USER MOD reduce.3.24.130724 H: found=0, std=0, add=899, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 899 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 18 THR OG1 : rot 180:sc= 0.251 USER MOD Set 1.2: A 21 SER OG : rot 90:sc= 0.27 USER MOD Single : A 1 MET CE :methyl -175:sc= 0 (180deg=-0.0512) USER MOD Single : A 1 MET N :NH3+ -170:sc= -0.128 (180deg=-0.149) USER MOD Single : A 6 LYS NZ :NH3+ -172:sc= 0.987 (180deg=0.862) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.0553 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 TYR OH : rot 158:sc= 0.752 USER MOD Single : A 17 ASN : amide:sc= 0.36 X(o=0.36,f=-0.056) USER MOD Single : A 20 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 THR OG1 : rot 83:sc= 1.24 USER MOD Single : A 30 ASN : amide:sc= -0.0113 K(o=-0.011,f=-0.66) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ -164:sc= -0.0519 (180deg=-0.316) USER MOD Single : A 40 TYR OH : rot -164:sc= -0.748 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 ASN : amide:sc= -0.747 K(o=-0.75,f=-7.5!) USER MOD Single : A 52 GLN : amide:sc= 0.12 X(o=0.12,f=-0.32) USER MOD Single : A 58 LYS NZ :NH3+ -164:sc= -0.0341 (180deg=-0.309) USER MOD Single : A 62 THR OG1 : rot 120:sc= 0 USER MOD Single : A 64 THR OG1 : rot 99:sc= 1.17 USER MOD Single : A 67 LYS NZ :NH3+ -111:sc= -0.75 (180deg=-3.74!) USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 82 ASN : amide:sc= -0.0544 K(o=-0.054,f=-4.2!) USER MOD Single : A 85 LYS NZ :NH3+ -171:sc=-0.00126 (180deg=-0.092) USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 LYS NZ :NH3+ 167:sc= -0.0427 (180deg=-0.3) USER MOD Single : A 106 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0313) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -18.316 -16.121 -17.091 1.00 0.00 N ATOM 2 CA MET A 1 -17.469 -16.576 -18.226 1.00 0.00 C ATOM 3 C MET A 1 -16.205 -15.732 -18.327 1.00 0.00 C ATOM 4 O MET A 1 -15.332 -15.994 -19.155 1.00 0.00 O ATOM 5 CB MET A 1 -18.254 -16.490 -19.538 1.00 0.00 C ATOM 6 CG MET A 1 -19.370 -17.516 -19.651 1.00 0.00 C ATOM 7 SD MET A 1 -20.115 -17.557 -21.292 1.00 0.00 S ATOM 8 CE MET A 1 -21.023 -16.013 -21.296 1.00 0.00 C ATOM 0 H1 MET A 1 -19.082 -16.807 -16.932 1.00 0.00 H new ATOM 0 H2 MET A 1 -17.735 -16.047 -16.232 1.00 0.00 H new ATOM 0 H3 MET A 1 -18.725 -15.191 -17.314 1.00 0.00 H new ATOM 0 HA MET A 1 -17.184 -17.612 -18.045 1.00 0.00 H new ATOM 0 HB2 MET A 1 -18.680 -15.491 -19.631 1.00 0.00 H new ATOM 0 HB3 MET A 1 -17.565 -16.622 -20.372 1.00 0.00 H new ATOM 0 HG2 MET A 1 -18.976 -18.503 -19.411 1.00 0.00 H new ATOM 0 HG3 MET A 1 -20.140 -17.292 -18.913 1.00 0.00 H new ATOM 0 HE1 MET A 1 -21.609 -15.938 -22.212 1.00 0.00 H new ATOM 0 HE2 MET A 1 -21.691 -15.981 -20.435 1.00 0.00 H new ATOM 0 HE3 MET A 1 -20.323 -15.179 -21.243 1.00 0.00 H new ATOM 20 N ALA A 2 -16.114 -14.718 -17.476 1.00 0.00 N ATOM 21 CA ALA A 2 -14.959 -13.829 -17.464 1.00 0.00 C ATOM 22 C ALA A 2 -14.073 -14.097 -16.252 1.00 0.00 C ATOM 23 O ALA A 2 -14.477 -13.850 -15.114 1.00 0.00 O ATOM 24 CB ALA A 2 -15.411 -12.375 -17.478 1.00 0.00 C ATOM 0 H ALA A 2 -16.828 -14.490 -16.784 1.00 0.00 H new ATOM 0 HA ALA A 2 -14.372 -14.024 -18.361 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -14.538 -11.722 -17.469 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -15.997 -12.185 -18.377 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -16.022 -12.176 -16.598 1.00 0.00 H new ATOM 30 N PRO A 3 -12.851 -14.619 -16.479 1.00 0.00 N ATOM 31 CA PRO A 3 -11.903 -14.919 -15.400 1.00 0.00 C ATOM 32 C PRO A 3 -11.308 -13.661 -14.774 1.00 0.00 C ATOM 33 O PRO A 3 -11.244 -12.607 -15.407 1.00 0.00 O ATOM 34 CB PRO A 3 -10.823 -15.742 -16.097 1.00 0.00 C ATOM 35 CG PRO A 3 -10.856 -15.266 -17.501 1.00 0.00 C ATOM 36 CD PRO A 3 -12.300 -14.967 -17.803 1.00 0.00 C ATOM 0 HA PRO A 3 -12.382 -15.439 -14.570 1.00 0.00 H new ATOM 0 HB2 PRO A 3 -9.845 -15.581 -15.644 1.00 0.00 H new ATOM 0 HB3 PRO A 3 -11.032 -16.810 -16.033 1.00 0.00 H new ATOM 0 HG2 PRO A 3 -10.239 -14.376 -17.626 1.00 0.00 H new ATOM 0 HG3 PRO A 3 -10.464 -16.024 -18.179 1.00 0.00 H new ATOM 0 HD2 PRO A 3 -12.402 -14.145 -18.511 1.00 0.00 H new ATOM 0 HD3 PRO A 3 -12.808 -15.828 -18.238 1.00 0.00 H new ATOM 44 N LEU A 4 -10.866 -13.780 -13.527 1.00 0.00 N ATOM 45 CA LEU A 4 -10.286 -12.647 -12.818 1.00 0.00 C ATOM 46 C LEU A 4 -8.776 -12.818 -12.673 1.00 0.00 C ATOM 47 O LEU A 4 -8.291 -13.913 -12.386 1.00 0.00 O ATOM 48 CB LEU A 4 -10.931 -12.497 -11.437 1.00 0.00 C ATOM 49 CG LEU A 4 -12.456 -12.357 -11.442 1.00 0.00 C ATOM 50 CD1 LEU A 4 -12.984 -12.223 -10.022 1.00 0.00 C ATOM 51 CD2 LEU A 4 -12.887 -11.168 -12.290 1.00 0.00 C ATOM 0 H LEU A 4 -10.898 -14.646 -12.989 1.00 0.00 H new ATOM 0 HA LEU A 4 -10.480 -11.745 -13.399 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -10.664 -13.364 -10.833 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -10.503 -11.622 -10.947 1.00 0.00 H new ATOM 0 HG LEU A 4 -12.880 -13.259 -11.883 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -14.069 -12.125 -10.045 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -12.712 -13.109 -9.448 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -12.549 -11.340 -9.554 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -13.974 -11.088 -12.279 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -12.452 -10.255 -11.884 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -12.544 -11.309 -13.315 1.00 0.00 H new ATOM 63 N ARG A 5 -8.043 -11.730 -12.871 1.00 0.00 N ATOM 64 CA ARG A 5 -6.588 -11.756 -12.762 1.00 0.00 C ATOM 65 C ARG A 5 -6.143 -11.316 -11.371 1.00 0.00 C ATOM 66 O ARG A 5 -6.840 -10.551 -10.704 1.00 0.00 O ATOM 67 CB ARG A 5 -5.954 -10.852 -13.823 1.00 0.00 C ATOM 68 CG ARG A 5 -5.643 -11.565 -15.133 1.00 0.00 C ATOM 69 CD ARG A 5 -6.884 -11.699 -16.003 1.00 0.00 C ATOM 70 NE ARG A 5 -7.278 -10.424 -16.595 1.00 0.00 N ATOM 71 CZ ARG A 5 -8.432 -10.227 -17.227 1.00 0.00 C ATOM 72 NH1 ARG A 5 -9.314 -11.216 -17.325 1.00 0.00 N ATOM 73 NH2 ARG A 5 -8.707 -9.042 -17.756 1.00 0.00 N ATOM 0 H ARG A 5 -8.431 -10.817 -13.108 1.00 0.00 H new ATOM 0 HA ARG A 5 -6.255 -12.781 -12.927 1.00 0.00 H new ATOM 0 HB2 ARG A 5 -6.626 -10.018 -14.025 1.00 0.00 H new ATOM 0 HB3 ARG A 5 -5.033 -10.429 -13.423 1.00 0.00 H new ATOM 0 HG2 ARG A 5 -4.875 -11.013 -15.675 1.00 0.00 H new ATOM 0 HG3 ARG A 5 -5.236 -12.554 -14.923 1.00 0.00 H new ATOM 0 HD2 ARG A 5 -6.695 -12.423 -16.795 1.00 0.00 H new ATOM 0 HD3 ARG A 5 -7.706 -12.090 -15.404 1.00 0.00 H new ATOM 0 HE ARG A 5 -6.631 -9.639 -16.520 1.00 0.00 H new ATOM 0 HH11 ARG A 5 -9.106 -12.127 -16.916 1.00 0.00 H new ATOM 0 HH12 ARG A 5 -10.199 -11.064 -17.810 1.00 0.00 H new ATOM 0 HH21 ARG A 5 -8.033 -8.280 -17.679 1.00 0.00 H new ATOM 0 HH22 ARG A 5 -9.592 -8.893 -18.240 1.00 0.00 H new ATOM 87 N LYS A 6 -4.986 -11.814 -10.937 1.00 0.00 N ATOM 88 CA LYS A 6 -4.445 -11.469 -9.622 1.00 0.00 C ATOM 89 C LYS A 6 -4.079 -9.994 -9.562 1.00 0.00 C ATOM 90 O LYS A 6 -4.276 -9.331 -8.543 1.00 0.00 O ATOM 91 CB LYS A 6 -3.213 -12.322 -9.306 1.00 0.00 C ATOM 92 CG LYS A 6 -3.502 -13.814 -9.228 1.00 0.00 C ATOM 93 CD LYS A 6 -4.462 -14.151 -8.096 1.00 0.00 C ATOM 94 CE LYS A 6 -4.673 -15.653 -7.982 1.00 0.00 C ATOM 95 NZ LYS A 6 -5.291 -16.220 -9.212 1.00 0.00 N ATOM 0 H LYS A 6 -4.405 -12.457 -11.476 1.00 0.00 H new ATOM 0 HA LYS A 6 -5.215 -11.671 -8.877 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -2.456 -12.148 -10.071 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -2.789 -11.994 -8.357 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -3.925 -14.151 -10.174 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -2.568 -14.357 -9.085 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -4.070 -13.764 -7.156 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -5.419 -13.659 -8.269 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -3.716 -16.141 -7.798 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -5.310 -15.866 -7.124 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -5.543 -17.215 -9.047 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -6.148 -15.681 -9.450 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -4.614 -16.160 -10.000 1.00 0.00 H new ATOM 109 N THR A 7 -3.541 -9.492 -10.660 1.00 0.00 N ATOM 110 CA THR A 7 -3.152 -8.097 -10.750 1.00 0.00 C ATOM 111 C THR A 7 -4.300 -7.244 -11.261 1.00 0.00 C ATOM 112 O THR A 7 -4.828 -7.474 -12.351 1.00 0.00 O ATOM 113 CB THR A 7 -1.939 -7.904 -11.676 1.00 0.00 C ATOM 114 OG1 THR A 7 -1.968 -8.878 -12.730 1.00 0.00 O ATOM 115 CG2 THR A 7 -0.629 -8.015 -10.910 1.00 0.00 C ATOM 0 H THR A 7 -3.363 -10.034 -11.506 1.00 0.00 H new ATOM 0 HA THR A 7 -2.881 -7.782 -9.742 1.00 0.00 H new ATOM 0 HB THR A 7 -1.999 -6.902 -12.100 1.00 0.00 H new ATOM 0 HG1 THR A 7 -1.194 -8.748 -13.317 1.00 0.00 H new ATOM 0 HG21 THR A 7 0.206 -7.873 -11.596 1.00 0.00 H new ATOM 0 HG22 THR A 7 -0.595 -7.250 -10.134 1.00 0.00 H new ATOM 0 HG23 THR A 7 -0.558 -9.001 -10.451 1.00 0.00 H new ATOM 123 N ALA A 8 -4.678 -6.260 -10.464 1.00 0.00 N ATOM 124 CA ALA A 8 -5.760 -5.356 -10.817 1.00 0.00 C ATOM 125 C ALA A 8 -5.244 -4.167 -11.609 1.00 0.00 C ATOM 126 O ALA A 8 -4.090 -3.760 -11.457 1.00 0.00 O ATOM 127 CB ALA A 8 -6.476 -4.887 -9.566 1.00 0.00 C ATOM 0 H ALA A 8 -4.248 -6.065 -9.560 1.00 0.00 H new ATOM 0 HA ALA A 8 -6.465 -5.898 -11.447 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -7.285 -4.210 -9.842 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -6.887 -5.747 -9.038 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -5.772 -4.366 -8.918 1.00 0.00 H new ATOM 133 N VAL A 9 -6.103 -3.605 -12.445 1.00 0.00 N ATOM 134 CA VAL A 9 -5.730 -2.460 -13.251 1.00 0.00 C ATOM 135 C VAL A 9 -6.457 -1.221 -12.749 1.00 0.00 C ATOM 136 O VAL A 9 -7.690 -1.174 -12.708 1.00 0.00 O ATOM 137 CB VAL A 9 -6.049 -2.679 -14.746 1.00 0.00 C ATOM 138 CG1 VAL A 9 -5.663 -1.453 -15.573 1.00 0.00 C ATOM 139 CG2 VAL A 9 -5.333 -3.917 -15.266 1.00 0.00 C ATOM 0 H VAL A 9 -7.062 -3.925 -12.581 1.00 0.00 H new ATOM 0 HA VAL A 9 -4.652 -2.325 -13.157 1.00 0.00 H new ATOM 0 HB VAL A 9 -7.124 -2.830 -14.845 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -5.898 -1.633 -16.622 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -6.221 -0.586 -15.220 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -4.595 -1.265 -15.468 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -5.568 -4.057 -16.321 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -4.257 -3.791 -15.148 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -5.660 -4.790 -14.702 1.00 0.00 H new ATOM 149 N LEU A 10 -5.682 -0.223 -12.376 1.00 0.00 N ATOM 150 CA LEU A 10 -6.224 1.026 -11.872 1.00 0.00 C ATOM 151 C LEU A 10 -5.946 2.108 -12.903 1.00 0.00 C ATOM 152 O LEU A 10 -4.800 2.282 -13.320 1.00 0.00 O ATOM 153 CB LEU A 10 -5.561 1.366 -10.528 1.00 0.00 C ATOM 154 CG LEU A 10 -6.479 1.891 -9.410 1.00 0.00 C ATOM 155 CD1 LEU A 10 -7.250 3.117 -9.859 1.00 0.00 C ATOM 156 CD2 LEU A 10 -7.434 0.808 -8.930 1.00 0.00 C ATOM 0 H LEU A 10 -4.663 -0.253 -12.413 1.00 0.00 H new ATOM 0 HA LEU A 10 -7.299 0.947 -11.708 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -5.059 0.471 -10.162 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -4.788 2.113 -10.711 1.00 0.00 H new ATOM 0 HG LEU A 10 -5.841 2.180 -8.574 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -7.889 3.463 -9.046 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -6.550 3.907 -10.132 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -7.866 2.864 -10.722 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -8.070 1.208 -8.140 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -8.054 0.475 -9.762 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -6.862 -0.036 -8.543 1.00 0.00 H new ATOM 168 N LYS A 11 -6.970 2.844 -13.316 1.00 0.00 N ATOM 169 CA LYS A 11 -6.765 3.881 -14.315 1.00 0.00 C ATOM 170 C LYS A 11 -7.002 5.258 -13.722 1.00 0.00 C ATOM 171 O LYS A 11 -7.995 5.494 -13.027 1.00 0.00 O ATOM 172 CB LYS A 11 -7.662 3.687 -15.543 1.00 0.00 C ATOM 173 CG LYS A 11 -7.297 2.482 -16.393 1.00 0.00 C ATOM 174 CD LYS A 11 -8.185 2.379 -17.622 1.00 0.00 C ATOM 175 CE LYS A 11 -7.795 1.199 -18.496 1.00 0.00 C ATOM 176 NZ LYS A 11 -8.663 1.085 -19.699 1.00 0.00 N ATOM 0 H LYS A 11 -7.929 2.745 -12.983 1.00 0.00 H new ATOM 0 HA LYS A 11 -5.728 3.801 -14.640 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -8.696 3.585 -15.212 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -7.612 4.583 -16.161 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -6.254 2.555 -16.701 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -7.391 1.574 -15.798 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -9.225 2.275 -17.313 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -8.115 3.300 -18.201 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -6.756 1.306 -18.808 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -7.860 0.280 -17.914 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -8.363 0.267 -20.267 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -9.652 0.957 -19.403 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -8.582 1.951 -20.269 1.00 0.00 H new ATOM 190 N LEU A 12 -6.076 6.160 -13.996 1.00 0.00 N ATOM 191 CA LEU A 12 -6.178 7.524 -13.513 1.00 0.00 C ATOM 192 C LEU A 12 -6.434 8.447 -14.691 1.00 0.00 C ATOM 193 O LEU A 12 -5.658 8.454 -15.647 1.00 0.00 O ATOM 194 CB LEU A 12 -4.883 7.945 -12.805 1.00 0.00 C ATOM 195 CG LEU A 12 -5.052 8.790 -11.533 1.00 0.00 C ATOM 196 CD1 LEU A 12 -3.717 9.391 -11.118 1.00 0.00 C ATOM 197 CD2 LEU A 12 -6.085 9.891 -11.725 1.00 0.00 C ATOM 0 H LEU A 12 -5.242 5.971 -14.553 1.00 0.00 H new ATOM 0 HA LEU A 12 -6.999 7.588 -12.799 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -4.325 7.045 -12.547 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -4.273 8.507 -13.512 1.00 0.00 H new ATOM 0 HG LEU A 12 -5.410 8.130 -10.742 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -3.851 9.987 -10.215 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -3.003 8.591 -10.922 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -3.339 10.026 -11.919 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -6.177 10.468 -10.805 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -5.770 10.549 -12.535 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -7.049 9.446 -11.973 1.00 0.00 H new ATOM 209 N TYR A 13 -7.502 9.221 -14.645 1.00 0.00 N ATOM 210 CA TYR A 13 -7.803 10.139 -15.726 1.00 0.00 C ATOM 211 C TYR A 13 -7.326 11.526 -15.331 1.00 0.00 C ATOM 212 O TYR A 13 -7.795 12.088 -14.338 1.00 0.00 O ATOM 213 CB TYR A 13 -9.308 10.146 -15.998 1.00 0.00 C ATOM 214 CG TYR A 13 -9.842 8.800 -16.439 1.00 0.00 C ATOM 215 CD1 TYR A 13 -10.359 7.897 -15.516 1.00 0.00 C ATOM 216 CD2 TYR A 13 -9.822 8.427 -17.777 1.00 0.00 C ATOM 217 CE1 TYR A 13 -10.840 6.664 -15.914 1.00 0.00 C ATOM 218 CE2 TYR A 13 -10.303 7.194 -18.183 1.00 0.00 C ATOM 219 CZ TYR A 13 -10.810 6.318 -17.246 1.00 0.00 C ATOM 220 OH TYR A 13 -11.288 5.091 -17.645 1.00 0.00 O ATOM 0 H TYR A 13 -8.172 9.232 -13.876 1.00 0.00 H new ATOM 0 HA TYR A 13 -7.294 9.826 -16.637 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -9.832 10.459 -15.095 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -9.528 10.886 -16.767 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -10.385 8.164 -14.470 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -9.425 9.110 -18.513 1.00 0.00 H new ATOM 0 HE1 TYR A 13 -11.238 5.975 -15.183 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -10.281 6.920 -19.227 1.00 0.00 H new ATOM 0 HH TYR A 13 -11.520 5.124 -18.597 1.00 0.00 H new ATOM 230 N VAL A 14 -6.401 12.080 -16.100 1.00 0.00 N ATOM 231 CA VAL A 14 -5.847 13.388 -15.792 1.00 0.00 C ATOM 232 C VAL A 14 -5.975 14.336 -16.970 1.00 0.00 C ATOM 233 O VAL A 14 -6.146 13.909 -18.115 1.00 0.00 O ATOM 234 CB VAL A 14 -4.354 13.287 -15.396 1.00 0.00 C ATOM 235 CG1 VAL A 14 -4.185 12.461 -14.128 1.00 0.00 C ATOM 236 CG2 VAL A 14 -3.527 12.699 -16.531 1.00 0.00 C ATOM 0 H VAL A 14 -6.019 11.645 -16.940 1.00 0.00 H new ATOM 0 HA VAL A 14 -6.420 13.779 -14.951 1.00 0.00 H new ATOM 0 HB VAL A 14 -3.991 14.296 -15.199 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -3.128 12.404 -13.869 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -4.733 12.931 -13.312 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -4.573 11.456 -14.294 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -2.482 12.639 -16.227 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -3.894 11.700 -16.769 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -3.612 13.336 -17.411 1.00 0.00 H new ATOM 246 N ALA A 15 -5.887 15.624 -16.682 1.00 0.00 N ATOM 247 CA ALA A 15 -5.981 16.636 -17.715 1.00 0.00 C ATOM 248 C ALA A 15 -4.676 17.414 -17.784 1.00 0.00 C ATOM 249 O ALA A 15 -4.406 18.270 -16.938 1.00 0.00 O ATOM 250 CB ALA A 15 -7.157 17.566 -17.461 1.00 0.00 C ATOM 0 H ALA A 15 -5.751 15.991 -15.740 1.00 0.00 H new ATOM 0 HA ALA A 15 -6.153 16.148 -18.674 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -7.205 18.316 -18.251 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -8.082 16.989 -17.452 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -7.028 18.061 -16.498 1.00 0.00 H new ATOM 256 N GLY A 16 -3.874 17.115 -18.804 1.00 0.00 N ATOM 257 CA GLY A 16 -2.596 17.784 -18.971 1.00 0.00 C ATOM 258 C GLY A 16 -1.661 17.535 -17.805 1.00 0.00 C ATOM 259 O GLY A 16 -1.444 16.391 -17.408 1.00 0.00 O ATOM 0 H GLY A 16 -4.088 16.420 -19.519 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -2.125 17.439 -19.892 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -2.761 18.856 -19.079 1.00 0.00 H new ATOM 263 N ASN A 17 -1.101 18.604 -17.258 1.00 0.00 N ATOM 264 CA ASN A 17 -0.190 18.487 -16.128 1.00 0.00 C ATOM 265 C ASN A 17 -0.494 19.543 -15.078 1.00 0.00 C ATOM 266 O ASN A 17 0.388 20.297 -14.664 1.00 0.00 O ATOM 267 CB ASN A 17 1.264 18.601 -16.591 1.00 0.00 C ATOM 268 CG ASN A 17 2.048 17.322 -16.363 1.00 0.00 C ATOM 269 OD1 ASN A 17 3.178 17.352 -15.881 1.00 0.00 O ATOM 270 ND2 ASN A 17 1.450 16.187 -16.707 1.00 0.00 N ATOM 0 H ASN A 17 -1.260 19.560 -17.577 1.00 0.00 H new ATOM 0 HA ASN A 17 -0.334 17.504 -15.679 1.00 0.00 H new ATOM 0 HB2 ASN A 17 1.286 18.853 -17.651 1.00 0.00 H new ATOM 0 HB3 ASN A 17 1.748 19.420 -16.059 1.00 0.00 H new ATOM 0 HD21 ASN A 17 1.930 15.297 -16.574 1.00 0.00 H new ATOM 0 HD22 ASN A 17 0.511 16.205 -17.104 1.00 0.00 H new ATOM 277 N THR A 18 -1.752 19.602 -14.664 1.00 0.00 N ATOM 278 CA THR A 18 -2.174 20.551 -13.646 1.00 0.00 C ATOM 279 C THR A 18 -1.694 20.085 -12.280 1.00 0.00 C ATOM 280 O THR A 18 -1.408 18.900 -12.098 1.00 0.00 O ATOM 281 CB THR A 18 -3.709 20.713 -13.622 1.00 0.00 C ATOM 282 OG1 THR A 18 -4.338 19.464 -13.301 1.00 0.00 O ATOM 283 CG2 THR A 18 -4.222 21.213 -14.964 1.00 0.00 C ATOM 0 H THR A 18 -2.498 19.003 -15.018 1.00 0.00 H new ATOM 0 HA THR A 18 -1.734 21.518 -13.888 1.00 0.00 H new ATOM 0 HB THR A 18 -3.958 21.448 -12.856 1.00 0.00 H new ATOM 0 HG1 THR A 18 -5.311 19.582 -13.288 1.00 0.00 H new ATOM 0 HG21 THR A 18 -5.306 21.319 -14.922 1.00 0.00 H new ATOM 0 HG22 THR A 18 -3.771 22.180 -15.189 1.00 0.00 H new ATOM 0 HG23 THR A 18 -3.957 20.499 -15.744 1.00 0.00 H new ATOM 291 N PRO A 19 -1.587 21.001 -11.301 1.00 0.00 N ATOM 292 CA PRO A 19 -1.135 20.648 -9.948 1.00 0.00 C ATOM 293 C PRO A 19 -1.955 19.514 -9.334 1.00 0.00 C ATOM 294 O PRO A 19 -1.409 18.668 -8.640 1.00 0.00 O ATOM 295 CB PRO A 19 -1.313 21.956 -9.171 1.00 0.00 C ATOM 296 CG PRO A 19 -1.177 23.013 -10.211 1.00 0.00 C ATOM 297 CD PRO A 19 -1.842 22.451 -11.434 1.00 0.00 C ATOM 0 HA PRO A 19 -0.112 20.273 -9.936 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -2.286 22.000 -8.681 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -0.559 22.063 -8.392 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -1.654 23.940 -9.894 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -0.129 23.243 -10.403 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -2.909 22.675 -11.455 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -1.413 22.856 -12.351 1.00 0.00 H new ATOM 305 N ASN A 20 -3.261 19.501 -9.604 1.00 0.00 N ATOM 306 CA ASN A 20 -4.129 18.443 -9.075 1.00 0.00 C ATOM 307 C ASN A 20 -3.751 17.098 -9.689 1.00 0.00 C ATOM 308 O ASN A 20 -3.631 16.098 -8.987 1.00 0.00 O ATOM 309 CB ASN A 20 -5.608 18.735 -9.372 1.00 0.00 C ATOM 310 CG ASN A 20 -6.096 20.009 -8.709 1.00 0.00 C ATOM 311 OD1 ASN A 20 -6.486 20.960 -9.382 1.00 0.00 O ATOM 312 ND2 ASN A 20 -6.079 20.032 -7.383 1.00 0.00 N ATOM 0 H ASN A 20 -3.737 20.198 -10.176 1.00 0.00 H new ATOM 0 HA ASN A 20 -3.990 18.409 -7.994 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -5.750 18.814 -10.450 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -6.216 17.897 -9.031 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -6.398 20.862 -6.883 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -5.747 19.220 -6.863 1.00 0.00 H new ATOM 319 N SER A 21 -3.560 17.094 -11.013 1.00 0.00 N ATOM 320 CA SER A 21 -3.171 15.890 -11.742 1.00 0.00 C ATOM 321 C SER A 21 -1.779 15.430 -11.339 1.00 0.00 C ATOM 322 O SER A 21 -1.561 14.241 -11.121 1.00 0.00 O ATOM 323 CB SER A 21 -3.213 16.151 -13.249 1.00 0.00 C ATOM 324 OG SER A 21 -4.532 16.436 -13.686 1.00 0.00 O ATOM 0 H SER A 21 -3.670 17.920 -11.602 1.00 0.00 H new ATOM 0 HA SER A 21 -3.879 15.101 -11.491 1.00 0.00 H new ATOM 0 HB2 SER A 21 -2.558 16.987 -13.494 1.00 0.00 H new ATOM 0 HB3 SER A 21 -2.831 15.280 -13.782 1.00 0.00 H new ATOM 0 HG SER A 21 -4.691 17.402 -13.639 1.00 0.00 H new ATOM 330 N VAL A 22 -0.844 16.364 -11.236 1.00 0.00 N ATOM 331 CA VAL A 22 0.518 16.028 -10.843 1.00 0.00 C ATOM 332 C VAL A 22 0.557 15.502 -9.407 1.00 0.00 C ATOM 333 O VAL A 22 1.187 14.480 -9.127 1.00 0.00 O ATOM 334 CB VAL A 22 1.467 17.241 -10.988 1.00 0.00 C ATOM 335 CG1 VAL A 22 2.818 16.964 -10.348 1.00 0.00 C ATOM 336 CG2 VAL A 22 1.634 17.613 -12.453 1.00 0.00 C ATOM 0 H VAL A 22 -1.002 17.355 -11.418 1.00 0.00 H new ATOM 0 HA VAL A 22 0.864 15.243 -11.516 1.00 0.00 H new ATOM 0 HB VAL A 22 1.017 18.084 -10.464 1.00 0.00 H new ATOM 0 HG11 VAL A 22 3.462 17.835 -10.467 1.00 0.00 H new ATOM 0 HG12 VAL A 22 2.682 16.755 -9.287 1.00 0.00 H new ATOM 0 HG13 VAL A 22 3.280 16.103 -10.831 1.00 0.00 H new ATOM 0 HG21 VAL A 22 2.305 18.468 -12.537 1.00 0.00 H new ATOM 0 HG22 VAL A 22 2.054 16.767 -12.997 1.00 0.00 H new ATOM 0 HG23 VAL A 22 0.663 17.870 -12.876 1.00 0.00 H new ATOM 346 N ARG A 23 -0.140 16.197 -8.514 1.00 0.00 N ATOM 347 CA ARG A 23 -0.198 15.816 -7.107 1.00 0.00 C ATOM 348 C ARG A 23 -0.845 14.450 -6.949 1.00 0.00 C ATOM 349 O ARG A 23 -0.338 13.586 -6.230 1.00 0.00 O ATOM 350 CB ARG A 23 -1.016 16.851 -6.343 1.00 0.00 C ATOM 351 CG ARG A 23 -0.905 16.752 -4.834 1.00 0.00 C ATOM 352 CD ARG A 23 -1.241 18.079 -4.169 1.00 0.00 C ATOM 353 NE ARG A 23 -1.119 18.015 -2.713 1.00 0.00 N ATOM 354 CZ ARG A 23 0.037 18.114 -2.060 1.00 0.00 C ATOM 355 NH1 ARG A 23 1.170 18.278 -2.730 1.00 0.00 N ATOM 356 NH2 ARG A 23 0.058 18.051 -0.736 1.00 0.00 N ATOM 0 H ARG A 23 -0.677 17.034 -8.742 1.00 0.00 H new ATOM 0 HA ARG A 23 0.817 15.771 -6.712 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -0.699 17.847 -6.653 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -2.064 16.747 -6.625 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -1.579 15.978 -4.467 1.00 0.00 H new ATOM 0 HG3 ARG A 23 0.106 16.451 -4.560 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -0.578 18.854 -4.554 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -2.258 18.369 -4.434 1.00 0.00 H new ATOM 0 HE ARG A 23 -1.970 17.887 -2.165 1.00 0.00 H new ATOM 0 HH11 ARG A 23 1.157 18.329 -3.749 1.00 0.00 H new ATOM 0 HH12 ARG A 23 2.054 18.354 -2.227 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -0.812 17.927 -0.217 1.00 0.00 H new ATOM 0 HH22 ARG A 23 0.944 18.127 -0.236 1.00 0.00 H new ATOM 370 N ALA A 24 -1.972 14.266 -7.634 1.00 0.00 N ATOM 371 CA ALA A 24 -2.699 13.006 -7.575 1.00 0.00 C ATOM 372 C ALA A 24 -1.865 11.860 -8.147 1.00 0.00 C ATOM 373 O ALA A 24 -1.825 10.764 -7.587 1.00 0.00 O ATOM 374 CB ALA A 24 -4.021 13.113 -8.320 1.00 0.00 C ATOM 0 H ALA A 24 -2.398 14.973 -8.234 1.00 0.00 H new ATOM 0 HA ALA A 24 -2.903 12.790 -6.526 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -4.548 12.161 -8.264 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -4.632 13.894 -7.867 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -3.831 13.361 -9.364 1.00 0.00 H new ATOM 380 N LEU A 25 -1.204 12.136 -9.272 1.00 0.00 N ATOM 381 CA LEU A 25 -0.361 11.153 -9.949 1.00 0.00 C ATOM 382 C LEU A 25 0.796 10.698 -9.066 1.00 0.00 C ATOM 383 O LEU A 25 1.046 9.500 -8.943 1.00 0.00 O ATOM 384 CB LEU A 25 0.171 11.733 -11.266 1.00 0.00 C ATOM 385 CG LEU A 25 1.115 10.827 -12.057 1.00 0.00 C ATOM 386 CD1 LEU A 25 0.418 9.532 -12.450 1.00 0.00 C ATOM 387 CD2 LEU A 25 1.630 11.550 -13.293 1.00 0.00 C ATOM 0 H LEU A 25 -1.238 13.043 -9.737 1.00 0.00 H new ATOM 0 HA LEU A 25 -0.975 10.278 -10.163 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -0.679 11.983 -11.901 1.00 0.00 H new ATOM 0 HB3 LEU A 25 0.691 12.666 -11.047 1.00 0.00 H new ATOM 0 HG LEU A 25 1.964 10.577 -11.420 1.00 0.00 H new ATOM 0 HD11 LEU A 25 1.109 8.903 -13.012 1.00 0.00 H new ATOM 0 HD12 LEU A 25 0.096 9.005 -11.552 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -0.450 9.759 -13.068 1.00 0.00 H new ATOM 0 HD21 LEU A 25 2.301 10.893 -13.846 1.00 0.00 H new ATOM 0 HD22 LEU A 25 0.789 11.828 -13.928 1.00 0.00 H new ATOM 0 HD23 LEU A 25 2.169 12.448 -12.991 1.00 0.00 H new ATOM 399 N LYS A 26 1.496 11.646 -8.448 1.00 0.00 N ATOM 400 CA LYS A 26 2.622 11.308 -7.580 1.00 0.00 C ATOM 401 C LYS A 26 2.154 10.487 -6.382 1.00 0.00 C ATOM 402 O LYS A 26 2.809 9.525 -5.980 1.00 0.00 O ATOM 403 CB LYS A 26 3.330 12.570 -7.086 1.00 0.00 C ATOM 404 CG LYS A 26 4.101 13.308 -8.172 1.00 0.00 C ATOM 405 CD LYS A 26 4.956 14.425 -7.590 1.00 0.00 C ATOM 406 CE LYS A 26 4.104 15.559 -7.039 1.00 0.00 C ATOM 407 NZ LYS A 26 4.936 16.684 -6.529 1.00 0.00 N ATOM 0 H LYS A 26 1.307 12.645 -8.530 1.00 0.00 H new ATOM 0 HA LYS A 26 3.324 10.716 -8.167 1.00 0.00 H new ATOM 0 HB2 LYS A 26 2.590 13.245 -6.656 1.00 0.00 H new ATOM 0 HB3 LYS A 26 4.018 12.299 -6.285 1.00 0.00 H new ATOM 0 HG2 LYS A 26 4.737 12.605 -8.710 1.00 0.00 H new ATOM 0 HG3 LYS A 26 3.402 13.724 -8.897 1.00 0.00 H new ATOM 0 HD2 LYS A 26 5.586 14.025 -6.796 1.00 0.00 H new ATOM 0 HD3 LYS A 26 5.622 14.812 -8.361 1.00 0.00 H new ATOM 0 HE2 LYS A 26 3.439 15.925 -7.821 1.00 0.00 H new ATOM 0 HE3 LYS A 26 3.473 15.181 -6.235 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 4.317 17.435 -6.163 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 5.553 16.341 -5.765 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 5.520 17.062 -7.302 1.00 0.00 H new ATOM 421 N THR A 27 1.013 10.878 -5.823 1.00 0.00 N ATOM 422 CA THR A 27 0.437 10.200 -4.668 1.00 0.00 C ATOM 423 C THR A 27 0.013 8.767 -4.995 1.00 0.00 C ATOM 424 O THR A 27 0.370 7.830 -4.283 1.00 0.00 O ATOM 425 CB THR A 27 -0.782 10.996 -4.157 1.00 0.00 C ATOM 426 OG1 THR A 27 -0.375 12.320 -3.792 1.00 0.00 O ATOM 427 CG2 THR A 27 -1.422 10.326 -2.957 1.00 0.00 C ATOM 0 H THR A 27 0.464 11.670 -6.157 1.00 0.00 H new ATOM 0 HA THR A 27 1.205 10.149 -3.897 1.00 0.00 H new ATOM 0 HB THR A 27 -1.516 11.034 -4.962 1.00 0.00 H new ATOM 0 HG1 THR A 27 -0.338 12.883 -4.593 1.00 0.00 H new ATOM 0 HG21 THR A 27 -2.277 10.915 -2.625 1.00 0.00 H new ATOM 0 HG22 THR A 27 -1.756 9.326 -3.234 1.00 0.00 H new ATOM 0 HG23 THR A 27 -0.694 10.255 -2.149 1.00 0.00 H new ATOM 435 N LEU A 28 -0.732 8.599 -6.086 1.00 0.00 N ATOM 436 CA LEU A 28 -1.223 7.279 -6.477 1.00 0.00 C ATOM 437 C LEU A 28 -0.098 6.350 -6.938 1.00 0.00 C ATOM 438 O LEU A 28 -0.031 5.194 -6.516 1.00 0.00 O ATOM 439 CB LEU A 28 -2.263 7.422 -7.596 1.00 0.00 C ATOM 440 CG LEU A 28 -2.912 6.116 -8.072 1.00 0.00 C ATOM 441 CD1 LEU A 28 -3.716 5.474 -6.953 1.00 0.00 C ATOM 442 CD2 LEU A 28 -3.796 6.372 -9.278 1.00 0.00 C ATOM 0 H LEU A 28 -1.008 9.356 -6.712 1.00 0.00 H new ATOM 0 HA LEU A 28 -1.678 6.829 -5.595 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -3.050 8.093 -7.252 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -1.786 7.902 -8.451 1.00 0.00 H new ATOM 0 HG LEU A 28 -2.118 5.427 -8.362 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -4.167 4.549 -7.313 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -3.058 5.253 -6.113 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -4.500 6.158 -6.630 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -4.249 5.435 -9.603 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -4.580 7.080 -9.011 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -3.195 6.785 -10.088 1.00 0.00 H new ATOM 454 N ALA A 29 0.788 6.864 -7.797 1.00 0.00 N ATOM 455 CA ALA A 29 1.884 6.064 -8.344 1.00 0.00 C ATOM 456 C ALA A 29 2.859 5.570 -7.282 1.00 0.00 C ATOM 457 O ALA A 29 3.234 4.403 -7.292 1.00 0.00 O ATOM 458 CB ALA A 29 2.635 6.857 -9.404 1.00 0.00 C ATOM 0 H ALA A 29 0.766 7.829 -8.127 1.00 0.00 H new ATOM 0 HA ALA A 29 1.427 5.180 -8.789 1.00 0.00 H new ATOM 0 HB1 ALA A 29 3.448 6.251 -9.804 1.00 0.00 H new ATOM 0 HB2 ALA A 29 1.952 7.125 -10.210 1.00 0.00 H new ATOM 0 HB3 ALA A 29 3.043 7.764 -8.958 1.00 0.00 H new ATOM 464 N ASN A 30 3.251 6.440 -6.357 1.00 0.00 N ATOM 465 CA ASN A 30 4.204 6.049 -5.316 1.00 0.00 C ATOM 466 C ASN A 30 3.605 4.988 -4.403 1.00 0.00 C ATOM 467 O ASN A 30 4.286 4.038 -4.016 1.00 0.00 O ATOM 468 CB ASN A 30 4.660 7.264 -4.503 1.00 0.00 C ATOM 469 CG ASN A 30 5.870 6.963 -3.640 1.00 0.00 C ATOM 470 OD1 ASN A 30 6.783 6.251 -4.056 1.00 0.00 O ATOM 471 ND2 ASN A 30 5.887 7.507 -2.429 1.00 0.00 N ATOM 0 H ASN A 30 2.931 7.407 -6.303 1.00 0.00 H new ATOM 0 HA ASN A 30 5.079 5.623 -5.808 1.00 0.00 H new ATOM 0 HB2 ASN A 30 4.896 8.084 -5.182 1.00 0.00 H new ATOM 0 HB3 ASN A 30 3.840 7.602 -3.869 1.00 0.00 H new ATOM 0 HD21 ASN A 30 6.677 7.340 -1.806 1.00 0.00 H new ATOM 0 HD22 ASN A 30 5.110 8.092 -2.122 1.00 0.00 H new ATOM 478 N ILE A 31 2.337 5.148 -4.056 1.00 0.00 N ATOM 479 CA ILE A 31 1.665 4.179 -3.210 1.00 0.00 C ATOM 480 C ILE A 31 1.573 2.822 -3.912 1.00 0.00 C ATOM 481 O ILE A 31 1.838 1.783 -3.316 1.00 0.00 O ATOM 482 CB ILE A 31 0.287 4.690 -2.756 1.00 0.00 C ATOM 483 CG1 ILE A 31 0.495 5.820 -1.751 1.00 0.00 C ATOM 484 CG2 ILE A 31 -0.561 3.578 -2.160 1.00 0.00 C ATOM 485 CD1 ILE A 31 -0.762 6.567 -1.406 1.00 0.00 C ATOM 0 H ILE A 31 1.757 5.935 -4.346 1.00 0.00 H new ATOM 0 HA ILE A 31 2.261 4.042 -2.308 1.00 0.00 H new ATOM 0 HB ILE A 31 -0.258 5.062 -3.624 1.00 0.00 H new ATOM 0 HG12 ILE A 31 0.923 5.407 -0.838 1.00 0.00 H new ATOM 0 HG13 ILE A 31 1.224 6.522 -2.155 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -1.526 3.981 -1.852 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -0.715 2.798 -2.906 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -0.051 3.156 -1.294 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -0.532 7.353 -0.687 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -1.180 7.012 -2.309 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -1.487 5.879 -0.971 1.00 0.00 H new ATOM 497 N LEU A 32 1.208 2.841 -5.186 1.00 0.00 N ATOM 498 CA LEU A 32 1.104 1.615 -5.976 1.00 0.00 C ATOM 499 C LEU A 32 2.471 0.975 -6.254 1.00 0.00 C ATOM 500 O LEU A 32 2.577 -0.244 -6.327 1.00 0.00 O ATOM 501 CB LEU A 32 0.358 1.878 -7.284 1.00 0.00 C ATOM 502 CG LEU A 32 -1.143 2.134 -7.125 1.00 0.00 C ATOM 503 CD1 LEU A 32 -1.742 2.627 -8.433 1.00 0.00 C ATOM 504 CD2 LEU A 32 -1.846 0.869 -6.666 1.00 0.00 C ATOM 0 H LEU A 32 0.978 3.692 -5.699 1.00 0.00 H new ATOM 0 HA LEU A 32 0.535 0.902 -5.380 1.00 0.00 H new ATOM 0 HB2 LEU A 32 0.809 2.739 -7.777 1.00 0.00 H new ATOM 0 HB3 LEU A 32 0.499 1.023 -7.945 1.00 0.00 H new ATOM 0 HG LEU A 32 -1.284 2.907 -6.369 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -2.809 2.804 -8.301 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -1.255 3.556 -8.729 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -1.592 1.875 -9.208 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -2.913 1.065 -6.557 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -1.695 0.081 -7.404 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -1.435 0.552 -5.707 1.00 0.00 H new ATOM 516 N GLU A 33 3.509 1.792 -6.431 1.00 0.00 N ATOM 517 CA GLU A 33 4.851 1.271 -6.720 1.00 0.00 C ATOM 518 C GLU A 33 5.595 0.823 -5.461 1.00 0.00 C ATOM 519 O GLU A 33 6.643 0.186 -5.556 1.00 0.00 O ATOM 520 CB GLU A 33 5.698 2.317 -7.452 1.00 0.00 C ATOM 521 CG GLU A 33 5.134 2.736 -8.800 1.00 0.00 C ATOM 522 CD GLU A 33 6.037 3.703 -9.538 1.00 0.00 C ATOM 523 OE1 GLU A 33 7.199 3.338 -9.812 1.00 0.00 O ATOM 524 OE2 GLU A 33 5.582 4.826 -9.841 1.00 0.00 O ATOM 0 H GLU A 33 3.451 2.809 -6.381 1.00 0.00 H new ATOM 0 HA GLU A 33 4.704 0.398 -7.356 1.00 0.00 H new ATOM 0 HB2 GLU A 33 5.793 3.200 -6.819 1.00 0.00 H new ATOM 0 HB3 GLU A 33 6.702 1.919 -7.598 1.00 0.00 H new ATOM 0 HG2 GLU A 33 4.978 1.850 -9.415 1.00 0.00 H new ATOM 0 HG3 GLU A 33 4.158 3.198 -8.653 1.00 0.00 H new ATOM 531 N LYS A 34 5.081 1.166 -4.287 1.00 0.00 N ATOM 532 CA LYS A 34 5.739 0.776 -3.043 1.00 0.00 C ATOM 533 C LYS A 34 4.809 -0.044 -2.150 1.00 0.00 C ATOM 534 O LYS A 34 5.088 -1.204 -1.846 1.00 0.00 O ATOM 535 CB LYS A 34 6.230 2.022 -2.296 1.00 0.00 C ATOM 536 CG LYS A 34 6.965 1.717 -0.997 1.00 0.00 C ATOM 537 CD LYS A 34 8.266 0.971 -1.249 1.00 0.00 C ATOM 538 CE LYS A 34 9.037 0.752 0.042 1.00 0.00 C ATOM 539 NZ LYS A 34 10.313 0.022 -0.189 1.00 0.00 N ATOM 0 H LYS A 34 4.223 1.705 -4.168 1.00 0.00 H new ATOM 0 HA LYS A 34 6.593 0.148 -3.297 1.00 0.00 H new ATOM 0 HB2 LYS A 34 6.892 2.589 -2.951 1.00 0.00 H new ATOM 0 HB3 LYS A 34 5.375 2.661 -2.076 1.00 0.00 H new ATOM 0 HG2 LYS A 34 7.175 2.648 -0.471 1.00 0.00 H new ATOM 0 HG3 LYS A 34 6.324 1.121 -0.347 1.00 0.00 H new ATOM 0 HD2 LYS A 34 8.052 0.009 -1.714 1.00 0.00 H new ATOM 0 HD3 LYS A 34 8.881 1.535 -1.951 1.00 0.00 H new ATOM 0 HE2 LYS A 34 9.249 1.715 0.506 1.00 0.00 H new ATOM 0 HE3 LYS A 34 8.419 0.190 0.743 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 10.808 -0.107 0.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 10.110 -0.908 -0.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 10.914 0.570 -0.837 1.00 0.00 H new ATOM 553 N GLU A 35 3.704 0.569 -1.740 1.00 0.00 N ATOM 554 CA GLU A 35 2.727 -0.075 -0.862 1.00 0.00 C ATOM 555 C GLU A 35 2.049 -1.279 -1.525 1.00 0.00 C ATOM 556 O GLU A 35 1.830 -2.304 -0.880 1.00 0.00 O ATOM 557 CB GLU A 35 1.671 0.951 -0.427 1.00 0.00 C ATOM 558 CG GLU A 35 2.204 2.003 0.537 1.00 0.00 C ATOM 559 CD GLU A 35 2.736 1.408 1.827 1.00 0.00 C ATOM 560 OE1 GLU A 35 2.017 0.599 2.449 1.00 0.00 O ATOM 561 OE2 GLU A 35 3.872 1.752 2.213 1.00 0.00 O ATOM 0 H GLU A 35 3.458 1.523 -2.004 1.00 0.00 H new ATOM 0 HA GLU A 35 3.264 -0.450 0.009 1.00 0.00 H new ATOM 0 HB2 GLU A 35 1.274 1.449 -1.312 1.00 0.00 H new ATOM 0 HB3 GLU A 35 0.839 0.427 0.044 1.00 0.00 H new ATOM 0 HG2 GLU A 35 2.999 2.567 0.048 1.00 0.00 H new ATOM 0 HG3 GLU A 35 1.408 2.711 0.770 1.00 0.00 H new ATOM 568 N PHE A 36 1.716 -1.155 -2.806 1.00 0.00 N ATOM 569 CA PHE A 36 1.046 -2.240 -3.526 1.00 0.00 C ATOM 570 C PHE A 36 1.861 -2.716 -4.726 1.00 0.00 C ATOM 571 O PHE A 36 1.295 -3.166 -5.729 1.00 0.00 O ATOM 572 CB PHE A 36 -0.349 -1.799 -3.976 1.00 0.00 C ATOM 573 CG PHE A 36 -1.253 -1.436 -2.833 1.00 0.00 C ATOM 574 CD1 PHE A 36 -1.381 -0.119 -2.427 1.00 0.00 C ATOM 575 CD2 PHE A 36 -1.965 -2.413 -2.157 1.00 0.00 C ATOM 576 CE1 PHE A 36 -2.200 0.218 -1.369 1.00 0.00 C ATOM 577 CE2 PHE A 36 -2.788 -2.082 -1.099 1.00 0.00 C ATOM 578 CZ PHE A 36 -2.904 -0.765 -0.703 1.00 0.00 C ATOM 0 H PHE A 36 1.896 -0.322 -3.366 1.00 0.00 H new ATOM 0 HA PHE A 36 0.952 -3.080 -2.837 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -0.254 -0.942 -4.642 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -0.808 -2.602 -4.553 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -0.833 0.654 -2.945 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -1.875 -3.445 -2.461 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -2.290 1.250 -1.062 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -3.340 -2.853 -0.582 1.00 0.00 H new ATOM 0 HZ PHE A 36 -3.544 -0.504 0.127 1.00 0.00 H new ATOM 588 N LYS A 37 3.184 -2.602 -4.627 1.00 0.00 N ATOM 589 CA LYS A 37 4.079 -3.016 -5.708 1.00 0.00 C ATOM 590 C LYS A 37 3.870 -4.482 -6.085 1.00 0.00 C ATOM 591 O LYS A 37 3.893 -5.368 -5.229 1.00 0.00 O ATOM 592 CB LYS A 37 5.540 -2.791 -5.303 1.00 0.00 C ATOM 593 CG LYS A 37 6.546 -3.183 -6.377 1.00 0.00 C ATOM 594 CD LYS A 37 6.448 -2.283 -7.600 1.00 0.00 C ATOM 595 CE LYS A 37 7.497 -2.641 -8.642 1.00 0.00 C ATOM 596 NZ LYS A 37 8.880 -2.473 -8.117 1.00 0.00 N ATOM 0 H LYS A 37 3.662 -2.226 -3.808 1.00 0.00 H new ATOM 0 HA LYS A 37 3.843 -2.406 -6.580 1.00 0.00 H new ATOM 0 HB2 LYS A 37 5.680 -1.739 -5.055 1.00 0.00 H new ATOM 0 HB3 LYS A 37 5.748 -3.362 -4.398 1.00 0.00 H new ATOM 0 HG2 LYS A 37 7.554 -3.130 -5.967 1.00 0.00 H new ATOM 0 HG3 LYS A 37 6.376 -4.218 -6.673 1.00 0.00 H new ATOM 0 HD2 LYS A 37 5.454 -2.370 -8.038 1.00 0.00 H new ATOM 0 HD3 LYS A 37 6.573 -1.243 -7.299 1.00 0.00 H new ATOM 0 HE2 LYS A 37 7.353 -3.673 -8.963 1.00 0.00 H new ATOM 0 HE3 LYS A 37 7.364 -2.012 -9.522 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 9.553 -2.459 -8.910 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 8.946 -1.578 -7.592 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 9.109 -3.264 -7.482 1.00 0.00 H new ATOM 610 N GLY A 38 3.669 -4.722 -7.378 1.00 0.00 N ATOM 611 CA GLY A 38 3.472 -6.073 -7.870 1.00 0.00 C ATOM 612 C GLY A 38 2.037 -6.556 -7.759 1.00 0.00 C ATOM 613 O GLY A 38 1.727 -7.670 -8.175 1.00 0.00 O ATOM 0 H GLY A 38 3.639 -3.999 -8.097 1.00 0.00 H new ATOM 0 HA2 GLY A 38 3.783 -6.120 -8.914 1.00 0.00 H new ATOM 0 HA3 GLY A 38 4.119 -6.751 -7.314 1.00 0.00 H new ATOM 617 N VAL A 39 1.155 -5.728 -7.204 1.00 0.00 N ATOM 618 CA VAL A 39 -0.242 -6.118 -7.061 1.00 0.00 C ATOM 619 C VAL A 39 -1.145 -5.325 -8.008 1.00 0.00 C ATOM 620 O VAL A 39 -2.054 -5.890 -8.620 1.00 0.00 O ATOM 621 CB VAL A 39 -0.746 -5.964 -5.607 1.00 0.00 C ATOM 622 CG1 VAL A 39 -2.157 -6.518 -5.460 1.00 0.00 C ATOM 623 CG2 VAL A 39 0.204 -6.650 -4.634 1.00 0.00 C ATOM 0 H VAL A 39 1.379 -4.797 -6.851 1.00 0.00 H new ATOM 0 HA VAL A 39 -0.293 -7.174 -7.327 1.00 0.00 H new ATOM 0 HB VAL A 39 -0.773 -4.901 -5.369 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -2.489 -6.398 -4.429 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -2.831 -5.977 -6.124 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -2.162 -7.576 -5.722 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -0.168 -6.530 -3.617 1.00 0.00 H new ATOM 0 HG22 VAL A 39 0.267 -7.711 -4.875 1.00 0.00 H new ATOM 0 HG23 VAL A 39 1.194 -6.200 -4.714 1.00 0.00 H new ATOM 633 N TYR A 40 -0.902 -4.023 -8.139 1.00 0.00 N ATOM 634 CA TYR A 40 -1.736 -3.211 -9.024 1.00 0.00 C ATOM 635 C TYR A 40 -0.950 -2.643 -10.198 1.00 0.00 C ATOM 636 O TYR A 40 0.223 -2.289 -10.070 1.00 0.00 O ATOM 637 CB TYR A 40 -2.383 -2.046 -8.278 1.00 0.00 C ATOM 638 CG TYR A 40 -3.617 -2.373 -7.478 1.00 0.00 C ATOM 639 CD1 TYR A 40 -3.528 -2.946 -6.218 1.00 0.00 C ATOM 640 CD2 TYR A 40 -4.872 -2.059 -7.973 1.00 0.00 C ATOM 641 CE1 TYR A 40 -4.661 -3.201 -5.477 1.00 0.00 C ATOM 642 CE2 TYR A 40 -6.009 -2.317 -7.241 1.00 0.00 C ATOM 643 CZ TYR A 40 -5.899 -2.885 -5.996 1.00 0.00 C ATOM 644 OH TYR A 40 -7.029 -3.127 -5.264 1.00 0.00 O ATOM 0 H TYR A 40 -0.157 -3.518 -7.659 1.00 0.00 H new ATOM 0 HA TYR A 40 -2.506 -3.885 -9.399 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -1.642 -1.616 -7.604 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -2.639 -1.274 -9.004 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -2.558 -3.195 -5.813 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -4.960 -1.605 -8.949 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -4.580 -3.645 -4.496 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -6.981 -2.074 -7.644 1.00 0.00 H new ATOM 0 HH TYR A 40 -7.813 -3.091 -5.851 1.00 0.00 H new ATOM 654 N ALA A 41 -1.617 -2.562 -11.341 1.00 0.00 N ATOM 655 CA ALA A 41 -1.034 -1.983 -12.538 1.00 0.00 C ATOM 656 C ALA A 41 -1.660 -0.608 -12.765 1.00 0.00 C ATOM 657 O ALA A 41 -2.886 -0.489 -12.832 1.00 0.00 O ATOM 658 CB ALA A 41 -1.264 -2.889 -13.740 1.00 0.00 C ATOM 0 H ALA A 41 -2.573 -2.895 -11.462 1.00 0.00 H new ATOM 0 HA ALA A 41 0.043 -1.878 -12.411 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -0.819 -2.437 -14.627 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -0.803 -3.860 -13.558 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -2.335 -3.020 -13.897 1.00 0.00 H new ATOM 664 N LEU A 42 -0.835 0.427 -12.871 1.00 0.00 N ATOM 665 CA LEU A 42 -1.352 1.782 -13.047 1.00 0.00 C ATOM 666 C LEU A 42 -1.402 2.201 -14.514 1.00 0.00 C ATOM 667 O LEU A 42 -0.423 2.072 -15.252 1.00 0.00 O ATOM 668 CB LEU A 42 -0.520 2.787 -12.240 1.00 0.00 C ATOM 669 CG LEU A 42 -0.961 4.251 -12.364 1.00 0.00 C ATOM 670 CD1 LEU A 42 -2.386 4.431 -11.863 1.00 0.00 C ATOM 671 CD2 LEU A 42 -0.010 5.160 -11.601 1.00 0.00 C ATOM 0 H LEU A 42 0.182 0.358 -12.839 1.00 0.00 H new ATOM 0 HA LEU A 42 -2.376 1.780 -12.674 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -0.555 2.502 -11.189 1.00 0.00 H new ATOM 0 HB3 LEU A 42 0.520 2.710 -12.556 1.00 0.00 H new ATOM 0 HG LEU A 42 -0.933 4.527 -13.418 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -2.677 5.477 -11.961 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -3.060 3.810 -12.453 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -2.444 4.135 -10.816 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -0.338 6.195 -11.700 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -0.005 4.880 -10.548 1.00 0.00 H new ATOM 0 HD23 LEU A 42 0.996 5.058 -12.008 1.00 0.00 H new ATOM 683 N LYS A 43 -2.562 2.707 -14.913 1.00 0.00 N ATOM 684 CA LYS A 43 -2.793 3.177 -16.266 1.00 0.00 C ATOM 685 C LYS A 43 -3.352 4.593 -16.216 1.00 0.00 C ATOM 686 O LYS A 43 -4.449 4.823 -15.723 1.00 0.00 O ATOM 687 CB LYS A 43 -3.768 2.257 -17.001 1.00 0.00 C ATOM 688 CG LYS A 43 -3.127 1.427 -18.097 1.00 0.00 C ATOM 689 CD LYS A 43 -2.643 0.082 -17.581 1.00 0.00 C ATOM 690 CE LYS A 43 -2.400 -0.889 -18.723 1.00 0.00 C ATOM 691 NZ LYS A 43 -1.207 -0.511 -19.530 1.00 0.00 N ATOM 0 H LYS A 43 -3.372 2.802 -14.300 1.00 0.00 H new ATOM 0 HA LYS A 43 -1.847 3.173 -16.808 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -4.235 1.588 -16.278 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -4.564 2.861 -17.436 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -3.846 1.270 -18.901 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -2.287 1.976 -18.524 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -1.723 0.217 -17.013 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -3.382 -0.335 -16.896 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -2.264 -1.894 -18.322 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -3.279 -0.919 -19.367 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -1.076 -1.199 -20.299 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -1.347 0.437 -19.934 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -0.363 -0.507 -18.922 1.00 0.00 H new ATOM 705 N VAL A 44 -2.584 5.534 -16.721 1.00 0.00 N ATOM 706 CA VAL A 44 -2.982 6.934 -16.732 1.00 0.00 C ATOM 707 C VAL A 44 -3.461 7.347 -18.113 1.00 0.00 C ATOM 708 O VAL A 44 -2.782 7.137 -19.120 1.00 0.00 O ATOM 709 CB VAL A 44 -1.814 7.825 -16.268 1.00 0.00 C ATOM 710 CG1 VAL A 44 -2.172 9.302 -16.354 1.00 0.00 C ATOM 711 CG2 VAL A 44 -1.403 7.458 -14.849 1.00 0.00 C ATOM 0 H VAL A 44 -1.669 5.356 -17.135 1.00 0.00 H new ATOM 0 HA VAL A 44 -3.811 7.063 -16.037 1.00 0.00 H new ATOM 0 HB VAL A 44 -0.972 7.649 -16.937 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -1.326 9.902 -16.019 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -2.413 9.559 -17.386 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -3.034 9.505 -15.719 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -0.577 8.095 -14.533 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -2.249 7.601 -14.177 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -1.089 6.415 -14.820 1.00 0.00 H new ATOM 721 N ILE A 45 -4.650 7.936 -18.138 1.00 0.00 N ATOM 722 CA ILE A 45 -5.287 8.363 -19.364 1.00 0.00 C ATOM 723 C ILE A 45 -5.304 9.888 -19.437 1.00 0.00 C ATOM 724 O ILE A 45 -5.931 10.545 -18.601 1.00 0.00 O ATOM 725 CB ILE A 45 -6.746 7.845 -19.387 1.00 0.00 C ATOM 726 CG1 ILE A 45 -6.793 6.338 -19.092 1.00 0.00 C ATOM 727 CG2 ILE A 45 -7.441 8.157 -20.712 1.00 0.00 C ATOM 728 CD1 ILE A 45 -6.029 5.479 -20.074 1.00 0.00 C ATOM 0 H ILE A 45 -5.198 8.129 -17.300 1.00 0.00 H new ATOM 0 HA ILE A 45 -4.732 7.964 -20.213 1.00 0.00 H new ATOM 0 HB ILE A 45 -7.289 8.371 -18.602 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -6.395 6.165 -18.092 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -7.834 6.016 -19.081 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -8.462 7.776 -20.686 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -7.460 9.236 -20.868 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -6.898 7.682 -21.529 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -6.118 4.431 -19.787 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -6.439 5.617 -21.074 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -4.978 5.768 -20.070 1.00 0.00 H new ATOM 740 N ASP A 46 -4.608 10.458 -20.417 1.00 0.00 N ATOM 741 CA ASP A 46 -4.583 11.907 -20.572 1.00 0.00 C ATOM 742 C ASP A 46 -5.773 12.330 -21.425 1.00 0.00 C ATOM 743 O ASP A 46 -5.746 12.197 -22.651 1.00 0.00 O ATOM 744 CB ASP A 46 -3.272 12.357 -21.224 1.00 0.00 C ATOM 745 CG ASP A 46 -3.069 13.864 -21.161 1.00 0.00 C ATOM 746 OD1 ASP A 46 -4.071 14.610 -21.090 1.00 0.00 O ATOM 747 OD2 ASP A 46 -1.900 14.298 -21.162 1.00 0.00 O ATOM 0 H ASP A 46 -4.060 9.945 -21.108 1.00 0.00 H new ATOM 0 HA ASP A 46 -4.648 12.379 -19.591 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -2.437 11.861 -20.729 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -3.261 12.037 -22.266 1.00 0.00 H new ATOM 752 N VAL A 47 -6.806 12.843 -20.774 1.00 0.00 N ATOM 753 CA VAL A 47 -8.028 13.246 -21.467 1.00 0.00 C ATOM 754 C VAL A 47 -7.828 14.422 -22.436 1.00 0.00 C ATOM 755 O VAL A 47 -8.505 14.493 -23.461 1.00 0.00 O ATOM 756 CB VAL A 47 -9.155 13.578 -20.463 1.00 0.00 C ATOM 757 CG1 VAL A 47 -9.437 12.378 -19.567 1.00 0.00 C ATOM 758 CG2 VAL A 47 -8.808 14.801 -19.624 1.00 0.00 C ATOM 0 H VAL A 47 -6.826 12.992 -19.765 1.00 0.00 H new ATOM 0 HA VAL A 47 -8.318 12.385 -22.070 1.00 0.00 H new ATOM 0 HB VAL A 47 -10.055 13.810 -21.033 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -10.233 12.627 -18.865 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -9.745 11.531 -20.180 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -8.535 12.117 -19.014 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -9.621 15.008 -18.928 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -7.892 14.611 -19.065 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -8.662 15.661 -20.277 1.00 0.00 H new ATOM 768 N LEU A 48 -6.918 15.345 -22.122 1.00 0.00 N ATOM 769 CA LEU A 48 -6.677 16.495 -23.002 1.00 0.00 C ATOM 770 C LEU A 48 -5.984 16.098 -24.306 1.00 0.00 C ATOM 771 O LEU A 48 -6.305 16.635 -25.366 1.00 0.00 O ATOM 772 CB LEU A 48 -5.878 17.594 -22.297 1.00 0.00 C ATOM 773 CG LEU A 48 -6.636 18.347 -21.202 1.00 0.00 C ATOM 774 CD1 LEU A 48 -5.715 19.329 -20.495 1.00 0.00 C ATOM 775 CD2 LEU A 48 -7.840 19.073 -21.785 1.00 0.00 C ATOM 0 H LEU A 48 -6.343 15.323 -21.280 1.00 0.00 H new ATOM 0 HA LEU A 48 -7.661 16.890 -23.254 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -4.985 17.148 -21.858 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -5.541 18.313 -23.044 1.00 0.00 H new ATOM 0 HG LEU A 48 -6.993 17.621 -20.472 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -6.271 19.856 -19.719 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -4.885 18.787 -20.042 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -5.328 20.049 -21.216 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -8.366 19.602 -20.990 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -7.505 19.787 -22.537 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -8.513 18.350 -22.246 1.00 0.00 H new ATOM 787 N LYS A 49 -5.030 15.173 -24.229 1.00 0.00 N ATOM 788 CA LYS A 49 -4.307 14.732 -25.423 1.00 0.00 C ATOM 789 C LYS A 49 -5.192 13.899 -26.340 1.00 0.00 C ATOM 790 O LYS A 49 -5.100 14.001 -27.563 1.00 0.00 O ATOM 791 CB LYS A 49 -3.045 13.952 -25.063 1.00 0.00 C ATOM 792 CG LYS A 49 -1.947 14.817 -24.468 1.00 0.00 C ATOM 793 CD LYS A 49 -0.703 14.001 -24.171 1.00 0.00 C ATOM 794 CE LYS A 49 0.406 14.865 -23.592 1.00 0.00 C ATOM 795 NZ LYS A 49 1.630 14.072 -23.292 1.00 0.00 N ATOM 0 H LYS A 49 -4.741 14.718 -23.363 1.00 0.00 H new ATOM 0 HA LYS A 49 -4.011 15.634 -25.958 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -3.303 13.167 -24.353 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -2.664 13.460 -25.958 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -1.700 15.622 -25.160 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -2.306 15.284 -23.551 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -0.949 13.204 -23.469 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -0.353 13.523 -25.086 1.00 0.00 H new ATOM 0 HE2 LYS A 49 0.652 15.660 -24.296 1.00 0.00 H new ATOM 0 HE3 LYS A 49 0.053 15.346 -22.680 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 2.362 14.698 -22.899 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 1.402 13.330 -22.600 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 1.983 13.634 -24.167 1.00 0.00 H new ATOM 809 N ASN A 50 -6.046 13.069 -25.754 1.00 0.00 N ATOM 810 CA ASN A 50 -6.938 12.236 -26.548 1.00 0.00 C ATOM 811 C ASN A 50 -8.368 12.384 -26.069 1.00 0.00 C ATOM 812 O ASN A 50 -8.843 11.610 -25.235 1.00 0.00 O ATOM 813 CB ASN A 50 -6.530 10.770 -26.475 1.00 0.00 C ATOM 814 CG ASN A 50 -7.124 9.944 -27.603 1.00 0.00 C ATOM 815 OD1 ASN A 50 -8.322 10.006 -27.871 1.00 0.00 O ATOM 816 ND2 ASN A 50 -6.283 9.170 -28.276 1.00 0.00 N ATOM 0 H ASN A 50 -6.139 12.956 -24.745 1.00 0.00 H new ATOM 0 HA ASN A 50 -6.866 12.569 -27.583 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -5.443 10.697 -26.509 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -6.848 10.355 -25.519 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -6.624 8.597 -29.048 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -5.296 9.148 -28.021 1.00 0.00 H new ATOM 823 N PRO A 51 -9.063 13.394 -26.594 1.00 0.00 N ATOM 824 CA PRO A 51 -10.454 13.672 -26.236 1.00 0.00 C ATOM 825 C PRO A 51 -11.390 12.521 -26.587 1.00 0.00 C ATOM 826 O PRO A 51 -12.416 12.324 -25.937 1.00 0.00 O ATOM 827 CB PRO A 51 -10.789 14.925 -27.056 1.00 0.00 C ATOM 828 CG PRO A 51 -9.462 15.517 -27.389 1.00 0.00 C ATOM 829 CD PRO A 51 -8.557 14.349 -27.591 1.00 0.00 C ATOM 0 HA PRO A 51 -10.580 13.809 -25.162 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -11.349 14.672 -27.957 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -11.403 15.621 -26.484 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -9.519 16.132 -28.287 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -9.104 16.159 -26.585 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -8.622 13.953 -28.605 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -7.513 14.607 -27.416 1.00 0.00 H new ATOM 837 N GLN A 52 -11.027 11.767 -27.624 1.00 0.00 N ATOM 838 CA GLN A 52 -11.827 10.633 -28.074 1.00 0.00 C ATOM 839 C GLN A 52 -11.918 9.579 -26.988 1.00 0.00 C ATOM 840 O GLN A 52 -12.995 9.054 -26.719 1.00 0.00 O ATOM 841 CB GLN A 52 -11.217 10.007 -29.332 1.00 0.00 C ATOM 842 CG GLN A 52 -12.072 8.908 -29.946 1.00 0.00 C ATOM 843 CD GLN A 52 -11.454 8.312 -31.193 1.00 0.00 C ATOM 844 OE1 GLN A 52 -10.881 9.022 -32.018 1.00 0.00 O ATOM 845 NE2 GLN A 52 -11.563 6.997 -31.338 1.00 0.00 N ATOM 0 H GLN A 52 -10.179 11.924 -28.169 1.00 0.00 H new ATOM 0 HA GLN A 52 -12.827 11.001 -28.304 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -11.057 10.788 -30.075 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -10.238 9.597 -29.085 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -12.226 8.119 -29.210 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -13.054 9.312 -30.190 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -12.046 6.444 -30.630 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -11.163 6.539 -32.157 1.00 0.00 H new ATOM 854 N LEU A 53 -10.792 9.295 -26.345 1.00 0.00 N ATOM 855 CA LEU A 53 -10.770 8.287 -25.298 1.00 0.00 C ATOM 856 C LEU A 53 -11.518 8.786 -24.075 1.00 0.00 C ATOM 857 O LEU A 53 -12.195 8.015 -23.391 1.00 0.00 O ATOM 858 CB LEU A 53 -9.341 7.880 -24.951 1.00 0.00 C ATOM 859 CG LEU A 53 -8.614 7.143 -26.071 1.00 0.00 C ATOM 860 CD1 LEU A 53 -7.155 6.913 -25.708 1.00 0.00 C ATOM 861 CD2 LEU A 53 -9.304 5.826 -26.386 1.00 0.00 C ATOM 0 H LEU A 53 -9.894 9.743 -26.528 1.00 0.00 H new ATOM 0 HA LEU A 53 -11.276 7.395 -25.667 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -8.773 8.773 -24.690 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -9.360 7.245 -24.065 1.00 0.00 H new ATOM 0 HG LEU A 53 -8.647 7.767 -26.964 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -6.656 6.386 -26.521 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -6.665 7.873 -25.544 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -7.096 6.315 -24.798 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -8.769 5.317 -27.188 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -9.309 5.196 -25.496 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -10.330 6.019 -26.700 1.00 0.00 H new ATOM 873 N ALA A 54 -11.391 10.087 -23.800 1.00 0.00 N ATOM 874 CA ALA A 54 -12.085 10.692 -22.676 1.00 0.00 C ATOM 875 C ALA A 54 -13.586 10.604 -22.896 1.00 0.00 C ATOM 876 O ALA A 54 -14.343 10.315 -21.978 1.00 0.00 O ATOM 877 CB ALA A 54 -11.661 12.140 -22.497 1.00 0.00 C ATOM 0 H ALA A 54 -10.816 10.733 -24.341 1.00 0.00 H new ATOM 0 HA ALA A 54 -11.823 10.149 -21.768 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -12.193 12.573 -21.650 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -10.588 12.185 -22.312 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -11.898 12.703 -23.400 1.00 0.00 H new ATOM 883 N GLU A 55 -14.000 10.866 -24.134 1.00 0.00 N ATOM 884 CA GLU A 55 -15.404 10.795 -24.521 1.00 0.00 C ATOM 885 C GLU A 55 -15.899 9.354 -24.464 1.00 0.00 C ATOM 886 O GLU A 55 -17.035 9.099 -24.063 1.00 0.00 O ATOM 887 CB GLU A 55 -15.615 11.370 -25.924 1.00 0.00 C ATOM 888 CG GLU A 55 -17.076 11.406 -26.355 1.00 0.00 C ATOM 889 CD GLU A 55 -17.269 12.009 -27.733 1.00 0.00 C ATOM 890 OE1 GLU A 55 -16.261 12.395 -28.362 1.00 0.00 O ATOM 891 OE2 GLU A 55 -18.431 12.096 -28.182 1.00 0.00 O ATOM 0 H GLU A 55 -13.373 11.132 -24.893 1.00 0.00 H new ATOM 0 HA GLU A 55 -15.980 11.394 -23.815 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -15.210 12.381 -25.958 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -15.048 10.775 -26.640 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -17.477 10.392 -26.348 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -17.650 11.981 -25.628 1.00 0.00 H new ATOM 898 N GLU A 56 -15.043 8.416 -24.874 1.00 0.00 N ATOM 899 CA GLU A 56 -15.403 6.999 -24.872 1.00 0.00 C ATOM 900 C GLU A 56 -15.726 6.536 -23.452 1.00 0.00 C ATOM 901 O GLU A 56 -16.669 5.775 -23.242 1.00 0.00 O ATOM 902 CB GLU A 56 -14.265 6.146 -25.450 1.00 0.00 C ATOM 903 CG GLU A 56 -14.006 6.375 -26.937 1.00 0.00 C ATOM 904 CD GLU A 56 -12.976 5.422 -27.512 1.00 0.00 C ATOM 905 OE1 GLU A 56 -12.458 4.576 -26.753 1.00 0.00 O ATOM 906 OE2 GLU A 56 -12.683 5.529 -28.722 1.00 0.00 O ATOM 0 H GLU A 56 -14.100 8.612 -25.210 1.00 0.00 H new ATOM 0 HA GLU A 56 -16.286 6.873 -25.499 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -13.350 6.357 -24.896 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -14.498 5.093 -25.291 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -14.942 6.264 -27.485 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -13.669 7.400 -27.088 1.00 0.00 H new ATOM 913 N ASP A 57 -14.942 6.997 -22.475 1.00 0.00 N ATOM 914 CA ASP A 57 -15.190 6.635 -21.081 1.00 0.00 C ATOM 915 C ASP A 57 -15.987 7.729 -20.366 1.00 0.00 C ATOM 916 O ASP A 57 -16.145 7.687 -19.145 1.00 0.00 O ATOM 917 CB ASP A 57 -13.884 6.322 -20.332 1.00 0.00 C ATOM 918 CG ASP A 57 -13.262 5.004 -20.750 1.00 0.00 C ATOM 919 OD1 ASP A 57 -13.947 4.204 -21.419 1.00 0.00 O ATOM 920 OD2 ASP A 57 -12.083 4.772 -20.400 1.00 0.00 O ATOM 0 H ASP A 57 -14.142 7.613 -22.621 1.00 0.00 H new ATOM 0 HA ASP A 57 -15.788 5.724 -21.081 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -13.170 7.126 -20.507 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -14.083 6.300 -19.260 1.00 0.00 H new ATOM 925 N LYS A 58 -16.487 8.693 -21.149 1.00 0.00 N ATOM 926 CA LYS A 58 -17.307 9.804 -20.643 1.00 0.00 C ATOM 927 C LYS A 58 -16.668 10.519 -19.453 1.00 0.00 C ATOM 928 O LYS A 58 -17.304 10.717 -18.415 1.00 0.00 O ATOM 929 CB LYS A 58 -18.711 9.310 -20.284 1.00 0.00 C ATOM 930 CG LYS A 58 -19.485 8.777 -21.484 1.00 0.00 C ATOM 931 CD LYS A 58 -20.911 8.395 -21.114 1.00 0.00 C ATOM 932 CE LYS A 58 -20.953 7.179 -20.200 1.00 0.00 C ATOM 933 NZ LYS A 58 -20.385 5.970 -20.858 1.00 0.00 N ATOM 0 H LYS A 58 -16.334 8.726 -22.157 1.00 0.00 H new ATOM 0 HA LYS A 58 -17.377 10.537 -21.447 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -18.632 8.524 -19.533 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -19.272 10.128 -19.832 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -19.504 9.533 -22.269 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -18.970 7.907 -21.891 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -21.396 9.237 -20.621 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -21.478 8.187 -22.021 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -20.396 7.391 -19.288 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -21.984 6.982 -19.905 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -20.670 5.121 -20.329 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -20.740 5.906 -21.833 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -19.347 6.037 -20.871 1.00 0.00 H new ATOM 947 N ILE A 59 -15.414 10.913 -19.613 1.00 0.00 N ATOM 948 CA ILE A 59 -14.694 11.606 -18.557 1.00 0.00 C ATOM 949 C ILE A 59 -14.908 13.114 -18.664 1.00 0.00 C ATOM 950 O ILE A 59 -14.351 13.773 -19.542 1.00 0.00 O ATOM 951 CB ILE A 59 -13.183 11.294 -18.625 1.00 0.00 C ATOM 952 CG1 ILE A 59 -12.952 9.782 -18.615 1.00 0.00 C ATOM 953 CG2 ILE A 59 -12.441 11.957 -17.472 1.00 0.00 C ATOM 954 CD1 ILE A 59 -13.492 9.093 -17.379 1.00 0.00 C ATOM 0 H ILE A 59 -14.874 10.764 -20.465 1.00 0.00 H new ATOM 0 HA ILE A 59 -15.084 11.255 -17.602 1.00 0.00 H new ATOM 0 HB ILE A 59 -12.790 11.699 -19.557 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -13.420 9.346 -19.497 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -11.883 9.586 -18.692 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -11.379 11.723 -17.541 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -12.579 13.037 -17.524 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -12.834 11.586 -16.525 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -13.292 8.023 -17.442 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -13.006 9.502 -16.493 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -14.567 9.258 -17.311 1.00 0.00 H new ATOM 966 N LEU A 60 -15.727 13.651 -17.765 1.00 0.00 N ATOM 967 CA LEU A 60 -16.022 15.080 -17.755 1.00 0.00 C ATOM 968 C LEU A 60 -15.334 15.787 -16.589 1.00 0.00 C ATOM 969 O LEU A 60 -15.489 16.995 -16.411 1.00 0.00 O ATOM 970 CB LEU A 60 -17.536 15.308 -17.679 1.00 0.00 C ATOM 971 CG LEU A 60 -18.347 14.709 -18.833 1.00 0.00 C ATOM 972 CD1 LEU A 60 -19.835 14.928 -18.608 1.00 0.00 C ATOM 973 CD2 LEU A 60 -17.915 15.312 -20.162 1.00 0.00 C ATOM 0 H LEU A 60 -16.198 13.118 -17.034 1.00 0.00 H new ATOM 0 HA LEU A 60 -15.637 15.503 -18.683 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -17.903 14.889 -16.742 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -17.724 16.381 -17.643 1.00 0.00 H new ATOM 0 HG LEU A 60 -18.156 13.636 -18.865 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -20.396 14.496 -19.437 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -20.137 14.448 -17.677 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -20.041 15.997 -18.548 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -18.503 14.874 -20.969 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -18.074 16.390 -20.141 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -16.858 15.105 -20.329 1.00 0.00 H new ATOM 985 N ALA A 61 -14.572 15.037 -15.801 1.00 0.00 N ATOM 986 CA ALA A 61 -13.877 15.604 -14.650 1.00 0.00 C ATOM 987 C ALA A 61 -12.527 14.937 -14.427 1.00 0.00 C ATOM 988 O ALA A 61 -12.339 13.766 -14.758 1.00 0.00 O ATOM 989 CB ALA A 61 -14.737 15.478 -13.399 1.00 0.00 C ATOM 0 H ALA A 61 -14.420 14.038 -15.937 1.00 0.00 H new ATOM 0 HA ALA A 61 -13.698 16.659 -14.858 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -14.206 15.905 -12.548 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -15.675 16.013 -13.547 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -14.946 14.426 -13.206 1.00 0.00 H new ATOM 995 N THR A 62 -11.590 15.697 -13.869 1.00 0.00 N ATOM 996 CA THR A 62 -10.252 15.209 -13.574 1.00 0.00 C ATOM 997 C THR A 62 -9.723 15.872 -12.305 1.00 0.00 C ATOM 998 O THR A 62 -10.036 17.031 -12.031 1.00 0.00 O ATOM 999 CB THR A 62 -9.259 15.514 -14.723 1.00 0.00 C ATOM 1000 OG1 THR A 62 -9.266 16.918 -15.012 1.00 0.00 O ATOM 1001 CG2 THR A 62 -9.588 14.732 -15.988 1.00 0.00 C ATOM 0 H THR A 62 -11.740 16.672 -13.609 1.00 0.00 H new ATOM 0 HA THR A 62 -10.328 14.129 -13.448 1.00 0.00 H new ATOM 0 HB THR A 62 -8.268 15.205 -14.389 1.00 0.00 H new ATOM 0 HG1 THR A 62 -8.368 17.285 -14.872 1.00 0.00 H new ATOM 0 HG21 THR A 62 -8.865 14.978 -16.766 1.00 0.00 H new ATOM 0 HG22 THR A 62 -9.544 13.664 -15.777 1.00 0.00 H new ATOM 0 HG23 THR A 62 -10.590 14.994 -16.328 1.00 0.00 H new ATOM 1009 N PRO A 63 -8.911 15.152 -11.514 1.00 0.00 N ATOM 1010 CA PRO A 63 -8.547 13.763 -11.786 1.00 0.00 C ATOM 1011 C PRO A 63 -9.657 12.795 -11.377 1.00 0.00 C ATOM 1012 O PRO A 63 -10.392 13.043 -10.421 1.00 0.00 O ATOM 1013 CB PRO A 63 -7.295 13.537 -10.920 1.00 0.00 C ATOM 1014 CG PRO A 63 -6.965 14.873 -10.329 1.00 0.00 C ATOM 1015 CD PRO A 63 -8.254 15.639 -10.302 1.00 0.00 C ATOM 0 HA PRO A 63 -8.378 13.585 -12.848 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -7.486 12.800 -10.140 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -6.467 13.159 -11.520 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -6.553 14.765 -9.326 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -6.215 15.391 -10.927 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -8.838 15.427 -9.406 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -8.091 16.716 -10.329 1.00 0.00 H new ATOM 1023 N THR A 64 -9.771 11.691 -12.100 1.00 0.00 N ATOM 1024 CA THR A 64 -10.766 10.673 -11.785 1.00 0.00 C ATOM 1025 C THR A 64 -10.069 9.337 -11.574 1.00 0.00 C ATOM 1026 O THR A 64 -9.270 8.901 -12.407 1.00 0.00 O ATOM 1027 CB THR A 64 -11.852 10.525 -12.875 1.00 0.00 C ATOM 1028 OG1 THR A 64 -12.546 11.767 -13.042 1.00 0.00 O ATOM 1029 CG2 THR A 64 -12.861 9.440 -12.508 1.00 0.00 C ATOM 0 H THR A 64 -9.188 11.476 -12.909 1.00 0.00 H new ATOM 0 HA THR A 64 -11.275 10.993 -10.876 1.00 0.00 H new ATOM 0 HB THR A 64 -11.356 10.243 -13.804 1.00 0.00 H new ATOM 0 HG1 THR A 64 -12.183 12.243 -13.818 1.00 0.00 H new ATOM 0 HG21 THR A 64 -13.612 9.360 -13.294 1.00 0.00 H new ATOM 0 HG22 THR A 64 -12.346 8.486 -12.400 1.00 0.00 H new ATOM 0 HG23 THR A 64 -13.347 9.698 -11.567 1.00 0.00 H new ATOM 1037 N LEU A 65 -10.372 8.700 -10.456 1.00 0.00 N ATOM 1038 CA LEU A 65 -9.780 7.420 -10.107 1.00 0.00 C ATOM 1039 C LEU A 65 -10.775 6.298 -10.376 1.00 0.00 C ATOM 1040 O LEU A 65 -11.864 6.294 -9.818 1.00 0.00 O ATOM 1041 CB LEU A 65 -9.399 7.435 -8.624 1.00 0.00 C ATOM 1042 CG LEU A 65 -8.538 6.266 -8.151 1.00 0.00 C ATOM 1043 CD1 LEU A 65 -7.174 6.326 -8.812 1.00 0.00 C ATOM 1044 CD2 LEU A 65 -8.398 6.279 -6.637 1.00 0.00 C ATOM 0 H LEU A 65 -11.034 9.055 -9.766 1.00 0.00 H new ATOM 0 HA LEU A 65 -8.889 7.251 -10.712 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -8.867 8.363 -8.414 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -10.314 7.451 -8.032 1.00 0.00 H new ATOM 0 HG LEU A 65 -9.027 5.335 -8.437 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -6.566 5.489 -8.469 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -7.291 6.270 -9.894 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -6.683 7.263 -8.548 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -7.781 5.438 -6.321 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -7.929 7.211 -6.323 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -9.384 6.197 -6.180 1.00 0.00 H new ATOM 1056 N ALA A 66 -10.419 5.355 -11.240 1.00 0.00 N ATOM 1057 CA ALA A 66 -11.320 4.248 -11.543 1.00 0.00 C ATOM 1058 C ALA A 66 -10.566 2.938 -11.733 1.00 0.00 C ATOM 1059 O ALA A 66 -9.531 2.884 -12.395 1.00 0.00 O ATOM 1060 CB ALA A 66 -12.152 4.545 -12.781 1.00 0.00 C ATOM 0 H ALA A 66 -9.528 5.333 -11.736 1.00 0.00 H new ATOM 0 HA ALA A 66 -11.983 4.138 -10.685 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -12.815 3.704 -12.984 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -12.747 5.443 -12.613 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -11.492 4.701 -13.634 1.00 0.00 H new ATOM 1066 N LYS A 67 -11.108 1.882 -11.140 1.00 0.00 N ATOM 1067 CA LYS A 67 -10.532 0.555 -11.256 1.00 0.00 C ATOM 1068 C LYS A 67 -11.318 -0.203 -12.306 1.00 0.00 C ATOM 1069 O LYS A 67 -12.441 -0.634 -12.056 1.00 0.00 O ATOM 1070 CB LYS A 67 -10.596 -0.182 -9.909 1.00 0.00 C ATOM 1071 CG LYS A 67 -10.194 -1.654 -9.983 1.00 0.00 C ATOM 1072 CD LYS A 67 -9.785 -2.212 -8.623 1.00 0.00 C ATOM 1073 CE LYS A 67 -10.954 -2.859 -7.889 1.00 0.00 C ATOM 1074 NZ LYS A 67 -11.670 -3.851 -8.736 1.00 0.00 N ATOM 0 H LYS A 67 -11.953 1.923 -10.570 1.00 0.00 H new ATOM 0 HA LYS A 67 -9.483 0.627 -11.544 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -9.945 0.326 -9.198 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -11.611 -0.113 -9.517 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -11.027 -2.236 -10.377 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -9.367 -1.768 -10.684 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -8.992 -2.947 -8.758 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -9.374 -1.409 -8.011 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -10.588 -3.351 -6.988 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -11.652 -2.086 -7.569 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -12.615 -3.487 -8.973 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -11.132 -4.013 -9.611 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -11.764 -4.747 -8.217 1.00 0.00 H new ATOM 1088 N VAL A 68 -10.738 -0.358 -13.482 1.00 0.00 N ATOM 1089 CA VAL A 68 -11.422 -1.046 -14.561 1.00 0.00 C ATOM 1090 C VAL A 68 -11.332 -2.558 -14.410 1.00 0.00 C ATOM 1091 O VAL A 68 -12.224 -3.284 -14.850 1.00 0.00 O ATOM 1092 CB VAL A 68 -10.879 -0.618 -15.938 1.00 0.00 C ATOM 1093 CG1 VAL A 68 -11.155 0.859 -16.180 1.00 0.00 C ATOM 1094 CG2 VAL A 68 -9.389 -0.913 -16.055 1.00 0.00 C ATOM 0 H VAL A 68 -9.804 -0.020 -13.713 1.00 0.00 H new ATOM 0 HA VAL A 68 -12.472 -0.759 -14.501 1.00 0.00 H new ATOM 0 HB VAL A 68 -11.395 -1.198 -16.703 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -10.766 1.147 -17.157 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -12.230 1.038 -16.151 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -10.667 1.452 -15.406 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -9.032 -0.601 -17.037 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -8.848 -0.367 -15.282 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -9.219 -1.982 -15.930 1.00 0.00 H new ATOM 1104 N LEU A 69 -10.261 -3.032 -13.781 1.00 0.00 N ATOM 1105 CA LEU A 69 -10.084 -4.470 -13.591 1.00 0.00 C ATOM 1106 C LEU A 69 -9.593 -4.787 -12.185 1.00 0.00 C ATOM 1107 O LEU A 69 -8.725 -4.093 -11.662 1.00 0.00 O ATOM 1108 CB LEU A 69 -9.095 -5.033 -14.621 1.00 0.00 C ATOM 1109 CG LEU A 69 -9.537 -4.942 -16.084 1.00 0.00 C ATOM 1110 CD1 LEU A 69 -8.399 -5.338 -17.012 1.00 0.00 C ATOM 1111 CD2 LEU A 69 -10.752 -5.824 -16.333 1.00 0.00 C ATOM 0 H LEU A 69 -9.513 -2.453 -13.399 1.00 0.00 H new ATOM 0 HA LEU A 69 -11.057 -4.941 -13.732 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -8.147 -4.506 -14.513 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -8.906 -6.080 -14.382 1.00 0.00 H new ATOM 0 HG LEU A 69 -9.811 -3.908 -16.293 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -8.732 -5.267 -18.047 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -7.553 -4.669 -16.856 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -8.095 -6.363 -16.798 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -11.051 -5.745 -17.378 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -10.503 -6.860 -16.104 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -11.574 -5.499 -15.695 1.00 0.00 H new ATOM 1123 N PRO A 70 -10.135 -5.844 -11.550 1.00 0.00 N ATOM 1124 CA PRO A 70 -11.196 -6.683 -12.130 1.00 0.00 C ATOM 1125 C PRO A 70 -12.569 -6.006 -12.073 1.00 0.00 C ATOM 1126 O PRO A 70 -12.786 -5.108 -11.259 1.00 0.00 O ATOM 1127 CB PRO A 70 -11.169 -7.926 -11.239 1.00 0.00 C ATOM 1128 CG PRO A 70 -10.720 -7.418 -9.914 1.00 0.00 C ATOM 1129 CD PRO A 70 -9.737 -6.318 -10.208 1.00 0.00 C ATOM 0 HA PRO A 70 -11.032 -6.891 -13.187 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -12.153 -8.391 -11.174 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -10.485 -8.680 -11.629 1.00 0.00 H new ATOM 0 HG2 PRO A 70 -11.563 -7.044 -9.333 1.00 0.00 H new ATOM 0 HG3 PRO A 70 -10.255 -8.211 -9.328 1.00 0.00 H new ATOM 0 HD2 PRO A 70 -9.795 -5.520 -9.468 1.00 0.00 H new ATOM 0 HD3 PRO A 70 -8.711 -6.685 -10.201 1.00 0.00 H new ATOM 1137 N PRO A 71 -13.509 -6.416 -12.944 1.00 0.00 N ATOM 1138 CA PRO A 71 -14.867 -5.852 -12.970 1.00 0.00 C ATOM 1139 C PRO A 71 -15.673 -6.244 -11.728 1.00 0.00 C ATOM 1140 O PRO A 71 -15.403 -7.277 -11.112 1.00 0.00 O ATOM 1141 CB PRO A 71 -15.483 -6.466 -14.231 1.00 0.00 C ATOM 1142 CG PRO A 71 -14.728 -7.733 -14.434 1.00 0.00 C ATOM 1143 CD PRO A 71 -13.323 -7.439 -13.989 1.00 0.00 C ATOM 0 HA PRO A 71 -14.862 -4.762 -12.976 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -16.549 -6.655 -14.101 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -15.380 -5.800 -15.088 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -15.162 -8.546 -13.852 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -14.752 -8.041 -15.479 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -12.830 -8.329 -13.598 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -12.709 -7.069 -14.810 1.00 0.00 H new ATOM 1151 N PRO A 72 -16.685 -5.440 -11.337 1.00 0.00 N ATOM 1152 CA PRO A 72 -17.077 -4.200 -12.038 1.00 0.00 C ATOM 1153 C PRO A 72 -16.099 -3.044 -11.821 1.00 0.00 C ATOM 1154 O PRO A 72 -15.256 -3.084 -10.926 1.00 0.00 O ATOM 1155 CB PRO A 72 -18.435 -3.870 -11.416 1.00 0.00 C ATOM 1156 CG PRO A 72 -18.356 -4.434 -10.041 1.00 0.00 C ATOM 1157 CD PRO A 72 -17.543 -5.695 -10.163 1.00 0.00 C ATOM 0 HA PRO A 72 -17.095 -4.340 -13.119 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -18.612 -2.795 -11.395 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -19.252 -4.317 -11.983 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -17.885 -3.729 -9.356 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -19.350 -4.646 -9.647 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -16.952 -5.880 -9.266 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -18.177 -6.569 -10.312 1.00 0.00 H new ATOM 1165 N VAL A 73 -16.225 -2.017 -12.660 1.00 0.00 N ATOM 1166 CA VAL A 73 -15.360 -0.843 -12.582 1.00 0.00 C ATOM 1167 C VAL A 73 -15.687 0.000 -11.347 1.00 0.00 C ATOM 1168 O VAL A 73 -16.842 0.371 -11.124 1.00 0.00 O ATOM 1169 CB VAL A 73 -15.501 0.029 -13.851 1.00 0.00 C ATOM 1170 CG1 VAL A 73 -14.634 1.280 -13.763 1.00 0.00 C ATOM 1171 CG2 VAL A 73 -15.154 -0.778 -15.096 1.00 0.00 C ATOM 0 H VAL A 73 -16.921 -1.975 -13.404 1.00 0.00 H new ATOM 0 HA VAL A 73 -14.333 -1.199 -12.505 1.00 0.00 H new ATOM 0 HB VAL A 73 -16.541 0.349 -13.923 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -14.756 1.872 -14.670 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -14.937 1.873 -12.900 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -13.588 0.991 -13.656 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -15.259 -0.148 -15.979 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -14.126 -1.134 -15.024 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -15.828 -1.631 -15.177 1.00 0.00 H new ATOM 1181 N ARG A 74 -14.663 0.299 -10.551 1.00 0.00 N ATOM 1182 CA ARG A 74 -14.838 1.096 -9.339 1.00 0.00 C ATOM 1183 C ARG A 74 -14.384 2.523 -9.572 1.00 0.00 C ATOM 1184 O ARG A 74 -13.200 2.773 -9.772 1.00 0.00 O ATOM 1185 CB ARG A 74 -14.019 0.515 -8.182 1.00 0.00 C ATOM 1186 CG ARG A 74 -14.183 -0.982 -7.979 1.00 0.00 C ATOM 1187 CD ARG A 74 -15.615 -1.352 -7.622 1.00 0.00 C ATOM 1188 NE ARG A 74 -16.000 -0.848 -6.306 1.00 0.00 N ATOM 1189 CZ ARG A 74 -17.241 -0.897 -5.831 1.00 0.00 C ATOM 1190 NH1 ARG A 74 -18.215 -1.418 -6.567 1.00 0.00 N ATOM 1191 NH2 ARG A 74 -17.507 -0.426 -4.621 1.00 0.00 N ATOM 0 H ARG A 74 -13.703 0.001 -10.724 1.00 0.00 H new ATOM 0 HA ARG A 74 -15.898 1.077 -9.086 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -12.965 0.731 -8.356 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -14.302 1.026 -7.262 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -13.888 -1.506 -8.888 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -13.513 -1.317 -7.187 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -16.292 -0.950 -8.376 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -15.724 -2.436 -7.641 1.00 0.00 H new ATOM 0 HE ARG A 74 -15.276 -0.435 -5.718 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -18.012 -1.781 -7.498 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -19.167 -1.455 -6.201 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -16.760 -0.026 -4.054 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -18.459 -0.464 -4.257 1.00 0.00 H new ATOM 1205 N ARG A 75 -15.313 3.462 -9.529 1.00 0.00 N ATOM 1206 CA ARG A 75 -14.956 4.856 -9.716 1.00 0.00 C ATOM 1207 C ARG A 75 -14.897 5.553 -8.369 1.00 0.00 C ATOM 1208 O ARG A 75 -15.876 5.583 -7.622 1.00 0.00 O ATOM 1209 CB ARG A 75 -15.932 5.569 -10.641 1.00 0.00 C ATOM 1210 CG ARG A 75 -15.940 5.024 -12.058 1.00 0.00 C ATOM 1211 CD ARG A 75 -16.801 5.877 -12.970 1.00 0.00 C ATOM 1212 NE ARG A 75 -16.830 5.367 -14.339 1.00 0.00 N ATOM 1213 CZ ARG A 75 -17.661 4.416 -14.761 1.00 0.00 C ATOM 1214 NH1 ARG A 75 -18.533 3.871 -13.920 1.00 0.00 N ATOM 1215 NH2 ARG A 75 -17.622 4.013 -16.024 1.00 0.00 N ATOM 0 H ARG A 75 -16.305 3.288 -9.369 1.00 0.00 H new ATOM 0 HA ARG A 75 -13.975 4.894 -10.189 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -16.936 5.490 -10.225 1.00 0.00 H new ATOM 0 HB3 ARG A 75 -15.682 6.630 -10.671 1.00 0.00 H new ATOM 0 HG2 ARG A 75 -14.921 4.990 -12.443 1.00 0.00 H new ATOM 0 HG3 ARG A 75 -16.313 4.000 -12.054 1.00 0.00 H new ATOM 0 HD2 ARG A 75 -17.817 5.915 -12.577 1.00 0.00 H new ATOM 0 HD3 ARG A 75 -16.422 6.899 -12.973 1.00 0.00 H new ATOM 0 HE ARG A 75 -16.174 5.763 -15.012 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -18.567 4.181 -12.949 1.00 0.00 H new ATOM 0 HH12 ARG A 75 -19.169 3.143 -14.245 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -16.955 4.432 -16.673 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -18.259 3.284 -16.347 1.00 0.00 H new ATOM 1229 N ILE A 76 -13.740 6.111 -8.069 1.00 0.00 N ATOM 1230 CA ILE A 76 -13.520 6.799 -6.811 1.00 0.00 C ATOM 1231 C ILE A 76 -13.345 8.297 -7.057 1.00 0.00 C ATOM 1232 O ILE A 76 -12.414 8.719 -7.746 1.00 0.00 O ATOM 1233 CB ILE A 76 -12.277 6.236 -6.095 1.00 0.00 C ATOM 1234 CG1 ILE A 76 -12.411 4.716 -5.955 1.00 0.00 C ATOM 1235 CG2 ILE A 76 -12.097 6.890 -4.728 1.00 0.00 C ATOM 1236 CD1 ILE A 76 -11.224 4.062 -5.301 1.00 0.00 C ATOM 0 H ILE A 76 -12.929 6.101 -8.687 1.00 0.00 H new ATOM 0 HA ILE A 76 -14.390 6.640 -6.174 1.00 0.00 H new ATOM 0 HB ILE A 76 -11.392 6.462 -6.691 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -13.305 4.491 -5.373 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -12.556 4.280 -6.944 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -11.214 6.477 -4.241 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -11.973 7.966 -4.853 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -12.975 6.695 -4.113 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -11.391 2.987 -5.236 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -10.330 4.255 -5.893 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -11.090 4.469 -4.299 1.00 0.00 H new ATOM 1248 N ILE A 77 -14.245 9.101 -6.495 1.00 0.00 N ATOM 1249 CA ILE A 77 -14.184 10.547 -6.669 1.00 0.00 C ATOM 1250 C ILE A 77 -13.986 11.244 -5.326 1.00 0.00 C ATOM 1251 O ILE A 77 -14.756 11.035 -4.388 1.00 0.00 O ATOM 1252 CB ILE A 77 -15.459 11.095 -7.351 1.00 0.00 C ATOM 1253 CG1 ILE A 77 -15.778 10.293 -8.616 1.00 0.00 C ATOM 1254 CG2 ILE A 77 -15.296 12.571 -7.693 1.00 0.00 C ATOM 1255 CD1 ILE A 77 -16.983 9.389 -8.472 1.00 0.00 C ATOM 0 H ILE A 77 -15.021 8.776 -5.918 1.00 0.00 H new ATOM 0 HA ILE A 77 -13.332 10.756 -7.315 1.00 0.00 H new ATOM 0 HB ILE A 77 -16.289 10.991 -6.652 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -15.949 10.984 -9.441 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -14.911 9.689 -8.882 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -16.205 12.936 -8.172 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -15.114 13.138 -6.780 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -14.453 12.696 -8.372 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -17.149 8.853 -9.406 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -16.807 8.673 -7.669 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -17.862 9.989 -8.237 1.00 0.00 H new ATOM 1267 N GLY A 78 -12.948 12.068 -5.240 1.00 0.00 N ATOM 1268 CA GLY A 78 -12.662 12.782 -4.010 1.00 0.00 C ATOM 1269 C GLY A 78 -11.307 13.457 -4.056 1.00 0.00 C ATOM 1270 O GLY A 78 -10.715 13.592 -5.127 1.00 0.00 O ATOM 0 H GLY A 78 -12.297 12.255 -6.003 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -13.435 13.530 -3.835 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -12.694 12.088 -3.170 1.00 0.00 H new ATOM 1274 N ASP A 79 -10.811 13.880 -2.899 1.00 0.00 N ATOM 1275 CA ASP A 79 -9.510 14.537 -2.829 1.00 0.00 C ATOM 1276 C ASP A 79 -8.404 13.488 -2.778 1.00 0.00 C ATOM 1277 O ASP A 79 -8.137 12.904 -1.730 1.00 0.00 O ATOM 1278 CB ASP A 79 -9.429 15.445 -1.597 1.00 0.00 C ATOM 1279 CG ASP A 79 -8.133 16.232 -1.534 1.00 0.00 C ATOM 1280 OD1 ASP A 79 -7.435 16.316 -2.567 1.00 0.00 O ATOM 1281 OD2 ASP A 79 -7.814 16.763 -0.451 1.00 0.00 O ATOM 0 H ASP A 79 -11.286 13.781 -2.002 1.00 0.00 H new ATOM 0 HA ASP A 79 -9.382 15.152 -3.719 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -10.270 16.138 -1.606 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -9.525 14.838 -0.697 1.00 0.00 H new ATOM 1286 N LEU A 80 -7.756 13.268 -3.917 1.00 0.00 N ATOM 1287 CA LEU A 80 -6.692 12.274 -4.012 1.00 0.00 C ATOM 1288 C LEU A 80 -5.325 12.870 -3.694 1.00 0.00 C ATOM 1289 O LEU A 80 -4.315 12.171 -3.738 1.00 0.00 O ATOM 1290 CB LEU A 80 -6.653 11.664 -5.416 1.00 0.00 C ATOM 1291 CG LEU A 80 -7.925 10.945 -5.865 1.00 0.00 C ATOM 1292 CD1 LEU A 80 -7.776 10.475 -7.302 1.00 0.00 C ATOM 1293 CD2 LEU A 80 -8.230 9.769 -4.947 1.00 0.00 C ATOM 0 H LEU A 80 -7.949 13.764 -4.787 1.00 0.00 H new ATOM 0 HA LEU A 80 -6.913 11.502 -3.275 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -6.436 12.458 -6.131 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -5.824 10.958 -5.462 1.00 0.00 H new ATOM 0 HG LEU A 80 -8.760 11.644 -5.809 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -8.687 9.964 -7.614 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -7.602 11.334 -7.950 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -6.932 9.789 -7.375 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -9.139 9.271 -5.284 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -7.399 9.064 -4.971 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -8.370 10.130 -3.928 1.00 0.00 H new ATOM 1305 N SER A 81 -5.288 14.163 -3.391 1.00 0.00 N ATOM 1306 CA SER A 81 -4.029 14.829 -3.066 1.00 0.00 C ATOM 1307 C SER A 81 -3.525 14.364 -1.699 1.00 0.00 C ATOM 1308 O SER A 81 -2.367 14.579 -1.339 1.00 0.00 O ATOM 1309 CB SER A 81 -4.209 16.347 -3.089 1.00 0.00 C ATOM 1310 OG SER A 81 -4.710 16.781 -4.343 1.00 0.00 O ATOM 0 H SER A 81 -6.108 14.769 -3.363 1.00 0.00 H new ATOM 0 HA SER A 81 -3.285 14.562 -3.817 1.00 0.00 H new ATOM 0 HB2 SER A 81 -4.894 16.648 -2.296 1.00 0.00 H new ATOM 0 HB3 SER A 81 -3.255 16.833 -2.887 1.00 0.00 H new ATOM 0 HG SER A 81 -4.818 17.755 -4.333 1.00 0.00 H new ATOM 1316 N ASN A 82 -4.422 13.746 -0.937 1.00 0.00 N ATOM 1317 CA ASN A 82 -4.093 13.209 0.375 1.00 0.00 C ATOM 1318 C ASN A 82 -3.665 11.753 0.228 1.00 0.00 C ATOM 1319 O ASN A 82 -4.444 10.915 -0.235 1.00 0.00 O ATOM 1320 CB ASN A 82 -5.294 13.332 1.315 1.00 0.00 C ATOM 1321 CG ASN A 82 -4.998 12.872 2.734 1.00 0.00 C ATOM 1322 OD1 ASN A 82 -3.878 12.473 3.058 1.00 0.00 O ATOM 1323 ND2 ASN A 82 -6.007 12.928 3.594 1.00 0.00 N ATOM 0 H ASN A 82 -5.394 13.605 -1.212 1.00 0.00 H new ATOM 0 HA ASN A 82 -3.270 13.779 0.807 1.00 0.00 H new ATOM 0 HB2 ASN A 82 -5.623 14.371 1.339 1.00 0.00 H new ATOM 0 HB3 ASN A 82 -6.121 12.745 0.915 1.00 0.00 H new ATOM 0 HD21 ASN A 82 -5.870 12.635 4.561 1.00 0.00 H new ATOM 0 HD22 ASN A 82 -6.920 13.264 3.288 1.00 0.00 H new ATOM 1330 N ARG A 83 -2.429 11.460 0.622 1.00 0.00 N ATOM 1331 CA ARG A 83 -1.881 10.109 0.505 1.00 0.00 C ATOM 1332 C ARG A 83 -2.706 9.097 1.296 1.00 0.00 C ATOM 1333 O ARG A 83 -2.870 7.958 0.860 1.00 0.00 O ATOM 1334 CB ARG A 83 -0.417 10.068 0.950 1.00 0.00 C ATOM 1335 CG ARG A 83 0.540 10.773 0.000 1.00 0.00 C ATOM 1336 CD ARG A 83 1.104 12.042 0.621 1.00 0.00 C ATOM 1337 NE ARG A 83 0.209 13.179 0.433 1.00 0.00 N ATOM 1338 CZ ARG A 83 0.103 14.191 1.288 1.00 0.00 C ATOM 1339 NH1 ARG A 83 0.844 14.216 2.389 1.00 0.00 N ATOM 1340 NH2 ARG A 83 -0.744 15.181 1.037 1.00 0.00 N ATOM 0 H ARG A 83 -1.785 12.140 1.026 1.00 0.00 H new ATOM 0 HA ARG A 83 -1.930 9.832 -0.548 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -0.335 10.525 1.936 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -0.109 9.028 1.054 1.00 0.00 H new ATOM 0 HG2 ARG A 83 1.357 10.100 -0.262 1.00 0.00 H new ATOM 0 HG3 ARG A 83 0.020 11.019 -0.926 1.00 0.00 H new ATOM 0 HD2 ARG A 83 1.271 11.883 1.686 1.00 0.00 H new ATOM 0 HD3 ARG A 83 2.074 12.265 0.176 1.00 0.00 H new ATOM 0 HE ARG A 83 -0.371 13.198 -0.406 1.00 0.00 H new ATOM 0 HH11 ARG A 83 1.498 13.457 2.581 1.00 0.00 H new ATOM 0 HH12 ARG A 83 0.760 14.994 3.043 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -1.312 15.164 0.190 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -0.828 15.959 1.691 1.00 0.00 H new ATOM 1354 N GLU A 84 -3.218 9.504 2.455 1.00 0.00 N ATOM 1355 CA GLU A 84 -4.025 8.611 3.279 1.00 0.00 C ATOM 1356 C GLU A 84 -5.270 8.117 2.545 1.00 0.00 C ATOM 1357 O GLU A 84 -5.560 6.926 2.574 1.00 0.00 O ATOM 1358 CB GLU A 84 -4.428 9.295 4.584 1.00 0.00 C ATOM 1359 CG GLU A 84 -3.445 9.045 5.715 1.00 0.00 C ATOM 1360 CD GLU A 84 -3.799 9.801 6.978 1.00 0.00 C ATOM 1361 OE1 GLU A 84 -3.766 11.049 6.951 1.00 0.00 O ATOM 1362 OE2 GLU A 84 -4.112 9.146 7.993 1.00 0.00 O ATOM 0 H GLU A 84 -3.089 10.439 2.842 1.00 0.00 H new ATOM 0 HA GLU A 84 -3.405 7.743 3.504 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -4.512 10.368 4.414 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -5.415 8.941 4.883 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -3.413 7.978 5.933 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -2.445 9.335 5.392 1.00 0.00 H new ATOM 1369 N LYS A 85 -6.002 9.013 1.878 1.00 0.00 N ATOM 1370 CA LYS A 85 -7.204 8.593 1.151 1.00 0.00 C ATOM 1371 C LYS A 85 -6.849 7.649 0.009 1.00 0.00 C ATOM 1372 O LYS A 85 -7.562 6.674 -0.230 1.00 0.00 O ATOM 1373 CB LYS A 85 -8.003 9.784 0.617 1.00 0.00 C ATOM 1374 CG LYS A 85 -8.720 10.595 1.679 1.00 0.00 C ATOM 1375 CD LYS A 85 -9.488 11.746 1.045 1.00 0.00 C ATOM 1376 CE LYS A 85 -10.148 12.624 2.096 1.00 0.00 C ATOM 1377 NZ LYS A 85 -11.158 11.876 2.894 1.00 0.00 N ATOM 0 H LYS A 85 -5.792 10.010 1.825 1.00 0.00 H new ATOM 0 HA LYS A 85 -7.834 8.065 1.866 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -7.327 10.442 0.072 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -8.739 9.418 -0.100 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -9.406 9.954 2.233 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -7.998 10.984 2.397 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -8.809 12.348 0.441 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -10.248 11.350 0.371 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -9.385 13.027 2.763 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -10.627 13.474 1.610 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -11.690 12.541 3.491 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -11.814 11.386 2.252 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -10.677 11.178 3.497 1.00 0.00 H new ATOM 1391 N VAL A 86 -5.758 7.936 -0.693 1.00 0.00 N ATOM 1392 CA VAL A 86 -5.317 7.073 -1.780 1.00 0.00 C ATOM 1393 C VAL A 86 -4.963 5.687 -1.237 1.00 0.00 C ATOM 1394 O VAL A 86 -5.336 4.669 -1.817 1.00 0.00 O ATOM 1395 CB VAL A 86 -4.122 7.684 -2.554 1.00 0.00 C ATOM 1396 CG1 VAL A 86 -3.553 6.687 -3.553 1.00 0.00 C ATOM 1397 CG2 VAL A 86 -4.563 8.952 -3.266 1.00 0.00 C ATOM 0 H VAL A 86 -5.168 8.752 -0.530 1.00 0.00 H new ATOM 0 HA VAL A 86 -6.140 6.978 -2.488 1.00 0.00 H new ATOM 0 HB VAL A 86 -3.336 7.930 -1.839 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -2.716 7.141 -4.083 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -3.209 5.798 -3.024 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -4.326 6.407 -4.268 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -3.719 9.377 -3.808 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -5.363 8.716 -3.967 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -4.924 9.674 -2.533 1.00 0.00 H new ATOM 1407 N LEU A 87 -4.264 5.659 -0.104 1.00 0.00 N ATOM 1408 CA LEU A 87 -3.881 4.401 0.535 1.00 0.00 C ATOM 1409 C LEU A 87 -5.095 3.650 1.074 1.00 0.00 C ATOM 1410 O LEU A 87 -5.211 2.443 0.876 1.00 0.00 O ATOM 1411 CB LEU A 87 -2.900 4.656 1.679 1.00 0.00 C ATOM 1412 CG LEU A 87 -1.471 4.183 1.442 1.00 0.00 C ATOM 1413 CD1 LEU A 87 -0.540 4.779 2.491 1.00 0.00 C ATOM 1414 CD2 LEU A 87 -1.411 2.659 1.470 1.00 0.00 C ATOM 0 H LEU A 87 -3.951 6.494 0.391 1.00 0.00 H new ATOM 0 HA LEU A 87 -3.404 3.787 -0.228 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -2.880 5.726 1.884 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -3.281 4.167 2.576 1.00 0.00 H new ATOM 0 HG LEU A 87 -1.143 4.522 0.459 1.00 0.00 H new ATOM 0 HD11 LEU A 87 0.478 4.434 2.312 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -0.571 5.867 2.429 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -0.861 4.463 3.484 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -0.385 2.332 1.300 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -1.750 2.299 2.442 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -2.055 2.255 0.689 1.00 0.00 H new ATOM 1426 N ILE A 88 -5.990 4.360 1.752 1.00 0.00 N ATOM 1427 CA ILE A 88 -7.186 3.741 2.316 1.00 0.00 C ATOM 1428 C ILE A 88 -8.069 3.135 1.222 1.00 0.00 C ATOM 1429 O ILE A 88 -8.509 1.988 1.335 1.00 0.00 O ATOM 1430 CB ILE A 88 -7.988 4.756 3.159 1.00 0.00 C ATOM 1431 CG1 ILE A 88 -7.201 5.088 4.431 1.00 0.00 C ATOM 1432 CG2 ILE A 88 -9.372 4.216 3.506 1.00 0.00 C ATOM 1433 CD1 ILE A 88 -7.725 6.290 5.180 1.00 0.00 C ATOM 0 H ILE A 88 -5.911 5.362 1.925 1.00 0.00 H new ATOM 0 HA ILE A 88 -6.859 2.933 2.970 1.00 0.00 H new ATOM 0 HB ILE A 88 -8.132 5.664 2.574 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -7.220 4.223 5.094 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -6.159 5.264 4.166 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -9.912 4.954 4.100 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -9.924 4.014 2.588 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -9.270 3.294 4.078 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -7.115 6.460 6.067 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -7.680 7.168 4.536 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -8.758 6.111 5.478 1.00 0.00 H new ATOM 1445 N ALA A 89 -8.316 3.900 0.159 1.00 0.00 N ATOM 1446 CA ALA A 89 -9.133 3.421 -0.952 1.00 0.00 C ATOM 1447 C ALA A 89 -8.472 2.235 -1.656 1.00 0.00 C ATOM 1448 O ALA A 89 -9.140 1.264 -2.005 1.00 0.00 O ATOM 1449 CB ALA A 89 -9.419 4.545 -1.935 1.00 0.00 C ATOM 0 H ALA A 89 -7.963 4.850 0.045 1.00 0.00 H new ATOM 0 HA ALA A 89 -10.083 3.076 -0.543 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -10.029 4.165 -2.755 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -9.954 5.347 -1.426 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -8.479 4.930 -2.331 1.00 0.00 H new ATOM 1455 N LEU A 90 -7.155 2.315 -1.846 1.00 0.00 N ATOM 1456 CA LEU A 90 -6.404 1.242 -2.500 1.00 0.00 C ATOM 1457 C LEU A 90 -6.376 -0.012 -1.629 1.00 0.00 C ATOM 1458 O LEU A 90 -6.490 -1.129 -2.136 1.00 0.00 O ATOM 1459 CB LEU A 90 -4.972 1.697 -2.817 1.00 0.00 C ATOM 1460 CG LEU A 90 -4.735 2.227 -4.236 1.00 0.00 C ATOM 1461 CD1 LEU A 90 -5.830 3.199 -4.654 1.00 0.00 C ATOM 1462 CD2 LEU A 90 -3.373 2.897 -4.311 1.00 0.00 C ATOM 0 H LEU A 90 -6.586 3.111 -1.557 1.00 0.00 H new ATOM 0 HA LEU A 90 -6.909 1.002 -3.435 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -4.694 2.477 -2.108 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -4.299 0.857 -2.647 1.00 0.00 H new ATOM 0 HG LEU A 90 -4.761 1.384 -4.927 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -5.633 3.557 -5.665 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -6.795 2.692 -4.630 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -5.847 4.045 -3.967 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -3.207 3.273 -5.321 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -3.336 3.726 -3.605 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -2.597 2.173 -4.061 1.00 0.00 H new ATOM 1474 N ARG A 91 -6.223 0.180 -0.317 1.00 0.00 N ATOM 1475 CA ARG A 91 -6.185 -0.930 0.633 1.00 0.00 C ATOM 1476 C ARG A 91 -7.510 -1.693 0.635 1.00 0.00 C ATOM 1477 O ARG A 91 -7.526 -2.925 0.600 1.00 0.00 O ATOM 1478 CB ARG A 91 -5.884 -0.408 2.043 1.00 0.00 C ATOM 1479 CG ARG A 91 -5.777 -1.501 3.096 1.00 0.00 C ATOM 1480 CD ARG A 91 -5.305 -0.947 4.432 1.00 0.00 C ATOM 1481 NE ARG A 91 -3.921 -0.479 4.371 1.00 0.00 N ATOM 1482 CZ ARG A 91 -3.292 0.097 5.392 1.00 0.00 C ATOM 1483 NH1 ARG A 91 -3.923 0.279 6.545 1.00 0.00 N ATOM 1484 NH2 ARG A 91 -2.032 0.490 5.257 1.00 0.00 N ATOM 0 H ARG A 91 -6.123 1.100 0.112 1.00 0.00 H new ATOM 0 HA ARG A 91 -5.393 -1.613 0.325 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -4.950 0.153 2.020 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -6.668 0.290 2.336 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -6.747 -1.981 3.223 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -5.083 -2.269 2.755 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -5.953 -0.124 4.733 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -5.394 -1.719 5.197 1.00 0.00 H new ATOM 0 HE ARG A 91 -3.409 -0.601 3.497 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -4.892 -0.023 6.649 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -3.439 0.721 7.327 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -1.546 0.350 4.371 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -1.549 0.932 6.039 1.00 0.00 H new ATOM 1498 N LEU A 92 -8.619 -0.954 0.672 1.00 0.00 N ATOM 1499 CA LEU A 92 -9.949 -1.564 0.675 1.00 0.00 C ATOM 1500 C LEU A 92 -10.222 -2.308 -0.629 1.00 0.00 C ATOM 1501 O LEU A 92 -10.809 -3.391 -0.618 1.00 0.00 O ATOM 1502 CB LEU A 92 -11.031 -0.507 0.920 1.00 0.00 C ATOM 1503 CG LEU A 92 -11.502 -0.373 2.374 1.00 0.00 C ATOM 1504 CD1 LEU A 92 -10.320 -0.221 3.320 1.00 0.00 C ATOM 1505 CD2 LEU A 92 -12.450 0.808 2.514 1.00 0.00 C ATOM 0 H LEU A 92 -8.623 0.066 0.700 1.00 0.00 H new ATOM 0 HA LEU A 92 -9.977 -2.288 1.490 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -10.653 0.460 0.588 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -11.893 -0.743 0.297 1.00 0.00 H new ATOM 0 HG LEU A 92 -12.034 -1.285 2.644 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -10.683 -0.128 4.344 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -9.676 -1.097 3.241 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -9.753 0.671 3.054 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -12.777 0.892 3.551 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -11.937 1.724 2.220 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -13.317 0.656 1.871 1.00 0.00 H new ATOM 1517 N LEU A 93 -9.799 -1.724 -1.750 1.00 0.00 N ATOM 1518 CA LEU A 93 -9.992 -2.360 -3.048 1.00 0.00 C ATOM 1519 C LEU A 93 -9.190 -3.656 -3.127 1.00 0.00 C ATOM 1520 O LEU A 93 -9.668 -4.666 -3.644 1.00 0.00 O ATOM 1521 CB LEU A 93 -9.572 -1.427 -4.186 1.00 0.00 C ATOM 1522 CG LEU A 93 -10.470 -0.209 -4.406 1.00 0.00 C ATOM 1523 CD1 LEU A 93 -9.849 0.730 -5.427 1.00 0.00 C ATOM 1524 CD2 LEU A 93 -11.860 -0.644 -4.852 1.00 0.00 C ATOM 0 H LEU A 93 -9.326 -0.821 -1.784 1.00 0.00 H new ATOM 0 HA LEU A 93 -11.053 -2.584 -3.156 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -8.558 -1.078 -3.991 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -9.538 -2.003 -5.111 1.00 0.00 H new ATOM 0 HG LEU A 93 -10.566 0.326 -3.461 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -10.500 1.592 -5.572 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -8.877 1.067 -5.068 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -9.724 0.206 -6.375 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -12.485 0.236 -5.004 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -11.785 -1.201 -5.786 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -12.306 -1.278 -4.086 1.00 0.00 H new ATOM 1536 N ALA A 94 -7.963 -3.612 -2.600 1.00 0.00 N ATOM 1537 CA ALA A 94 -7.076 -4.774 -2.601 1.00 0.00 C ATOM 1538 C ALA A 94 -7.647 -5.911 -1.769 1.00 0.00 C ATOM 1539 O ALA A 94 -7.512 -7.079 -2.135 1.00 0.00 O ATOM 1540 CB ALA A 94 -5.687 -4.394 -2.116 1.00 0.00 C ATOM 0 H ALA A 94 -7.562 -2.780 -2.166 1.00 0.00 H new ATOM 0 HA ALA A 94 -6.995 -5.126 -3.629 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -5.045 -5.275 -2.125 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -5.268 -3.632 -2.773 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -5.751 -4.002 -1.101 1.00 0.00 H new ATOM 1546 N GLU A 95 -8.274 -5.570 -0.647 1.00 0.00 N ATOM 1547 CA GLU A 95 -8.876 -6.568 0.225 1.00 0.00 C ATOM 1548 C GLU A 95 -9.974 -7.319 -0.520 1.00 0.00 C ATOM 1549 O GLU A 95 -10.143 -8.526 -0.346 1.00 0.00 O ATOM 1550 CB GLU A 95 -9.445 -5.900 1.481 1.00 0.00 C ATOM 1551 CG GLU A 95 -8.378 -5.386 2.435 1.00 0.00 C ATOM 1552 CD GLU A 95 -8.951 -4.544 3.559 1.00 0.00 C ATOM 1553 OE1 GLU A 95 -10.110 -4.094 3.435 1.00 0.00 O ATOM 1554 OE2 GLU A 95 -8.241 -4.338 4.566 1.00 0.00 O ATOM 0 H GLU A 95 -8.377 -4.609 -0.322 1.00 0.00 H new ATOM 0 HA GLU A 95 -8.109 -7.280 0.528 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -10.084 -5.069 1.182 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -10.077 -6.615 2.008 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -7.839 -6.233 2.860 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -7.653 -4.794 1.877 1.00 0.00 H new ATOM 1561 N GLU A 96 -10.723 -6.586 -1.341 1.00 0.00 N ATOM 1562 CA GLU A 96 -11.794 -7.171 -2.141 1.00 0.00 C ATOM 1563 C GLU A 96 -11.224 -8.184 -3.133 1.00 0.00 C ATOM 1564 O GLU A 96 -11.798 -9.250 -3.352 1.00 0.00 O ATOM 1565 CB GLU A 96 -12.535 -6.068 -2.901 1.00 0.00 C ATOM 1566 CG GLU A 96 -13.374 -5.167 -2.005 1.00 0.00 C ATOM 1567 CD GLU A 96 -13.933 -3.964 -2.739 1.00 0.00 C ATOM 1568 OE1 GLU A 96 -13.443 -3.661 -3.847 1.00 0.00 O ATOM 1569 OE2 GLU A 96 -14.864 -3.326 -2.206 1.00 0.00 O ATOM 0 H GLU A 96 -10.606 -5.581 -1.469 1.00 0.00 H new ATOM 0 HA GLU A 96 -12.489 -7.682 -1.475 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -11.809 -5.458 -3.438 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -13.182 -6.526 -3.649 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -14.197 -5.745 -1.585 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -12.765 -4.825 -1.168 1.00 0.00 H new ATOM 1576 N ILE A 97 -10.086 -7.830 -3.725 1.00 0.00 N ATOM 1577 CA ILE A 97 -9.409 -8.685 -4.696 1.00 0.00 C ATOM 1578 C ILE A 97 -8.824 -9.924 -4.018 1.00 0.00 C ATOM 1579 O ILE A 97 -8.948 -11.038 -4.526 1.00 0.00 O ATOM 1580 CB ILE A 97 -8.298 -7.893 -5.417 1.00 0.00 C ATOM 1581 CG1 ILE A 97 -8.932 -6.712 -6.141 1.00 0.00 C ATOM 1582 CG2 ILE A 97 -7.528 -8.777 -6.402 1.00 0.00 C ATOM 1583 CD1 ILE A 97 -7.935 -5.724 -6.673 1.00 0.00 C ATOM 0 H ILE A 97 -9.609 -6.946 -3.546 1.00 0.00 H new ATOM 0 HA ILE A 97 -10.142 -9.016 -5.432 1.00 0.00 H new ATOM 0 HB ILE A 97 -7.580 -7.536 -4.679 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -9.536 -7.086 -6.968 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -9.609 -6.199 -5.458 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -6.753 -8.187 -6.892 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -7.067 -9.605 -5.864 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -8.214 -9.169 -7.152 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -8.460 -4.912 -7.175 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -7.347 -5.321 -5.849 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -7.273 -6.221 -7.382 1.00 0.00 H new ATOM 1595 N GLY A 98 -8.195 -9.713 -2.860 1.00 0.00 N ATOM 1596 CA GLY A 98 -7.603 -10.813 -2.109 1.00 0.00 C ATOM 1597 C GLY A 98 -8.640 -11.779 -1.568 1.00 0.00 C ATOM 1598 O GLY A 98 -8.327 -12.932 -1.272 1.00 0.00 O ATOM 0 H GLY A 98 -8.085 -8.796 -2.427 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -6.909 -11.354 -2.752 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -7.021 -10.410 -1.280 1.00 0.00 H new ATOM 1602 N ASP A 99 -9.873 -11.296 -1.418 1.00 0.00 N ATOM 1603 CA ASP A 99 -10.978 -12.113 -0.922 1.00 0.00 C ATOM 1604 C ASP A 99 -11.264 -13.278 -1.867 1.00 0.00 C ATOM 1605 O ASP A 99 -11.573 -14.385 -1.427 1.00 0.00 O ATOM 1606 CB ASP A 99 -12.238 -11.261 -0.749 1.00 0.00 C ATOM 1607 CG ASP A 99 -13.377 -12.032 -0.112 1.00 0.00 C ATOM 1608 OD1 ASP A 99 -13.248 -12.410 1.072 1.00 0.00 O ATOM 1609 OD2 ASP A 99 -14.400 -12.249 -0.795 1.00 0.00 O ATOM 0 H ASP A 99 -10.132 -10.334 -1.635 1.00 0.00 H new ATOM 0 HA ASP A 99 -10.687 -12.518 0.047 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -12.003 -10.392 -0.134 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -12.556 -10.887 -1.722 1.00 0.00 H new ATOM 1614 N TYR A 100 -11.179 -13.009 -3.169 1.00 0.00 N ATOM 1615 CA TYR A 100 -11.422 -14.023 -4.178 1.00 0.00 C ATOM 1616 C TYR A 100 -10.302 -15.057 -4.158 1.00 0.00 C ATOM 1617 O TYR A 100 -9.125 -14.726 -4.301 1.00 0.00 O ATOM 1618 CB TYR A 100 -11.526 -13.372 -5.564 1.00 0.00 C ATOM 1619 CG TYR A 100 -11.758 -14.352 -6.695 1.00 0.00 C ATOM 1620 CD1 TYR A 100 -13.005 -14.931 -6.895 1.00 0.00 C ATOM 1621 CD2 TYR A 100 -10.728 -14.693 -7.567 1.00 0.00 C ATOM 1622 CE1 TYR A 100 -13.220 -15.822 -7.930 1.00 0.00 C ATOM 1623 CE2 TYR A 100 -10.937 -15.583 -8.602 1.00 0.00 C ATOM 1624 CZ TYR A 100 -12.183 -16.145 -8.780 1.00 0.00 C ATOM 1625 OH TYR A 100 -12.394 -17.031 -9.811 1.00 0.00 O ATOM 0 H TYR A 100 -10.942 -12.091 -3.545 1.00 0.00 H new ATOM 0 HA TYR A 100 -12.364 -14.525 -3.958 1.00 0.00 H new ATOM 0 HB2 TYR A 100 -12.341 -12.648 -5.553 1.00 0.00 H new ATOM 0 HB3 TYR A 100 -10.609 -12.817 -5.762 1.00 0.00 H new ATOM 0 HD1 TYR A 100 -13.819 -14.681 -6.231 1.00 0.00 H new ATOM 0 HD2 TYR A 100 -9.750 -14.255 -7.432 1.00 0.00 H new ATOM 0 HE1 TYR A 100 -14.196 -16.263 -8.072 1.00 0.00 H new ATOM 0 HE2 TYR A 100 -10.127 -15.838 -9.270 1.00 0.00 H new ATOM 0 HH TYR A 100 -11.563 -17.149 -10.316 1.00 0.00 H new ATOM 1635 N LYS A 101 -10.685 -16.310 -3.985 1.00 0.00 N ATOM 1636 CA LYS A 101 -9.724 -17.405 -3.938 1.00 0.00 C ATOM 1637 C LYS A 101 -9.472 -17.972 -5.331 1.00 0.00 C ATOM 1638 O LYS A 101 -10.367 -17.989 -6.174 1.00 0.00 O ATOM 1639 CB LYS A 101 -10.219 -18.514 -3.004 1.00 0.00 C ATOM 1640 CG LYS A 101 -10.464 -18.053 -1.573 1.00 0.00 C ATOM 1641 CD LYS A 101 -9.177 -17.604 -0.897 1.00 0.00 C ATOM 1642 CE LYS A 101 -9.421 -17.193 0.547 1.00 0.00 C ATOM 1643 NZ LYS A 101 -9.929 -18.326 1.368 1.00 0.00 N ATOM 0 H LYS A 101 -11.657 -16.598 -3.874 1.00 0.00 H new ATOM 0 HA LYS A 101 -8.785 -17.009 -3.552 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -11.144 -18.927 -3.405 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -9.487 -19.321 -2.995 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -11.180 -17.232 -1.573 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -10.911 -18.866 -1.001 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -8.447 -18.413 -0.928 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -8.748 -16.767 -1.448 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -8.493 -16.818 0.980 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -10.139 -16.374 0.575 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -9.875 -18.076 2.376 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -10.918 -18.523 1.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -9.350 -19.171 1.189 1.00 0.00 H new ATOM 1657 N ASP A 102 -8.242 -18.433 -5.560 1.00 0.00 N ATOM 1658 CA ASP A 102 -7.855 -19.008 -6.849 1.00 0.00 C ATOM 1659 C ASP A 102 -8.668 -20.263 -7.162 1.00 0.00 C ATOM 1660 O ASP A 102 -9.107 -20.461 -8.294 1.00 0.00 O ATOM 1661 CB ASP A 102 -6.359 -19.346 -6.852 1.00 0.00 C ATOM 1662 CG ASP A 102 -5.884 -19.845 -8.202 1.00 0.00 C ATOM 1663 OD1 ASP A 102 -5.848 -19.037 -9.154 1.00 0.00 O ATOM 1664 OD2 ASP A 102 -5.543 -21.042 -8.304 1.00 0.00 O ATOM 0 H ASP A 102 -7.494 -18.419 -4.867 1.00 0.00 H new ATOM 0 HA ASP A 102 -8.060 -18.265 -7.620 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -5.788 -18.460 -6.573 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -6.159 -20.105 -6.096 1.00 0.00 H new ATOM 1669 N ASP A 103 -8.856 -21.107 -6.154 1.00 0.00 N ATOM 1670 CA ASP A 103 -9.612 -22.343 -6.313 1.00 0.00 C ATOM 1671 C ASP A 103 -10.160 -22.799 -4.965 1.00 0.00 C ATOM 1672 O ASP A 103 -9.642 -22.411 -3.919 1.00 0.00 O ATOM 1673 CB ASP A 103 -8.726 -23.437 -6.921 1.00 0.00 C ATOM 1674 CG ASP A 103 -9.523 -24.493 -7.664 1.00 0.00 C ATOM 1675 OD1 ASP A 103 -10.768 -24.378 -7.709 1.00 0.00 O ATOM 1676 OD2 ASP A 103 -8.905 -25.437 -8.193 1.00 0.00 O ATOM 0 H ASP A 103 -8.493 -20.956 -5.213 1.00 0.00 H new ATOM 0 HA ASP A 103 -10.447 -22.157 -6.989 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -8.010 -22.980 -7.605 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -8.150 -23.914 -6.128 1.00 0.00 H new ATOM 1681 N ASP A 104 -11.210 -23.620 -4.998 1.00 0.00 N ATOM 1682 CA ASP A 104 -11.834 -24.128 -3.774 1.00 0.00 C ATOM 1683 C ASP A 104 -10.897 -25.076 -3.022 1.00 0.00 C ATOM 1684 O ASP A 104 -10.952 -25.163 -1.795 1.00 0.00 O ATOM 1685 CB ASP A 104 -13.145 -24.846 -4.105 1.00 0.00 C ATOM 1686 CG ASP A 104 -13.954 -25.178 -2.867 1.00 0.00 C ATOM 1687 OD1 ASP A 104 -14.348 -24.238 -2.148 1.00 0.00 O ATOM 1688 OD2 ASP A 104 -14.199 -26.377 -2.624 1.00 0.00 O ATOM 0 H ASP A 104 -11.647 -23.948 -5.859 1.00 0.00 H new ATOM 0 HA ASP A 104 -12.043 -23.275 -3.129 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -13.742 -24.219 -4.767 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -12.925 -25.765 -4.648 1.00 0.00 H new ATOM 1693 N ASP A 105 -10.044 -25.777 -3.778 1.00 0.00 N ATOM 1694 CA ASP A 105 -9.073 -26.730 -3.223 1.00 0.00 C ATOM 1695 C ASP A 105 -9.756 -27.960 -2.621 1.00 0.00 C ATOM 1696 O ASP A 105 -9.749 -29.033 -3.220 1.00 0.00 O ATOM 1697 CB ASP A 105 -8.172 -26.058 -2.177 1.00 0.00 C ATOM 1698 CG ASP A 105 -6.907 -26.847 -1.912 1.00 0.00 C ATOM 1699 OD1 ASP A 105 -6.433 -27.538 -2.839 1.00 0.00 O ATOM 1700 OD2 ASP A 105 -6.393 -26.782 -0.776 1.00 0.00 O ATOM 0 H ASP A 105 -10.007 -25.700 -4.794 1.00 0.00 H new ATOM 0 HA ASP A 105 -8.453 -27.067 -4.054 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -7.908 -25.057 -2.518 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -8.726 -25.941 -1.246 1.00 0.00 H new ATOM 1705 N LYS A 106 -10.344 -27.801 -1.440 1.00 0.00 N ATOM 1706 CA LYS A 106 -11.015 -28.909 -0.766 1.00 0.00 C ATOM 1707 C LYS A 106 -12.507 -28.626 -0.612 1.00 0.00 C ATOM 1708 O LYS A 106 -12.852 -27.615 0.038 1.00 0.00 O ATOM 1709 CB LYS A 106 -10.388 -29.160 0.612 1.00 0.00 C ATOM 1710 CG LYS A 106 -8.888 -29.427 0.575 1.00 0.00 C ATOM 1711 CD LYS A 106 -8.559 -30.690 -0.207 1.00 0.00 C ATOM 1712 CE LYS A 106 -7.088 -31.054 -0.088 1.00 0.00 C ATOM 1713 NZ LYS A 106 -6.205 -30.015 -0.687 1.00 0.00 N ATOM 1714 OXT LYS A 106 -13.316 -29.419 -1.135 1.00 0.00 O ATOM 0 H LYS A 106 -10.370 -26.918 -0.930 1.00 0.00 H new ATOM 0 HA LYS A 106 -10.890 -29.801 -1.380 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -10.576 -28.295 1.248 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -10.886 -30.011 1.076 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -8.378 -28.576 0.123 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -8.510 -29.521 1.593 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -9.169 -31.515 0.160 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -8.815 -30.546 -1.257 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -6.831 -31.186 0.963 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -6.910 -32.009 -0.582 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -5.216 -30.334 -0.645 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -6.477 -29.858 -1.679 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -6.305 -29.126 -0.156 1.00 0.00 H new TER 1728 LYS A 106