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 2.488 17.882 1.566 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 1.627 17.373 2.938 1.00 0.00 H new ATOM 744 N ARG A 51 4.547 13.103 -2.333 1.00 0.00 N ATOM 745 CA ARG A 51 5.163 12.143 -3.233 1.00 0.00 C ATOM 746 C ARG A 51 4.439 12.138 -4.580 1.00 0.00 C ATOM 747 O ARG A 51 3.542 12.948 -4.810 1.00 0.00 O ATOM 748 CB ARG A 51 5.132 10.733 -2.639 1.00 0.00 C ATOM 749 CG ARG A 51 3.716 10.356 -2.198 1.00 0.00 C ATOM 750 CD ARG A 51 3.689 9.967 -0.718 1.00 0.00 C ATOM 751 NE ARG A 51 4.699 8.919 -0.451 1.00 0.00 N ATOM 752 CZ ARG A 51 4.719 8.158 0.652 1.00 0.00 C ATOM 753 NH1 ARG A 51 3.785 8.325 1.597 1.00 0.00 N ATOM 754 NH2 ARG A 51 5.674 7.231 0.809 1.00 0.00 N ATOM 0 H ARG A 51 3.991 12.690 -1.585 1.00 0.00 H new ATOM 0 HA ARG A 51 6.201 12.442 -3.376 1.00 0.00 H new ATOM 0 HB2 ARG A 51 5.490 10.015 -3.377 1.00 0.00 H new ATOM 0 HB3 ARG A 51 5.809 10.678 -1.787 1.00 0.00 H new ATOM 0 HG2 ARG A 51 3.042 11.195 -2.370 1.00 0.00 H new ATOM 0 HG3 ARG A 51 3.352 9.526 -2.803 1.00 0.00 H new ATOM 0 HD2 ARG A 51 3.889 10.842 -0.100 1.00 0.00 H new ATOM 0 HD3 ARG A 51 2.697 9.605 -0.447 1.00 0.00 H new ATOM 0 HE ARG A 51 5.426 8.766 -1.150 1.00 0.00 H new ATOM 0 HH11 ARG A 51 3.059 9.031 1.477 1.00 0.00 H new ATOM 0 HH12 ARG A 51 3.800 7.746 2.437 1.00 0.00 H new ATOM 0 HH21 ARG A 51 6.385 7.105 0.089 1.00 0.00 H new ATOM 0 HH22 ARG A 51 5.689 6.652 1.648 1.00 0.00 H new ATOM 768 N ASP A 52 4.856 11.217 -5.437 1.00 0.00 N ATOM 769 CA ASP A 52 4.258 11.097 -6.756 1.00 0.00 C ATOM 770 C ASP A 52 4.277 9.629 -7.187 1.00 0.00 C ATOM 771 O ASP A 52 3.241 8.966 -7.189 1.00 0.00 O ATOM 772 CB ASP A 52 5.043 11.904 -7.792 1.00 0.00 C ATOM 773 CG ASP A 52 4.876 13.421 -7.691 1.00 0.00 C ATOM 774 OD1 ASP A 52 3.820 13.921 -7.275 1.00 0.00 O ATOM 775 OD2 ASP A 52 5.901 14.108 -8.067 1.00 0.00 O ATOM 0 H ASP A 52 5.601 10.547 -5.244 1.00 0.00 H new ATOM 0 HA ASP A 52 3.238 11.477 -6.700 1.00 0.00 H new ATOM 0 HB2 ASP A 52 6.101 11.663 -7.693 1.00 0.00 H new ATOM 0 HB3 ASP A 52 4.735 11.585 -8.788 1.00 0.00 H new ATOM 780 N VAL A 53 5.466 9.164 -7.541 1.00 0.00 N ATOM 781 CA VAL A 53 5.633 7.787 -7.973 1.00 0.00 C ATOM 782 C VAL A 53 6.331 6.992 -6.868 1.00 0.00 C ATOM 783 O VAL A 53 6.401 5.765 -6.931 1.00 0.00 O ATOM 784 CB VAL A 53 6.383 7.744 -9.306 1.00 0.00 C ATOM 785 CG1 VAL A 53 6.445 6.317 -9.854 1.00 0.00 C ATOM 786 CG2 VAL A 53 5.748 8.695 -10.323 1.00 0.00 C ATOM 0 H VAL A 53 6.323 9.717 -7.537 1.00 0.00 H new ATOM 0 HA VAL A 53 4.663 7.320 -8.146 1.00 0.00 H new ATOM 0 HB VAL A 53 7.405 8.079 -9.127 1.00 0.00 H new ATOM 0 HG11 VAL A 53 6.983 6.314 -10.802 1.00 0.00 H new ATOM 0 HG12 VAL A 53 6.963 5.676 -9.141 1.00 0.00 H new ATOM 0 HG13 VAL A 53 5.433 5.943 -10.010 1.00 0.00 H new ATOM 0 HG21 VAL A 53 6.300 8.645 -11.262 1.00 0.00 H new ATOM 0 HG22 VAL A 53 4.712 8.404 -10.496 1.00 0.00 H new ATOM 0 HG23 VAL A 53 5.779 9.714 -9.937 1.00 0.00 H new ATOM 796 N LYS A 54 6.831 7.722 -5.883 1.00 0.00 N ATOM 797 CA LYS A 54 7.522 7.100 -4.766 1.00 0.00 C ATOM 798 C LYS A 54 6.595 6.078 -4.104 1.00 0.00 C ATOM 799 O LYS A 54 7.006 4.954 -3.822 1.00 0.00 O ATOM 800 CB LYS A 54 8.050 8.165 -3.802 1.00 0.00 C ATOM 801 CG LYS A 54 9.477 8.578 -4.170 1.00 0.00 C ATOM 802 CD LYS A 54 9.543 10.064 -4.526 1.00 0.00 C ATOM 803 CE LYS A 54 10.757 10.730 -3.874 1.00 0.00 C ATOM 804 NZ LYS A 54 11.198 11.897 -4.671 1.00 0.00 N ATOM 0 H LYS A 54 6.772 8.739 -5.835 1.00 0.00 H new ATOM 0 HA LYS A 54 8.399 6.556 -5.116 1.00 0.00 H new ATOM 0 HB2 LYS A 54 7.397 9.038 -3.826 1.00 0.00 H new ATOM 0 HB3 LYS A 54 8.030 7.780 -2.783 1.00 0.00 H new ATOM 0 HG2 LYS A 54 10.146 8.370 -3.335 1.00 0.00 H new ATOM 0 HG3 LYS A 54 9.826 7.982 -5.014 1.00 0.00 H new ATOM 0 HD2 LYS A 54 9.597 10.180 -5.608 1.00 0.00 H new ATOM 0 HD3 LYS A 54 8.630 10.561 -4.197 1.00 0.00 H new ATOM 0 HE2 LYS A 54 10.505 11.047 -2.862 1.00 0.00 H new ATOM 0 HE3 LYS A 54 11.572 10.011 -3.789 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 12.022 12.337 -4.215 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 11.458 11.585 -5.629 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 10.424 12.589 -4.730 1.00 0.00 H new ATOM 818 N VAL A 55 5.362 6.505 -3.876 1.00 0.00 N ATOM 819 CA VAL A 55 4.374 5.641 -3.253 1.00 0.00 C ATOM 820 C VAL A 55 4.081 4.458 -4.179 1.00 0.00 C ATOM 821 O VAL A 55 3.947 3.325 -3.720 1.00 0.00 O ATOM 822 CB VAL A 55 3.123 6.447 -2.899 1.00 0.00 C ATOM 823 CG1 VAL A 55 2.470 7.026 -4.155 1.00 0.00 C ATOM 824 CG2 VAL A 55 2.128 5.596 -2.106 1.00 0.00 C ATOM 0 H VAL A 55 5.024 7.438 -4.112 1.00 0.00 H new ATOM 0 HA VAL A 55 4.758 5.234 -2.317 1.00 0.00 H new ATOM 0 HB VAL A 55 3.430 7.280 -2.267 1.00 0.00 H new ATOM 0 HG11 VAL A 55 1.583 7.594 -3.875 1.00 0.00 H new ATOM 0 HG12 VAL A 55 3.176 7.683 -4.663 1.00 0.00 H new ATOM 0 HG13 VAL A 55 2.184 6.214 -4.824 1.00 0.00 H new ATOM 0 HG21 VAL A 55 1.248 6.193 -1.867 1.00 0.00 H new ATOM 0 HG22 VAL A 55 1.830 4.734 -2.702 1.00 0.00 H new ATOM 0 HG23 VAL A 55 2.596 5.255 -1.183 1.00 0.00 H new ATOM 834 N SER A 56 3.991 4.763 -5.465 1.00 0.00 N ATOM 835 CA SER A 56 3.716 3.740 -6.459 1.00 0.00 C ATOM 836 C SER A 56 4.698 2.577 -6.298 1.00 0.00 C ATOM 837 O SER A 56 4.301 1.470 -5.938 1.00 0.00 O ATOM 838 CB SER A 56 3.798 4.312 -7.876 1.00 0.00 C ATOM 839 OG SER A 56 2.858 3.699 -8.754 1.00 0.00 O ATOM 0 H SER A 56 4.104 5.704 -5.842 1.00 0.00 H new ATOM 0 HA SER A 56 2.701 3.375 -6.302 1.00 0.00 H new ATOM 0 HB2 SER A 56 3.617 5.386 -7.844 1.00 0.00 H new ATOM 0 HB3 SER A 56 4.806 4.170 -8.267 1.00 0.00 H new ATOM 0 HG SER A 56 3.112 3.880 -9.683 1.00 0.00 H new ATOM 845 N LEU A 57 5.961 2.869 -6.574 1.00 0.00 N ATOM 846 CA LEU A 57 7.002 1.862 -6.464 1.00 0.00 C ATOM 847 C LEU A 57 7.065 1.354 -5.022 1.00 0.00 C ATOM 848 O LEU A 57 6.757 0.193 -4.755 1.00 0.00 O ATOM 849 CB LEU A 57 8.334 2.409 -6.981 1.00 0.00 C ATOM 850 CG LEU A 57 9.277 1.387 -7.618 1.00 0.00 C ATOM 851 CD1 LEU A 57 9.548 1.730 -9.085 1.00 0.00 C ATOM 852 CD2 LEU A 57 10.571 1.257 -6.812 1.00 0.00 C ATOM 0 H LEU A 57 6.286 3.788 -6.873 1.00 0.00 H new ATOM 0 HA LEU A 57 6.769 1.004 -7.095 1.00 0.00 H new ATOM 0 HB2 LEU A 57 8.124 3.187 -7.715 1.00 0.00 H new ATOM 0 HB3 LEU A 57 8.855 2.886 -6.151 1.00 0.00 H new ATOM 0 HG LEU A 57 8.787 0.413 -7.600 1.00 0.00 H new ATOM 0 HD11 LEU A 57 10.221 0.988 -9.514 1.00 0.00 H new ATOM 0 HD12 LEU A 57 8.609 1.731 -9.638 1.00 0.00 H new ATOM 0 HD13 LEU A 57 10.007 2.716 -9.149 1.00 0.00 H new ATOM 0 HD21 LEU A 57 11.223 0.524 -7.287 1.00 0.00 H new ATOM 0 HD22 LEU A 57 11.076 2.222 -6.776 1.00 0.00 H new ATOM 0 HD23 LEU A 57 10.337 0.932 -5.798 1.00 0.00 H new ATOM 864 N PHE A 58 7.465 2.248 -4.130 1.00 0.00 N ATOM 865 CA PHE A 58 7.572 1.905 -2.722 1.00 0.00 C ATOM 866 C PHE A 58 6.460 0.938 -2.308 1.00 0.00 C ATOM 867 O PHE A 58 6.682 0.044 -1.493 1.00 0.00 O ATOM 868 CB PHE A 58 7.421 3.206 -1.932 1.00 0.00 C ATOM 869 CG PHE A 58 7.558 3.034 -0.418 1.00 0.00 C ATOM 870 CD1 PHE A 58 6.550 2.468 0.297 1.00 0.00 C ATOM 871 CD2 PHE A 58 8.690 3.448 0.213 1.00 0.00 C ATOM 872 CE1 PHE A 58 6.677 2.308 1.702 1.00 0.00 C ATOM 873 CE2 PHE A 58 8.818 3.288 1.618 1.00 0.00 C ATOM 874 CZ PHE A 58 7.809 2.722 2.333 1.00 0.00 C ATOM 0 H PHE A 58 7.719 3.210 -4.355 1.00 0.00 H new ATOM 0 HA PHE A 58 8.529 1.421 -2.528 1.00 0.00 H new ATOM 0 HB2 PHE A 58 8.172 3.917 -2.276 1.00 0.00 H new ATOM 0 HB3 PHE A 58 6.446 3.641 -2.151 1.00 0.00 H new ATOM 0 HD1 PHE A 58 5.651 2.140 -0.204 1.00 0.00 H new ATOM 0 HD2 PHE A 58 9.491 3.898 -0.355 1.00 0.00 H new ATOM 0 HE1 PHE A 58 5.876 1.858 2.269 1.00 0.00 H new ATOM 0 HE2 PHE A 58 9.717 3.616 2.119 1.00 0.00 H new ATOM 0 HZ PHE A 58 7.906 2.601 3.402 1.00 0.00 H new ATOM 884 N THR A 59 5.288 1.152 -2.887 1.00 0.00 N ATOM 885 CA THR A 59 4.141 0.311 -2.588 1.00 0.00 C ATOM 886 C THR A 59 4.343 -1.091 -3.166 1.00 0.00 C ATOM 887 O THR A 59 4.389 -2.072 -2.425 1.00 0.00 O ATOM 888 CB THR A 59 2.889 1.012 -3.118 1.00 0.00 C ATOM 889 OG1 THR A 59 2.644 2.048 -2.170 1.00 0.00 O ATOM 890 CG2 THR A 59 1.643 0.128 -3.035 1.00 0.00 C ATOM 0 H THR A 59 5.108 1.895 -3.562 1.00 0.00 H new ATOM 0 HA THR A 59 4.022 0.172 -1.513 1.00 0.00 H new ATOM 0 HB THR A 59 3.052 1.312 -4.153 1.00 0.00 H new ATOM 0 HG1 THR A 59 2.978 2.899 -2.522 1.00 0.00 H new ATOM 0 HG21 THR A 59 0.783 0.674 -3.424 1.00 0.00 H new ATOM 0 HG22 THR A 59 1.797 -0.775 -3.626 1.00 0.00 H new ATOM 0 HG23 THR A 59 1.460 -0.146 -1.996 1.00 0.00 H new ATOM 898 N ALA A 60 4.457 -1.142 -4.485 1.00 0.00 N ATOM 899 CA ALA A 60 4.653 -2.407 -5.172 1.00 0.00 C ATOM 900 C ALA A 60 5.702 -3.232 -4.423 1.00 0.00 C ATOM 901 O ALA A 60 5.528 -4.434 -4.227 1.00 0.00 O ATOM 902 CB ALA A 60 5.048 -2.144 -6.626 1.00 0.00 C ATOM 0 H ALA A 60 4.417 -0.327 -5.097 1.00 0.00 H new ATOM 0 HA ALA A 60 3.728 -2.983 -5.185 1.00 0.00 H new ATOM 0 HB1 ALA A 60 5.195 -3.094 -7.141 1.00 0.00 H new ATOM 0 HB2 ALA A 60 4.257 -1.581 -7.122 1.00 0.00 H new ATOM 0 HB3 ALA A 60 5.974 -1.570 -6.653 1.00 0.00 H new ATOM 908 N PHE A 61 6.768 -2.553 -4.025 1.00 0.00 N ATOM 909 CA PHE A 61 7.846 -3.208 -3.303 1.00 0.00 C ATOM 910 C PHE A 61 7.351 -3.761 -1.964 1.00 0.00 C ATOM 911 O PHE A 61 7.611 -4.916 -1.632 1.00 0.00 O ATOM 912 CB PHE A 61 8.916 -2.147 -3.039 1.00 0.00 C ATOM 913 CG PHE A 61 10.154 -2.277 -3.929 1.00 0.00 C ATOM 914 CD1 PHE A 61 10.170 -1.698 -5.160 1.00 0.00 C ATOM 915 CD2 PHE A 61 11.238 -2.971 -3.490 1.00 0.00 C ATOM 916 CE1 PHE A 61 11.318 -1.819 -5.986 1.00 0.00 C ATOM 917 CE2 PHE A 61 12.386 -3.092 -4.316 1.00 0.00 C ATOM 918 CZ PHE A 61 12.402 -2.513 -5.547 1.00 0.00 C ATOM 0 H PHE A 61 6.908 -1.556 -4.189 1.00 0.00 H new ATOM 0 HA PHE A 61 8.235 -4.041 -3.889 1.00 0.00 H new ATOM 0 HB2 PHE A 61 8.478 -1.160 -3.185 1.00 0.00 H new ATOM 0 HB3 PHE A 61 9.224 -2.208 -1.995 1.00 0.00 H new ATOM 0 HD1 PHE A 61 9.309 -1.146 -5.509 1.00 0.00 H new ATOM 0 HD2 PHE A 61 11.225 -3.430 -2.513 1.00 0.00 H new ATOM 0 HE1 PHE A 61 11.331 -1.360 -6.963 1.00 0.00 H new ATOM 0 HE2 PHE A 61 13.247 -3.644 -3.967 1.00 0.00 H new ATOM 0 HZ PHE A 61 13.275 -2.604 -6.176 1.00 0.00 H new ATOM 928 N PHE A 62 6.648 -2.909 -1.232 1.00 0.00 N ATOM 929 CA PHE A 62 6.115 -3.298 0.062 1.00 0.00 C ATOM 930 C PHE A 62 5.046 -4.382 -0.088 1.00 0.00 C ATOM 931 O PHE A 62 5.250 -5.522 0.327 1.00 0.00 O ATOM 932 CB PHE A 62 5.477 -2.051 0.676 1.00 0.00 C ATOM 933 CG PHE A 62 5.789 -1.859 2.162 1.00 0.00 C ATOM 934 CD1 PHE A 62 6.951 -1.261 2.541 1.00 0.00 C ATOM 935 CD2 PHE A 62 4.906 -2.286 3.103 1.00 0.00 C ATOM 936 CE1 PHE A 62 7.241 -1.083 3.919 1.00 0.00 C ATOM 937 CE2 PHE A 62 5.196 -2.107 4.482 1.00 0.00 C ATOM 938 CZ PHE A 62 6.358 -1.510 4.861 1.00 0.00 C ATOM 0 H PHE A 62 6.435 -1.951 -1.511 1.00 0.00 H new ATOM 0 HA PHE A 62 6.913 -3.697 0.688 1.00 0.00 H new ATOM 0 HB2 PHE A 62 5.818 -1.173 0.127 1.00 0.00 H new ATOM 0 HB3 PHE A 62 4.396 -2.107 0.547 1.00 0.00 H new ATOM 0 HD1 PHE A 62 7.653 -0.922 1.793 1.00 0.00 H new ATOM 0 HD2 PHE A 62 3.984 -2.761 2.802 1.00 0.00 H new ATOM 0 HE1 PHE A 62 8.163 -0.608 4.220 1.00 0.00 H new ATOM 0 HE2 PHE A 62 4.494 -2.445 5.230 1.00 0.00 H new ATOM 0 HZ PHE A 62 6.579 -1.375 5.909 1.00 0.00 H new ATOM 948 N LEU A 63 3.930 -3.989 -0.683 1.00 0.00 N ATOM 949 CA LEU A 63 2.828 -4.913 -0.894 1.00 0.00 C ATOM 950 C LEU A 63 3.378 -6.251 -1.391 1.00 0.00 C ATOM 951 O LEU A 63 2.892 -7.310 -1.000 1.00 0.00 O ATOM 952 CB LEU A 63 1.781 -4.295 -1.822 1.00 0.00 C ATOM 953 CG LEU A 63 0.384 -4.106 -1.226 1.00 0.00 C ATOM 954 CD1 LEU A 63 -0.316 -2.894 -1.842 1.00 0.00 C ATOM 955 CD2 LEU A 63 -0.449 -5.382 -1.367 1.00 0.00 C ATOM 0 H LEU A 63 3.765 -3.043 -1.026 1.00 0.00 H new ATOM 0 HA LEU A 63 2.311 -5.110 0.045 1.00 0.00 H new ATOM 0 HB2 LEU A 63 2.147 -3.324 -2.154 1.00 0.00 H new ATOM 0 HB3 LEU A 63 1.694 -4.923 -2.709 1.00 0.00 H new ATOM 0 HG LEU A 63 0.492 -3.907 -0.160 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -1.306 -2.783 -1.401 1.00 0.00 H new ATOM 0 HD12 LEU A 63 0.271 -1.997 -1.647 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -0.412 -3.038 -2.918 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -1.437 -5.221 -0.936 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -0.551 -5.635 -2.422 1.00 0.00 H new ATOM 0 HD23 LEU A 63 0.047 -6.200 -0.844 1.00 0.00 H new ATOM 967 N ALA A 64 4.386 -6.158 -2.247 1.00 0.00 N ATOM 968 CA ALA A 64 5.007 -7.348 -2.803 1.00 0.00 C ATOM 969 C ALA A 64 5.576 -8.199 -1.666 1.00 0.00 C ATOM 970 O ALA A 64 5.166 -9.343 -1.476 1.00 0.00 O ATOM 971 CB ALA A 64 6.077 -6.940 -3.817 1.00 0.00 C ATOM 0 H ALA A 64 4.788 -5.277 -2.569 1.00 0.00 H new ATOM 0 HA ALA A 64 4.271 -7.953 -3.332 1.00 0.00 H new ATOM 0 HB1 ALA A 64 6.543 -7.833 -4.234 1.00 0.00 H new ATOM 0 HB2 ALA A 64 5.617 -6.363 -4.619 1.00 0.00 H new ATOM 0 HB3 ALA A 64 6.835 -6.333 -3.322 1.00 0.00 H new ATOM 977 N THR A 65 6.513 -7.608 -0.939 1.00 0.00 N ATOM 978 CA THR A 65 7.143 -8.298 0.175 1.00 0.00 C ATOM 979 C THR A 65 6.084 -8.802 1.157 1.00 0.00 C ATOM 980 O THR A 65 5.932 -10.008 1.346 1.00 0.00 O ATOM 981 CB THR A 65 8.155 -7.343 0.810 1.00 0.00 C ATOM 982 OG1 THR A 65 9.180 -7.219 -0.172 1.00 0.00 O ATOM 983 CG2 THR A 65 8.867 -7.961 2.015 1.00 0.00 C ATOM 0 H THR A 65 6.851 -6.659 -1.099 1.00 0.00 H new ATOM 0 HA THR A 65 7.678 -9.186 -0.161 1.00 0.00 H new ATOM 0 HB THR A 65 7.647 -6.429 1.118 1.00 0.00 H new ATOM 0 HG1 THR A 65 8.930 -6.528 -0.821 1.00 0.00 H new ATOM 0 HG21 THR A 65 9.574 -7.242 2.428 1.00 0.00 H new ATOM 0 HG22 THR A 65 8.132 -8.225 2.776 1.00 0.00 H new ATOM 0 HG23 THR A 65 9.403 -8.857 1.701 1.00 0.00 H new ATOM 991 N ILE A 66 5.379 -7.854 1.757 1.00 0.00 N ATOM 992 CA ILE A 66 4.339 -8.187 2.715 1.00 0.00 C ATOM 993 C ILE A 66 3.511 -9.356 2.176 1.00 0.00 C ATOM 994 O ILE A 66 3.344 -10.368 2.855 1.00 0.00 O ATOM 995 CB ILE A 66 3.507 -6.949 3.055 1.00 0.00 C ATOM 996 CG1 ILE A 66 4.350 -5.908 3.793 1.00 0.00 C ATOM 997 CG2 ILE A 66 2.250 -7.331 3.840 1.00 0.00 C ATOM 998 CD1 ILE A 66 4.563 -6.311 5.254 1.00 0.00 C ATOM 0 H ILE A 66 5.508 -6.855 1.598 1.00 0.00 H new ATOM 0 HA ILE A 66 4.779 -8.515 3.657 1.00 0.00 H new ATOM 0 HB ILE A 66 3.177 -6.493 2.122 1.00 0.00 H new ATOM 0 HG12 ILE A 66 5.315 -5.799 3.298 1.00 0.00 H new ATOM 0 HG13 ILE A 66 3.857 -4.937 3.748 1.00 0.00 H new ATOM 0 HG21 ILE A 66 1.677 -6.433 4.069 1.00 0.00 H new ATOM 0 HG22 ILE A 66 1.640 -8.008 3.243 1.00 0.00 H new ATOM 0 HG23 ILE A 66 2.537 -7.825 4.769 1.00 0.00 H new ATOM 0 HD11 ILE A 66 5.165 -5.554 5.756 1.00 0.00 H new ATOM 0 HD12 ILE A 66 3.597 -6.396 5.753 1.00 0.00 H new ATOM 0 HD13 ILE A 66 5.078 -7.271 5.295 1.00 0.00 H new ATOM 1010 N MET A 67 3.014 -9.177 0.961 1.00 0.00 N ATOM 1011 CA MET A 67 2.208 -10.204 0.324 1.00 0.00 C ATOM 1012 C MET A 67 2.852 -11.583 0.482 1.00 0.00 C ATOM 1013 O MET A 67 2.323 -12.442 1.186 1.00 0.00 O ATOM 1014 CB MET A 67 2.051 -9.881 -1.163 1.00 0.00 C ATOM 1015 CG MET A 67 0.886 -8.916 -1.395 1.00 0.00 C ATOM 1016 SD MET A 67 1.069 -8.106 -2.975 1.00 0.00 S ATOM 1017 CE MET A 67 0.727 -9.476 -4.067 1.00 0.00 C ATOM 0 H MET A 67 3.154 -8.336 0.401 1.00 0.00 H new ATOM 0 HA MET A 67 1.230 -10.223 0.806 1.00 0.00 H new ATOM 0 HB2 MET A 67 2.973 -9.441 -1.543 1.00 0.00 H new ATOM 0 HB3 MET A 67 1.883 -10.801 -1.723 1.00 0.00 H new ATOM 0 HG2 MET A 67 -0.059 -9.459 -1.363 1.00 0.00 H new ATOM 0 HG3 MET A 67 0.854 -8.173 -0.598 1.00 0.00 H new ATOM 0 HE1 MET A 67 0.694 -9.121 -5.097 1.00 0.00 H new ATOM 0 HE2 MET A 67 1.512 -10.226 -3.967 1.00 0.00 H new ATOM 0 HE3 MET A 67 -0.234 -9.919 -3.805 1.00 0.00 H new ATOM 1027 N GLY A 68 3.983 -11.752 -0.186 1.00 0.00 N ATOM 1028 CA GLY A 68 4.705 -13.012 -0.129 1.00 0.00 C ATOM 1029 C GLY A 68 3.745 -14.199 -0.234 1.00 0.00 C ATOM 1030 O GLY A 68 3.752 -15.086 0.618 1.00 0.00 O ATOM 0 H GLY A 68 4.418 -11.037 -0.770 1.00 0.00 H new ATOM 0 HA2 GLY A 68 5.433 -13.055 -0.939 1.00 0.00 H new ATOM 0 HA3 GLY A 68 5.264 -13.073 0.805 1.00 0.00 H new ATOM 1034 N VAL A 69 2.940 -14.177 -1.287 1.00 0.00 N ATOM 1035 CA VAL A 69 1.976 -15.240 -1.515 1.00 0.00 C ATOM 1036 C VAL A 69 2.617 -16.586 -1.169 1.00 0.00 C ATOM 1037 O VAL A 69 2.101 -17.326 -0.333 1.00 0.00 O ATOM 1038 CB VAL A 69 1.457 -15.177 -2.953 1.00 0.00 C ATOM 1039 CG1 VAL A 69 0.405 -16.259 -3.204 1.00 0.00 C ATOM 1040 CG2 VAL A 69 0.903 -13.788 -3.275 1.00 0.00 C ATOM 0 H VAL A 69 2.936 -13.439 -1.992 1.00 0.00 H new ATOM 0 HA VAL A 69 1.109 -15.116 -0.866 1.00 0.00 H new ATOM 0 HB VAL A 69 2.297 -15.366 -3.621 1.00 0.00 H new ATOM 0 HG11 VAL A 69 0.053 -16.192 -4.233 1.00 0.00 H new ATOM 0 HG12 VAL A 69 0.846 -17.241 -3.034 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -0.434 -16.116 -2.523 1.00 0.00 H new ATOM 0 HG21 VAL A 69 0.541 -13.770 -4.303 1.00 0.00 H new ATOM 0 HG22 VAL A 69 0.082 -13.558 -2.597 1.00 0.00 H new ATOM 0 HG23 VAL A 69 1.692 -13.045 -3.155 1.00 0.00 H new ATOM 1050 N ARG A 70 3.731 -16.862 -1.830 1.00 0.00 N ATOM 1051 CA ARG A 70 4.447 -18.106 -1.603 1.00 0.00 C ATOM 1052 C ARG A 70 5.942 -17.914 -1.869 1.00 0.00 C ATOM 1053 O ARG A 70 6.765 -18.110 -0.975 1.00 0.00 O ATOM 1054 CB ARG A 70 3.915 -19.221 -2.506 1.00 0.00 C ATOM 1055 CG ARG A 70 3.816 -20.544 -1.744 1.00 0.00 C ATOM 1056 CD ARG A 70 2.645 -20.522 -0.759 1.00 0.00 C ATOM 1057 NE ARG A 70 2.755 -21.659 0.182 1.00 0.00 N ATOM 1058 CZ ARG A 70 1.868 -21.919 1.152 1.00 0.00 C ATOM 1059 NH1 ARG A 70 0.802 -21.124 1.316 1.00 0.00 N ATOM 1060 NH2 ARG A 70 2.048 -22.973 1.960 1.00 0.00 N ATOM 0 H ARG A 70 4.156 -16.246 -2.523 1.00 0.00 H new ATOM 0 HA ARG A 70 4.293 -18.392 -0.563 1.00 0.00 H new ATOM 0 HB2 ARG A 70 2.933 -18.945 -2.891 1.00 0.00 H new ATOM 0 HB3 ARG A 70 4.573 -19.341 -3.367 1.00 0.00 H new ATOM 0 HG2 ARG A 70 3.688 -21.365 -2.449 1.00 0.00 H new ATOM 0 HG3 ARG A 70 4.746 -20.728 -1.206 1.00 0.00 H new ATOM 0 HD2 ARG A 70 2.640 -19.582 -0.208 1.00 0.00 H new ATOM 0 HD3 ARG A 70 1.701 -20.578 -1.302 1.00 0.00 H new ATOM 0 HE ARG A 70 3.556 -22.283 0.086 1.00 0.00 H new ATOM 0 HH11 ARG A 70 0.666 -20.321 0.702 1.00 0.00 H new ATOM 0 HH12 ARG A 70 0.127 -21.322 2.054 1.00 0.00 H new ATOM 0 HH21 ARG A 70 2.860 -23.577 1.837 1.00 0.00 H new ATOM 0 HH22 ARG A 70 1.373 -23.171 2.698 1.00 0.00 H new ATOM 1074 N PHE A 71 6.248 -17.533 -3.100 1.00 0.00 N ATOM 1075 CA PHE A 71 7.629 -17.313 -3.494 1.00 0.00 C ATOM 1076 C PHE A 71 8.297 -16.274 -2.591 1.00 0.00 C ATOM 1077 O PHE A 71 9.306 -16.562 -1.950 1.00 0.00 O ATOM 1078 CB PHE A 71 7.605 -16.784 -4.930 1.00 0.00 C ATOM 1079 CG PHE A 71 8.584 -17.491 -5.869 1.00 0.00 C ATOM 1080 CD1 PHE A 71 9.899 -17.585 -5.536 1.00 0.00 C ATOM 1081 CD2 PHE A 71 8.139 -18.025 -7.038 1.00 0.00 C ATOM 1082 CE1 PHE A 71 10.808 -18.241 -6.408 1.00 0.00 C ATOM 1083 CE2 PHE A 71 9.048 -18.681 -7.910 1.00 0.00 C ATOM 1084 CZ PHE A 71 10.363 -18.775 -7.577 1.00 0.00 C ATOM 0 H PHE A 71 5.563 -17.371 -3.838 1.00 0.00 H new ATOM 0 HA PHE A 71 8.193 -18.242 -3.412 1.00 0.00 H new ATOM 0 HB2 PHE A 71 6.596 -16.888 -5.328 1.00 0.00 H new ATOM 0 HB3 PHE A 71 7.834 -15.718 -4.918 1.00 0.00 H new ATOM 0 HD1 PHE A 71 10.252 -17.161 -4.608 1.00 0.00 H new ATOM 0 HD2 PHE A 71 7.095 -17.950 -7.303 1.00 0.00 H new ATOM 0 HE1 PHE A 71 11.852 -18.316 -6.143 1.00 0.00 H new ATOM 0 HE2 PHE A 71 8.695 -19.105 -8.838 1.00 0.00 H new ATOM 0 HZ PHE A 71 11.054 -19.274 -8.241 1.00 0.00 H new ATOM 1094 N LYS A 72 7.708 -15.088 -2.571 1.00 0.00 N ATOM 1095 CA LYS A 72 8.233 -14.005 -1.757 1.00 0.00 C ATOM 1096 C LYS A 72 9.412 -13.353 -2.484 1.00 0.00 C ATOM 1097 O LYS A 72 9.356 -12.174 -2.831 1.00 0.00 O ATOM 1098 CB LYS A 72 8.578 -14.507 -0.354 1.00 0.00 C ATOM 1099 CG LYS A 72 8.222 -13.463 0.706 1.00 0.00 C ATOM 1100 CD LYS A 72 9.380 -13.258 1.685 1.00 0.00 C ATOM 1101 CE LYS A 72 9.404 -11.823 2.214 1.00 0.00 C ATOM 1102 NZ LYS A 72 9.895 -11.792 3.609 1.00 0.00 N ATOM 0 H LYS A 72 6.872 -14.853 -3.106 1.00 0.00 H new ATOM 0 HA LYS A 72 7.477 -13.233 -1.617 1.00 0.00 H new ATOM 0 HB2 LYS A 72 8.039 -15.433 -0.153 1.00 0.00 H new ATOM 0 HB3 LYS A 72 9.642 -14.739 -0.298 1.00 0.00 H new ATOM 0 HG2 LYS A 72 7.978 -12.517 0.222 1.00 0.00 H new ATOM 0 HG3 LYS A 72 7.333 -13.781 1.250 1.00 0.00 H new ATOM 0 HD2 LYS A 72 9.284 -13.955 2.518 1.00 0.00 H new ATOM 0 HD3 LYS A 72 10.324 -13.482 1.189 1.00 0.00 H new ATOM 0 HE2 LYS A 72 10.045 -11.207 1.583 1.00 0.00 H new ATOM 0 HE3 LYS A 72 8.403 -11.395 2.165 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 9.905 -10.810 3.952 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 9.267 -12.363 4.211 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 10.859 -12.181 3.647 1.00 0.00 H new ATOM 1116 N ARG A 73 10.450 -14.148 -2.692 1.00 0.00 N ATOM 1117 CA ARG A 73 11.640 -13.663 -3.371 1.00 0.00 C ATOM 1118 C ARG A 73 11.480 -13.800 -4.886 1.00 0.00 C ATOM 1119 O ARG A 73 12.377 -14.297 -5.566 1.00 0.00 O ATOM 1120 CB ARG A 73 12.883 -14.435 -2.924 1.00 0.00 C ATOM 1121 CG ARG A 73 14.046 -13.484 -2.638 1.00 0.00 C ATOM 1122 CD ARG A 73 14.696 -13.802 -1.290 1.00 0.00 C ATOM 1123 NE ARG A 73 16.055 -14.350 -1.500 1.00 0.00 N ATOM 1124 CZ ARG A 73 17.049 -13.683 -2.102 1.00 0.00 C ATOM 1125 NH1 ARG A 73 16.843 -12.439 -2.557 1.00 0.00 N ATOM 1126 NH2 ARG A 73 18.250 -14.259 -2.249 1.00 0.00 N ATOM 0 H ARG A 73 10.492 -15.125 -2.403 1.00 0.00 H new ATOM 0 HA ARG A 73 11.766 -12.612 -3.109 1.00 0.00 H new ATOM 0 HB2 ARG A 73 12.654 -15.014 -2.029 1.00 0.00 H new ATOM 0 HB3 ARG A 73 13.172 -15.146 -3.698 1.00 0.00 H new ATOM 0 HG2 ARG A 73 14.789 -13.563 -3.432 1.00 0.00 H new ATOM 0 HG3 ARG A 73 13.687 -12.455 -2.639 1.00 0.00 H new ATOM 0 HD2 ARG A 73 14.749 -12.900 -0.681 1.00 0.00 H new ATOM 0 HD3 ARG A 73 14.086 -14.521 -0.743 1.00 0.00 H new ATOM 0 HE ARG A 73 16.247 -15.294 -1.166 1.00 0.00 H new ATOM 0 HH11 ARG A 73 15.929 -12.000 -2.445 1.00 0.00 H new ATOM 0 HH12 ARG A 73 17.600 -11.932 -3.015 1.00 0.00 H new ATOM 0 HH21 ARG A 73 18.408 -15.205 -1.903 1.00 0.00 H new ATOM 0 HH22 ARG A 73 19.007 -13.751 -2.707 1.00 0.00 H new ATOM 1140 N SER A 74 10.331 -13.352 -5.371 1.00 0.00 N ATOM 1141 CA SER A 74 10.042 -13.419 -6.793 1.00 0.00 C ATOM 1142 C SER A 74 8.847 -12.524 -7.127 1.00 0.00 C ATOM 1143 O SER A 74 7.740 -13.016 -7.344 1.00 0.00 O ATOM 1144 CB SER A 74 9.766 -14.859 -7.232 1.00 0.00 C ATOM 1145 OG SER A 74 9.489 -14.948 -8.627 1.00 0.00 O ATOM 0 H SER A 74 9.589 -12.941 -4.804 1.00 0.00 H new ATOM 0 HA SER A 74 10.917 -13.063 -7.337 1.00 0.00 H new ATOM 0 HB2 SER A 74 10.628 -15.482 -6.993 1.00 0.00 H new ATOM 0 HB3 SER A 74 8.921 -15.254 -6.669 1.00 0.00 H new ATOM 0 HG SER A 74 9.320 -15.883 -8.868 1.00 0.00 H new ATOM 1151 N LYS A 75 9.111 -11.226 -7.158 1.00 0.00 N ATOM 1152 CA LYS A 75 8.071 -10.258 -7.462 1.00 0.00 C ATOM 1153 C LYS A 75 8.027 -10.019 -8.972 1.00 0.00 C ATOM 1154 O LYS A 75 8.156 -8.884 -9.429 1.00 0.00 O ATOM 1155 CB LYS A 75 8.271 -8.981 -6.643 1.00 0.00 C ATOM 1156 CG LYS A 75 9.509 -8.215 -7.116 1.00 0.00 C ATOM 1157 CD LYS A 75 10.047 -7.306 -6.009 1.00 0.00 C ATOM 1158 CE LYS A 75 11.574 -7.236 -6.052 1.00 0.00 C ATOM 1159 NZ LYS A 75 12.159 -7.988 -4.919 1.00 0.00 N ATOM 0 H LYS A 75 10.030 -10.822 -6.978 1.00 0.00 H new ATOM 0 HA LYS A 75 7.094 -10.646 -7.172 1.00 0.00 H new ATOM 0 HB2 LYS A 75 7.390 -8.346 -6.732 1.00 0.00 H new ATOM 0 HB3 LYS A 75 8.376 -9.234 -5.588 1.00 0.00 H new ATOM 0 HG2 LYS A 75 10.283 -8.920 -7.421 1.00 0.00 H new ATOM 0 HG3 LYS A 75 9.259 -7.618 -7.993 1.00 0.00 H new ATOM 0 HD2 LYS A 75 9.630 -6.305 -6.121 1.00 0.00 H new ATOM 0 HD3 LYS A 75 9.724 -7.679 -5.037 1.00 0.00 H new ATOM 0 HE2 LYS A 75 11.936 -7.646 -6.994 1.00 0.00 H new ATOM 0 HE3 LYS A 75 11.898 -6.196 -6.012 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 13.196 -7.930 -4.963 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 11.827 -7.579 -4.022 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 11.865 -8.984 -4.975 1.00 0.00 H new ATOM 1173 N LYS A 76 7.846 -11.107 -9.706 1.00 0.00 N ATOM 1174 CA LYS A 76 7.784 -11.031 -11.156 1.00 0.00 C ATOM 1175 C LYS A 76 6.391 -11.454 -11.626 1.00 0.00 C ATOM 1176 O LYS A 76 5.642 -10.643 -12.170 1.00 0.00 O ATOM 1177 CB LYS A 76 8.918 -11.843 -11.784 1.00 0.00 C ATOM 1178 CG LYS A 76 9.556 -11.084 -12.950 1.00 0.00 C ATOM 1179 CD LYS A 76 10.621 -11.936 -13.642 1.00 0.00 C ATOM 1180 CE LYS A 76 11.235 -11.190 -14.828 1.00 0.00 C ATOM 1181 NZ LYS A 76 11.780 -12.147 -15.817 1.00 0.00 N ATOM 0 H LYS A 76 7.740 -12.047 -9.324 1.00 0.00 H new ATOM 0 HA LYS A 76 7.935 -10.005 -11.490 1.00 0.00 H new ATOM 0 HB2 LYS A 76 9.674 -12.061 -11.030 1.00 0.00 H new ATOM 0 HB3 LYS A 76 8.533 -12.800 -12.136 1.00 0.00 H new ATOM 0 HG2 LYS A 76 8.787 -10.802 -13.669 1.00 0.00 H new ATOM 0 HG3 LYS A 76 10.005 -10.160 -12.585 1.00 0.00 H new ATOM 0 HD2 LYS A 76 11.402 -12.198 -12.929 1.00 0.00 H new ATOM 0 HD3 LYS A 76 10.177 -12.870 -13.986 1.00 0.00 H new ATOM 0 HE2 LYS A 76 10.480 -10.561 -15.300 1.00 0.00 H new ATOM 0 HE3 LYS A 76 12.028 -10.529 -14.478 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 12.193 -11.624 -16.615 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 12.515 -12.730 -15.368 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 11.016 -12.761 -16.164 1.00 0.00 H new ATOM 1195 N ILE A 77 6.085 -12.723 -11.399 1.00 0.00 N ATOM 1196 CA ILE A 77 4.795 -13.264 -11.793 1.00 0.00 C ATOM 1197 C ILE A 77 3.823 -13.158 -10.617 1.00 0.00 C ATOM 1198 O ILE A 77 2.650 -12.835 -10.803 1.00 0.00 O ATOM 1199 CB ILE A 77 4.953 -14.686 -12.335 1.00 0.00 C ATOM 1200 CG1 ILE A 77 5.873 -14.708 -13.557 1.00 0.00 C ATOM 1201 CG2 ILE A 77 3.590 -15.314 -12.631 1.00 0.00 C ATOM 1202 CD1 ILE A 77 6.681 -16.006 -13.612 1.00 0.00 C ATOM 0 H ILE A 77 6.708 -13.392 -10.947 1.00 0.00 H new ATOM 0 HA ILE A 77 4.371 -12.682 -12.611 1.00 0.00 H new ATOM 0 HB ILE A 77 5.427 -15.295 -11.565 1.00 0.00 H new ATOM 0 HG12 ILE A 77 5.279 -14.606 -14.465 1.00 0.00 H new ATOM 0 HG13 ILE A 77 6.551 -13.855 -13.522 1.00 0.00 H new ATOM 0 HG21 ILE A 77 3.731 -16.324 -13.015 1.00 0.00 H new ATOM 0 HG22 ILE A 77 3.001 -15.353 -11.715 1.00 0.00 H new ATOM 0 HG23 ILE A 77 3.066 -14.713 -13.374 1.00 0.00 H new ATOM 0 HD11 ILE A 77 7.327 -15.996 -14.490 1.00 0.00 H new ATOM 0 HD12 ILE A 77 7.292 -16.093 -12.713 1.00 0.00 H new ATOM 0 HD13 ILE A 77 6.001 -16.856 -13.672 1.00 0.00 H new ATOM 1214 N MET A 78 4.345 -13.436 -9.431 1.00 0.00 N ATOM 1215 CA MET A 78 3.537 -13.377 -8.225 1.00 0.00 C ATOM 1216 C MET A 78 2.683 -12.108 -8.199 1.00 0.00 C ATOM 1217 O MET A 78 1.470 -12.175 -8.005 1.00 0.00 O ATOM 1218 CB MET A 78 4.451 -13.403 -6.997 1.00 0.00 C ATOM 1219 CG MET A 78 4.039 -14.515 -6.031 1.00 0.00 C ATOM 1220 SD MET A 78 4.515 -16.104 -6.691 1.00 0.00 S ATOM 1221 CE MET A 78 2.904 -16.820 -6.968 1.00 0.00 C ATOM 0 H MET A 78 5.318 -13.703 -9.280 1.00 0.00 H new ATOM 0 HA MET A 78 2.872 -14.240 -8.213 1.00 0.00 H new ATOM 0 HB2 MET A 78 5.484 -13.553 -7.311 1.00 0.00 H new ATOM 0 HB3 MET A 78 4.410 -12.440 -6.488 1.00 0.00 H new ATOM 0 HG2 MET A 78 4.511 -14.359 -5.061 1.00 0.00 H new ATOM 0 HG3 MET A 78 2.961 -14.487 -5.869 1.00 0.00 H new ATOM 0 HE1 MET A 78 2.989 -17.906 -7.000 1.00 0.00 H new ATOM 0 HE2 MET A 78 2.234 -16.532 -6.158 1.00 0.00 H new ATOM 0 HE3 MET A 78 2.504 -16.459 -7.915 1.00 0.00 H new ATOM 1231 N PRO A 79 3.367 -10.950 -8.402 1.00 0.00 N ATOM 1232 CA PRO A 79 2.684 -9.668 -8.404 1.00 0.00 C ATOM 1233 C PRO A 79 1.895 -9.469 -9.699 1.00 0.00 C ATOM 1234 O PRO A 79 0.719 -9.824 -9.775 1.00 0.00 O ATOM 1235 CB PRO A 79 3.784 -8.636 -8.215 1.00 0.00 C ATOM 1236 CG PRO A 79 5.082 -9.339 -8.579 1.00 0.00 C ATOM 1237 CD PRO A 79 4.804 -10.832 -8.635 1.00 0.00 C ATOM 0 HA PRO A 79 1.939 -9.587 -7.612 1.00 0.00 H new ATOM 0 HB2 PRO A 79 3.618 -7.767 -8.852 1.00 0.00 H new ATOM 0 HB3 PRO A 79 3.810 -8.276 -7.186 1.00 0.00 H new ATOM 0 HG2 PRO A 79 5.452 -8.983 -9.541 1.00 0.00 H new ATOM 0 HG3 PRO A 79 5.854 -9.122 -7.840 1.00 0.00 H new ATOM 0 HD2 PRO A 79 5.084 -11.251 -9.601 1.00 0.00 H new ATOM 0 HD3 PRO A 79 5.374 -11.370 -7.877 1.00 0.00 H new ATOM 1245 N ALA A 80 2.572 -8.902 -10.687 1.00 0.00 N ATOM 1246 CA ALA A 80 1.949 -8.652 -11.975 1.00 0.00 C ATOM 1247 C ALA A 80 0.925 -7.523 -11.831 1.00 0.00 C ATOM 1248 O ALA A 80 1.049 -6.482 -12.474 1.00 0.00 O ATOM 1249 CB ALA A 80 1.321 -9.945 -12.499 1.00 0.00 C ATOM 0 H ALA A 80 3.547 -8.609 -10.621 1.00 0.00 H new ATOM 0 HA ALA A 80 2.693 -8.332 -12.705 1.00 0.00 H new ATOM 0 HB1 ALA A 80 0.854 -9.757 -13.466 1.00 0.00 H new ATOM 0 HB2 ALA A 80 2.094 -10.705 -12.612 1.00 0.00 H new ATOM 0 HB3 ALA A 80 0.567 -10.295 -11.794 1.00 0.00 H new ATOM 1255 N GLY A 81 -0.063 -7.769 -10.983 1.00 0.00 N ATOM 1256 CA GLY A 81 -1.107 -6.786 -10.746 1.00 0.00 C ATOM 1257 C GLY A 81 -0.581 -5.617 -9.911 1.00 0.00 C ATOM 1258 O GLY A 81 -0.925 -4.464 -10.164 1.00 0.00 O ATOM 0 H GLY A 81 -0.163 -8.634 -10.452 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -1.486 -6.416 -11.699 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -1.945 -7.257 -10.232 1.00 0.00 H new ATOM 1262 N LEU A 82 0.246 -5.956 -8.932 1.00 0.00 N ATOM 1263 CA LEU A 82 0.823 -4.948 -8.058 1.00 0.00 C ATOM 1264 C LEU A 82 1.618 -3.946 -8.897 1.00 0.00 C ATOM 1265 O LEU A 82 1.262 -2.771 -8.970 1.00 0.00 O ATOM 1266 CB LEU A 82 1.643 -5.608 -6.948 1.00 0.00 C ATOM 1267 CG LEU A 82 1.806 -4.797 -5.661 1.00 0.00 C ATOM 1268 CD1 LEU A 82 0.534 -4.854 -4.812 1.00 0.00 C ATOM 1269 CD2 LEU A 82 3.039 -5.252 -4.878 1.00 0.00 C ATOM 0 H LEU A 82 0.530 -6.914 -8.725 1.00 0.00 H new ATOM 0 HA LEU A 82 0.037 -4.387 -7.552 1.00 0.00 H new ATOM 0 HB2 LEU A 82 1.177 -6.561 -6.697 1.00 0.00 H new ATOM 0 HB3 LEU A 82 2.635 -5.832 -7.341 1.00 0.00 H new ATOM 0 HG LEU A 82 1.965 -3.754 -5.933 1.00 0.00 H new ATOM 0 HD11 LEU A 82 0.677 -4.269 -3.903 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -0.301 -4.444 -5.380 1.00 0.00 H new ATOM 0 HD13 LEU A 82 0.319 -5.889 -4.547 1.00 0.00 H new ATOM 0 HD21 LEU A 82 3.131 -4.659 -3.968 1.00 0.00 H new ATOM 0 HD22 LEU A 82 2.936 -6.305 -4.616 1.00 0.00 H new ATOM 0 HD23 LEU A 82 3.930 -5.116 -5.491 1.00 0.00 H new ATOM 1281 N VAL A 83 2.680 -4.448 -9.510 1.00 0.00 N ATOM 1282 CA VAL A 83 3.529 -3.611 -10.342 1.00 0.00 C ATOM 1283 C VAL A 83 2.674 -2.931 -11.413 1.00 0.00 C ATOM 1284 O VAL A 83 2.661 -1.705 -11.515 1.00 0.00 O ATOM 1285 CB VAL A 83 4.671 -4.443 -10.928 1.00 0.00 C ATOM 1286 CG1 VAL A 83 5.521 -3.608 -11.887 1.00 0.00 C ATOM 1287 CG2 VAL A 83 5.532 -5.050 -9.818 1.00 0.00 C ATOM 0 H VAL A 83 2.972 -5.423 -9.447 1.00 0.00 H new ATOM 0 HA VAL A 83 3.991 -2.824 -9.746 1.00 0.00 H new ATOM 0 HB VAL A 83 4.232 -5.262 -11.497 1.00 0.00 H new ATOM 0 HG11 VAL A 83 6.326 -4.223 -12.290 1.00 0.00 H new ATOM 0 HG12 VAL A 83 4.898 -3.246 -12.704 1.00 0.00 H new ATOM 0 HG13 VAL A 83 5.946 -2.759 -11.351 1.00 0.00 H new ATOM 0 HG21 VAL A 83 6.337 -5.637 -10.261 1.00 0.00 H new ATOM 0 HG22 VAL A 83 5.957 -4.252 -9.210 1.00 0.00 H new ATOM 0 HG23 VAL A 83 4.916 -5.695 -9.191 1.00 0.00 H new ATOM 1297 N ALA A 84 1.982 -3.756 -12.184 1.00 0.00 N ATOM 1298 CA ALA A 84 1.127 -3.249 -13.244 1.00 0.00 C ATOM 1299 C ALA A 84 0.263 -2.111 -12.697 1.00 0.00 C ATOM 1300 O ALA A 84 -0.089 -1.187 -13.428 1.00 0.00 O ATOM 1301 CB ALA A 84 0.288 -4.394 -13.815 1.00 0.00 C ATOM 0 H ALA A 84 1.996 -4.772 -12.096 1.00 0.00 H new ATOM 0 HA ALA A 84 1.727 -2.845 -14.060 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -0.353 -4.014 -14.610 1.00 0.00 H new ATOM 0 HB2 ALA A 84 0.948 -5.163 -14.217 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -0.329 -4.822 -13.025 1.00 0.00 H new ATOM 1307 N GLY A 85 -0.053 -2.215 -11.414 1.00 0.00 N ATOM 1308 CA GLY A 85 -0.868 -1.206 -10.760 1.00 0.00 C ATOM 1309 C GLY A 85 -0.077 0.087 -10.549 1.00 0.00 C ATOM 1310 O GLY A 85 -0.572 1.176 -10.833 1.00 0.00 O ATOM 0 H GLY A 85 0.241 -2.983 -10.810 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -1.752 -1.001 -11.363 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -1.218 -1.583 -9.799 1.00 0.00 H new ATOM 1314 N LEU A 86 1.141 -0.077 -10.053 1.00 0.00 N ATOM 1315 CA LEU A 86 2.006 1.062 -9.800 1.00 0.00 C ATOM 1316 C LEU A 86 2.160 1.875 -11.087 1.00 0.00 C ATOM 1317 O LEU A 86 2.114 3.104 -11.059 1.00 0.00 O ATOM 1318 CB LEU A 86 3.336 0.603 -9.199 1.00 0.00 C ATOM 1319 CG LEU A 86 4.516 0.519 -10.169 1.00 0.00 C ATOM 1320 CD1 LEU A 86 5.147 1.897 -10.385 1.00 0.00 C ATOM 1321 CD2 LEU A 86 5.542 -0.512 -9.696 1.00 0.00 C ATOM 0 H LEU A 86 1.549 -0.982 -9.820 1.00 0.00 H new ATOM 0 HA LEU A 86 1.559 1.722 -9.057 1.00 0.00 H new ATOM 0 HB2 LEU A 86 3.602 1.286 -8.392 1.00 0.00 H new ATOM 0 HB3 LEU A 86 3.189 -0.379 -8.750 1.00 0.00 H new ATOM 0 HG LEU A 86 4.141 0.181 -11.135 1.00 0.00 H new ATOM 0 HD11 LEU A 86 5.983 1.810 -11.078 1.00 0.00 H new ATOM 0 HD12 LEU A 86 4.402 2.577 -10.798 1.00 0.00 H new ATOM 0 HD13 LEU A 86 5.505 2.287 -9.432 1.00 0.00 H new ATOM 0 HD21 LEU A 86 6.370 -0.552 -10.403 1.00 0.00 H new ATOM 0 HD22 LEU A 86 5.917 -0.227 -8.713 1.00 0.00 H new ATOM 0 HD23 LEU A 86 5.070 -1.493 -9.634 1.00 0.00 H new ATOM 1333 N SER A 87 2.340 1.156 -12.185 1.00 0.00 N ATOM 1334 CA SER A 87 2.502 1.794 -13.480 1.00 0.00 C ATOM 1335 C SER A 87 1.218 2.532 -13.864 1.00 0.00 C ATOM 1336 O SER A 87 1.237 3.739 -14.097 1.00 0.00 O ATOM 1337 CB SER A 87 2.869 0.771 -14.557 1.00 0.00 C ATOM 1338 OG SER A 87 3.254 1.396 -15.778 1.00 0.00 O ATOM 0 H SER A 87 2.377 0.137 -12.204 1.00 0.00 H new ATOM 0 HA SER A 87 3.319 2.512 -13.407 1.00 0.00 H new ATOM 0 HB2 SER A 87 3.685 0.144 -14.198 1.00 0.00 H new ATOM 0 HB3 SER A 87 2.018 0.114 -14.738 1.00 0.00 H new ATOM 0 HG SER A 87 3.482 0.710 -16.439 1.00 0.00 H new ATOM 1344 N LEU A 88 0.132 1.774 -13.917 1.00 0.00 N ATOM 1345 CA LEU A 88 -1.159 2.341 -14.269 1.00 0.00 C ATOM 1346 C LEU A 88 -1.426 3.570 -13.398 1.00 0.00 C ATOM 1347 O LEU A 88 -2.108 4.501 -13.824 1.00 0.00 O ATOM 1348 CB LEU A 88 -2.254 1.276 -14.181 1.00 0.00 C ATOM 1349 CG LEU A 88 -2.593 0.554 -15.487 1.00 0.00 C ATOM 1350 CD1 LEU A 88 -2.959 -0.909 -15.226 1.00 0.00 C ATOM 1351 CD2 LEU A 88 -3.694 1.292 -16.251 1.00 0.00 C ATOM 0 H LEU A 88 0.120 0.773 -13.722 1.00 0.00 H new ATOM 0 HA LEU A 88 -1.157 2.678 -15.305 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -1.951 0.531 -13.445 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -3.162 1.747 -13.803 1.00 0.00 H new ATOM 0 HG LEU A 88 -1.705 0.556 -16.119 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -3.196 -1.399 -16.171 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -2.117 -1.416 -14.755 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -3.826 -0.955 -14.566 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -3.916 0.758 -17.175 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -4.593 1.342 -15.636 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -3.359 2.302 -16.487 1.00 0.00 H new ATOM 1363 N MET A 89 -0.875 3.533 -12.193 1.00 0.00 N ATOM 1364 CA MET A 89 -1.045 4.632 -11.258 1.00 0.00 C ATOM 1365 C MET A 89 -0.308 5.883 -11.742 1.00 0.00 C ATOM 1366 O MET A 89 -0.936 6.877 -12.103 1.00 0.00 O ATOM 1367 CB MET A 89 -0.509 4.222 -9.885 1.00 0.00 C ATOM 1368 CG MET A 89 -1.263 4.941 -8.765 1.00 0.00 C ATOM 1369 SD MET A 89 -0.105 5.686 -7.629 1.00 0.00 S ATOM 1370 CE MET A 89 0.453 7.065 -8.615 1.00 0.00 C ATOM 0 H MET A 89 -0.310 2.759 -11.843 1.00 0.00 H new ATOM 0 HA MET A 89 -2.108 4.864 -11.188 1.00 0.00 H new ATOM 0 HB2 MET A 89 -0.606 3.144 -9.760 1.00 0.00 H new ATOM 0 HB3 MET A 89 0.554 4.456 -9.821 1.00 0.00 H new ATOM 0 HG2 MET A 89 -1.914 5.706 -9.187 1.00 0.00 H new ATOM 0 HG3 MET A 89 -1.902 4.235 -8.235 1.00 0.00 H new ATOM 0 HE1 MET A 89 0.744 7.886 -7.960 1.00 0.00 H new ATOM 0 HE2 MET A 89 1.309 6.760 -9.216 1.00 0.00 H new ATOM 0 HE3 MET A 89 -0.353 7.392 -9.272 1.00 0.00 H new ATOM 1380 N MET A 90 1.014 5.792 -11.734 1.00 0.00 N ATOM 1381 CA MET A 90 1.843 6.903 -12.168 1.00 0.00 C ATOM 1382 C MET A 90 1.433 7.382 -13.562 1.00 0.00 C ATOM 1383 O MET A 90 1.752 8.503 -13.956 1.00 0.00 O ATOM 1384 CB MET A 90 3.310 6.468 -12.188 1.00 0.00 C ATOM 1385 CG MET A 90 3.625 5.659 -13.448 1.00 0.00 C ATOM 1386 SD MET A 90 4.636 6.625 -14.557 1.00 0.00 S ATOM 1387 CE MET A 90 6.230 5.885 -14.248 1.00 0.00 C ATOM 0 H MET A 90 1.531 4.966 -11.434 1.00 0.00 H new ATOM 0 HA MET A 90 1.709 7.727 -11.468 1.00 0.00 H new ATOM 0 HB2 MET A 90 3.954 7.346 -12.145 1.00 0.00 H new ATOM 0 HB3 MET A 90 3.528 5.870 -11.303 1.00 0.00 H new ATOM 0 HG2 MET A 90 4.143 4.739 -13.179 1.00 0.00 H new ATOM 0 HG3 MET A 90 2.699 5.370 -13.945 1.00 0.00 H new ATOM 0 HE1 MET A 90 6.984 6.374 -14.865 1.00 0.00 H new ATOM 0 HE2 MET A 90 6.489 6.004 -13.196 1.00 0.00 H new ATOM 0 HE3 MET A 90 6.192 4.824 -14.494 1.00 0.00 H new ATOM 1397 N ILE A 91 0.732 6.509 -14.270 1.00 0.00 N ATOM 1398 CA ILE A 91 0.275 6.829 -15.612 1.00 0.00 C ATOM 1399 C ILE A 91 -1.081 7.532 -15.530 1.00 0.00 C ATOM 1400 O ILE A 91 -1.389 8.392 -16.353 1.00 0.00 O ATOM 1401 CB ILE A 91 0.265 5.574 -16.488 1.00 0.00 C ATOM 1402 CG1 ILE A 91 1.690 5.117 -16.807 1.00 0.00 C ATOM 1403 CG2 ILE A 91 -0.563 5.796 -17.755 1.00 0.00 C ATOM 1404 CD1 ILE A 91 1.683 3.791 -17.569 1.00 0.00 C ATOM 0 H ILE A 91 0.469 5.580 -13.940 1.00 0.00 H new ATOM 0 HA ILE A 91 0.965 7.521 -16.095 1.00 0.00 H new ATOM 0 HB ILE A 91 -0.213 4.770 -15.928 1.00 0.00 H new ATOM 0 HG12 ILE A 91 2.196 5.879 -17.400 1.00 0.00 H new ATOM 0 HG13 ILE A 91 2.256 5.006 -15.882 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -0.553 4.889 -18.359 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -1.590 6.039 -17.481 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -0.137 6.619 -18.329 1.00 0.00 H new ATOM 0 HD11 ILE A 91 2.708 3.489 -17.783 1.00 0.00 H new ATOM 0 HD12 ILE A 91 1.198 3.026 -16.963 1.00 0.00 H new ATOM 0 HD13 ILE A 91 1.137 3.912 -18.505 1.00 0.00 H new ATOM 1416 N LEU A 92 -1.856 7.140 -14.529 1.00 0.00 N ATOM 1417 CA LEU A 92 -3.172 7.722 -14.329 1.00 0.00 C ATOM 1418 C LEU A 92 -3.021 9.113 -13.710 1.00 0.00 C ATOM 1419 O LEU A 92 -3.926 9.941 -13.806 1.00 0.00 O ATOM 1420 CB LEU A 92 -4.056 6.778 -13.512 1.00 0.00 C ATOM 1421 CG LEU A 92 -4.964 7.441 -12.473 1.00 0.00 C ATOM 1422 CD1 LEU A 92 -6.066 6.482 -12.018 1.00 0.00 C ATOM 1423 CD2 LEU A 92 -4.149 7.978 -11.296 1.00 0.00 C ATOM 0 H LEU A 92 -1.597 6.426 -13.848 1.00 0.00 H new ATOM 0 HA LEU A 92 -3.681 7.851 -15.284 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -4.680 6.209 -14.201 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -3.413 6.062 -13.000 1.00 0.00 H new ATOM 0 HG LEU A 92 -5.453 8.295 -12.941 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -6.697 6.977 -11.280 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -6.671 6.190 -12.876 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -5.615 5.595 -11.573 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -4.818 8.444 -10.573 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -3.614 7.157 -10.819 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -3.433 8.717 -11.656 1.00 0.00 H new ATOM 1435 N ARG A 93 -1.870 9.327 -13.088 1.00 0.00 N ATOM 1436 CA ARG A 93 -1.589 10.604 -12.454 1.00 0.00 C ATOM 1437 C ARG A 93 -0.837 11.522 -13.419 1.00 0.00 C ATOM 1438 O ARG A 93 -1.207 12.682 -13.594 1.00 0.00 O ATOM 1439 CB ARG A 93 -0.755 10.416 -11.185 1.00 0.00 C ATOM 1440 CG ARG A 93 -1.570 10.761 -9.937 1.00 0.00 C ATOM 1441 CD ARG A 93 -1.187 12.140 -9.396 1.00 0.00 C ATOM 1442 NE ARG A 93 -2.327 12.728 -8.658 1.00 0.00 N ATOM 1443 CZ ARG A 93 -3.426 13.223 -9.244 1.00 0.00 C ATOM 1444 NH1 ARG A 93 -3.541 13.203 -10.579 1.00 0.00 N ATOM 1445 NH2 ARG A 93 -4.411 13.738 -8.494 1.00 0.00 N ATOM 0 H ARG A 93 -1.122 8.638 -13.010 1.00 0.00 H new ATOM 0 HA ARG A 93 -2.543 11.058 -12.185 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -0.408 9.385 -11.123 1.00 0.00 H new ATOM 0 HB3 ARG A 93 0.131 11.049 -11.231 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -2.633 10.743 -10.176 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -1.403 10.006 -9.169 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -0.322 12.054 -8.738 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -0.898 12.795 -10.218 1.00 0.00 H new ATOM 0 HE ARG A 93 -2.273 12.758 -7.640 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -2.792 12.811 -11.150 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -4.378 13.580 -11.025 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -4.324 13.753 -7.478 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -5.248 14.115 -8.940 1.00 0.00 H new ATOM 1459 N LEU A 94 0.206 10.969 -14.021 1.00 0.00 N ATOM 1460 CA LEU A 94 1.013 11.723 -14.964 1.00 0.00 C ATOM 1461 C LEU A 94 0.124 12.224 -16.104 1.00 0.00 C ATOM 1462 O LEU A 94 0.501 13.138 -16.835 1.00 0.00 O ATOM 1463 CB LEU A 94 2.206 10.889 -15.435 1.00 0.00 C ATOM 1464 CG LEU A 94 3.110 11.544 -16.483 1.00 0.00 C ATOM 1465 CD1 LEU A 94 4.583 11.240 -16.202 1.00 0.00 C ATOM 1466 CD2 LEU A 94 2.699 11.130 -17.897 1.00 0.00 C ATOM 0 H LEU A 94 0.511 10.007 -13.873 1.00 0.00 H new ATOM 0 HA LEU A 94 1.439 12.603 -14.482 1.00 0.00 H new ATOM 0 HB2 LEU A 94 2.814 10.637 -14.566 1.00 0.00 H new ATOM 0 HB3 LEU A 94 1.830 9.951 -15.844 1.00 0.00 H new ATOM 0 HG LEU A 94 2.985 12.625 -16.415 1.00 0.00 H new ATOM 0 HD11 LEU A 94 5.204 11.717 -16.961 1.00 0.00 H new ATOM 0 HD12 LEU A 94 4.853 11.624 -15.218 1.00 0.00 H new ATOM 0 HD13 LEU A 94 4.743 10.162 -16.227 1.00 0.00 H new ATOM 0 HD21 LEU A 94 3.357 11.609 -18.622 1.00 0.00 H new ATOM 0 HD22 LEU A 94 2.777 10.047 -17.996 1.00 0.00 H new ATOM 0 HD23 LEU A 94 1.670 11.438 -18.082 1.00 0.00 H new ATOM 1478 N VAL A 95 -1.041 11.602 -16.220 1.00 0.00 N ATOM 1479 CA VAL A 95 -1.987 11.973 -17.258 1.00 0.00 C ATOM 1480 C VAL A 95 -2.171 13.492 -17.256 1.00 0.00 C ATOM 1481 O VAL A 95 -2.000 14.144 -18.285 1.00 0.00 O ATOM 1482 CB VAL A 95 -3.300 11.211 -17.067 1.00 0.00 C ATOM 1483 CG1 VAL A 95 -4.472 11.975 -17.685 1.00 0.00 C ATOM 1484 CG2 VAL A 95 -3.202 9.797 -17.643 1.00 0.00 C ATOM 0 H VAL A 95 -1.351 10.844 -15.612 1.00 0.00 H new ATOM 0 HA VAL A 95 -1.605 11.694 -18.240 1.00 0.00 H new ATOM 0 HB VAL A 95 -3.484 11.124 -15.996 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -5.393 11.412 -17.535 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -4.562 12.951 -17.208 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -4.297 12.108 -18.753 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -4.148 9.277 -17.494 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -2.982 9.853 -18.709 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -2.405 9.252 -17.137 1.00 0.00 H new ATOM 1494 N LEU A 96 -2.518 14.012 -16.087 1.00 0.00 N ATOM 1495 CA LEU A 96 -2.727 15.442 -15.937 1.00 0.00 C ATOM 1496 C LEU A 96 -1.550 16.048 -15.171 1.00 0.00 C ATOM 1497 O LEU A 96 -1.177 17.196 -15.406 1.00 0.00 O ATOM 1498 CB LEU A 96 -4.088 15.719 -15.294 1.00 0.00 C ATOM 1499 CG LEU A 96 -4.420 14.897 -14.047 1.00 0.00 C ATOM 1500 CD1 LEU A 96 -5.124 15.756 -12.995 1.00 0.00 C ATOM 1501 CD2 LEU A 96 -5.235 13.654 -14.411 1.00 0.00 C ATOM 0 H LEU A 96 -2.659 13.468 -15.236 1.00 0.00 H new ATOM 0 HA LEU A 96 -2.756 15.928 -16.912 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -4.135 16.776 -15.032 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -4.863 15.541 -16.039 1.00 0.00 H new ATOM 0 HG LEU A 96 -3.485 14.552 -13.607 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -5.349 15.147 -12.119 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -4.474 16.582 -12.706 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -6.051 16.152 -13.409 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -5.458 13.087 -13.507 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -6.167 13.957 -14.888 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -4.662 13.031 -15.098 1.00 0.00 H new ATOM 1513 N LEU A 97 -0.997 15.248 -14.271 1.00 0.00 N ATOM 1514 CA LEU A 97 0.131 15.692 -13.469 1.00 0.00 C ATOM 1515 C LEU A 97 -0.058 17.164 -13.100 1.00 0.00 C ATOM 1516 O LEU A 97 0.915 17.906 -12.972 1.00 0.00 O ATOM 1517 CB LEU A 97 1.448 15.403 -14.191 1.00 0.00 C ATOM 1518 CG LEU A 97 2.073 16.581 -14.943 1.00 0.00 C ATOM 1519 CD1 LEU A 97 3.154 17.258 -14.099 1.00 0.00 C ATOM 1520 CD2 LEU A 97 2.604 16.140 -16.308 1.00 0.00 C ATOM 0 H LEU A 97 -1.309 14.296 -14.079 1.00 0.00 H new ATOM 0 HA LEU A 97 0.177 15.133 -12.534 1.00 0.00 H new ATOM 0 HB2 LEU A 97 2.169 15.041 -13.458 1.00 0.00 H new ATOM 0 HB3 LEU A 97 1.280 14.592 -14.900 1.00 0.00 H new ATOM 0 HG LEU A 97 1.295 17.322 -15.125 1.00 0.00 H new ATOM 0 HD11 LEU A 97 3.582 18.091 -14.656 1.00 0.00 H new ATOM 0 HD12 LEU A 97 2.714 17.628 -13.173 1.00 0.00 H new ATOM 0 HD13 LEU A 97 3.938 16.537 -13.865 1.00 0.00 H new ATOM 0 HD21 LEU A 97 3.043 16.996 -16.821 1.00 0.00 H new ATOM 0 HD22 LEU A 97 3.363 15.370 -16.172 1.00 0.00 H new ATOM 0 HD23 LEU A 97 1.785 15.740 -16.905 1.00 0.00 H new ATOM 1532 N LEU A 98 -1.318 17.544 -12.939 1.00 0.00 N ATOM 1533 CA LEU A 98 -1.647 18.915 -12.587 1.00 0.00 C ATOM 1534 C LEU A 98 -1.497 19.099 -11.076 1.00 0.00 C ATOM 1535 O LEU A 98 -0.938 20.096 -10.621 1.00 0.00 O ATOM 1536 CB LEU A 98 -3.033 19.285 -13.117 1.00 0.00 C ATOM 1537 CG LEU A 98 -3.109 19.647 -14.602 1.00 0.00 C ATOM 1538 CD1 LEU A 98 -4.545 19.538 -15.120 1.00 0.00 C ATOM 1539 CD2 LEU A 98 -2.509 21.030 -14.861 1.00 0.00 C ATOM 0 H LEU A 98 -2.123 16.926 -13.046 1.00 0.00 H new ATOM 0 HA LEU A 98 -0.953 19.608 -13.063 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -3.706 18.448 -12.933 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -3.408 20.129 -12.538 1.00 0.00 H new ATOM 0 HG LEU A 98 -2.510 18.927 -15.160 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -4.571 19.801 -16.178 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -4.902 18.516 -14.991 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -5.186 20.220 -14.561 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -2.576 21.262 -15.924 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -3.060 21.778 -14.291 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -1.463 21.036 -14.553 1.00 0.00 H new ATOM 1551 N LEU A 99 -2.006 18.122 -10.339 1.00 0.00 N ATOM 1552 CA LEU A 99 -1.935 18.164 -8.889 1.00 0.00 C ATOM 1553 C LEU A 99 -0.482 17.984 -8.447 1.00 0.00 C ATOM 1554 O LEU A 99 -0.015 18.669 -7.539 1.00 0.00 O ATOM 1555 CB LEU A 99 -2.895 17.142 -8.276 1.00 0.00 C ATOM 1556 CG LEU A 99 -4.151 17.714 -7.614 1.00 0.00 C ATOM 1557 CD1 LEU A 99 -5.205 16.626 -7.405 1.00 0.00 C ATOM 1558 CD2 LEU A 99 -3.803 18.433 -6.309 1.00 0.00 C ATOM 0 H LEU A 99 -2.469 17.297 -10.720 1.00 0.00 H new ATOM 0 HA LEU A 99 -2.262 19.136 -8.520 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -3.204 16.449 -9.058 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -2.349 16.561 -7.533 1.00 0.00 H new ATOM 0 HG LEU A 99 -4.583 18.456 -8.286 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -6.087 17.059 -6.933 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -5.482 16.198 -8.368 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -4.798 15.844 -6.764 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -4.713 18.830 -5.859 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -3.334 17.730 -5.620 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -3.114 19.252 -6.517 1.00 0.00 H new TER 1570 LEU A 99