USER MOD reduce.3.24.130724 H: found=0, std=0, add=899, rem=0, adj=18 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 Single : A 1 MET CE :methyl 169:sc= 0 (180deg=-0.137) USER MOD Single : A 1 MET N :NH3+ 180:sc= -0.269 (180deg=-0.269) USER MOD Single : A 6 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.041) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.0556 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 TYR OH : rot 157:sc= 0.723 USER MOD Single : A 17 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 18 THR OG1 : rot 180:sc= 0.0108 USER MOD Single : A 20 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 21 SER OG : rot -160:sc= -1.96! USER MOD Single : A 26 LYS NZ :NH3+ -168:sc= -0.0167 (180deg=-0.177) USER MOD Single : A 27 THR OG1 : rot 85:sc= 1.24 USER MOD Single : A 30 ASN : amide:sc= -0.0499 K(o=-0.05,f=-1.5!) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 TYR OH : rot -175:sc= -1.64 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= -0.852 K(o=-0.85,f=-7!) USER MOD Single : A 52 GLN : amide:sc= 0.188 X(o=0.19,f=-0.27) USER MOD Single : A 58 LYS NZ :NH3+ 168:sc= -0.0166 (180deg=-0.163) USER MOD Single : A 62 THR OG1 : rot -120:sc= 0 USER MOD Single : A 64 THR OG1 : rot 93:sc= 1.21 USER MOD Single : A 67 LYS NZ :NH3+ -115:sc= -0.691 (180deg=-4.04!) USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 82 ASN : amide:sc= -0.0439 K(o=-0.044,f=-3.7) USER MOD Single : A 85 LYS NZ :NH3+ -171:sc=-0.00142 (180deg=-0.0863) USER MOD Single : A 100 TYR OH : rot 150:sc= 0 USER MOD Single : A 101 LYS NZ :NH3+ -164:sc= -0.0435 (180deg=-0.303) USER MOD Single : A 106 LYS NZ :NH3+ 170:sc= -0.0159 (180deg=-0.177) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -12.547 -6.586 -20.939 1.00 0.00 N ATOM 2 CA MET A 1 -13.468 -6.692 -19.776 1.00 0.00 C ATOM 3 C MET A 1 -13.298 -8.034 -19.074 1.00 0.00 C ATOM 4 O MET A 1 -14.111 -8.415 -18.231 1.00 0.00 O ATOM 5 CB MET A 1 -14.919 -6.525 -20.232 1.00 0.00 C ATOM 6 CG MET A 1 -15.258 -5.113 -20.686 1.00 0.00 C ATOM 7 SD MET A 1 -16.923 -4.982 -21.365 1.00 0.00 S ATOM 8 CE MET A 1 -17.915 -5.193 -19.886 1.00 0.00 C ATOM 0 H1 MET A 1 -12.679 -5.665 -21.403 1.00 0.00 H new ATOM 0 H2 MET A 1 -11.563 -6.671 -20.612 1.00 0.00 H new ATOM 0 H3 MET A 1 -12.754 -7.348 -21.616 1.00 0.00 H new ATOM 0 HA MET A 1 -13.221 -5.897 -19.073 1.00 0.00 H new ATOM 0 HB2 MET A 1 -15.115 -7.217 -21.051 1.00 0.00 H new ATOM 0 HB3 MET A 1 -15.582 -6.803 -19.413 1.00 0.00 H new ATOM 0 HG2 MET A 1 -15.160 -4.431 -19.842 1.00 0.00 H new ATOM 0 HG3 MET A 1 -14.537 -4.795 -21.439 1.00 0.00 H new ATOM 0 HE1 MET A 1 -18.953 -4.944 -20.106 1.00 0.00 H new ATOM 0 HE2 MET A 1 -17.853 -6.228 -19.551 1.00 0.00 H new ATOM 0 HE3 MET A 1 -17.542 -4.535 -19.101 1.00 0.00 H new ATOM 20 N ALA A 2 -12.237 -8.746 -19.435 1.00 0.00 N ATOM 21 CA ALA A 2 -11.949 -10.049 -18.845 1.00 0.00 C ATOM 22 C ALA A 2 -11.404 -9.898 -17.425 1.00 0.00 C ATOM 23 O ALA A 2 -10.404 -9.211 -17.211 1.00 0.00 O ATOM 24 CB ALA A 2 -10.957 -10.812 -19.712 1.00 0.00 C ATOM 0 H ALA A 2 -11.560 -8.443 -20.135 1.00 0.00 H new ATOM 0 HA ALA A 2 -12.880 -10.613 -18.794 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -10.751 -11.782 -19.261 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -11.379 -10.957 -20.706 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -10.030 -10.244 -19.790 1.00 0.00 H new ATOM 30 N PRO A 3 -12.069 -10.524 -16.433 1.00 0.00 N ATOM 31 CA PRO A 3 -11.643 -10.464 -15.025 1.00 0.00 C ATOM 32 C PRO A 3 -10.238 -11.014 -14.807 1.00 0.00 C ATOM 33 O PRO A 3 -9.844 -12.010 -15.417 1.00 0.00 O ATOM 34 CB PRO A 3 -12.674 -11.338 -14.302 1.00 0.00 C ATOM 35 CG PRO A 3 -13.861 -11.338 -15.200 1.00 0.00 C ATOM 36 CD PRO A 3 -13.303 -11.318 -16.592 1.00 0.00 C ATOM 0 HA PRO A 3 -11.600 -9.437 -14.664 1.00 0.00 H new ATOM 0 HB2 PRO A 3 -12.296 -12.348 -14.144 1.00 0.00 H new ATOM 0 HB3 PRO A 3 -12.919 -10.932 -13.321 1.00 0.00 H new ATOM 0 HG2 PRO A 3 -14.478 -12.221 -15.036 1.00 0.00 H new ATOM 0 HG3 PRO A 3 -14.493 -10.469 -15.017 1.00 0.00 H new ATOM 0 HD2 PRO A 3 -13.094 -12.323 -16.959 1.00 0.00 H new ATOM 0 HD3 PRO A 3 -13.993 -10.857 -17.299 1.00 0.00 H new ATOM 44 N LEU A 4 -9.495 -10.366 -13.919 1.00 0.00 N ATOM 45 CA LEU A 4 -8.132 -10.776 -13.617 1.00 0.00 C ATOM 46 C LEU A 4 -8.024 -11.240 -12.170 1.00 0.00 C ATOM 47 O LEU A 4 -8.773 -10.779 -11.307 1.00 0.00 O ATOM 48 CB LEU A 4 -7.161 -9.620 -13.868 1.00 0.00 C ATOM 49 CG LEU A 4 -7.222 -9.007 -15.270 1.00 0.00 C ATOM 50 CD1 LEU A 4 -6.216 -7.874 -15.400 1.00 0.00 C ATOM 51 CD2 LEU A 4 -6.983 -10.067 -16.334 1.00 0.00 C ATOM 0 H LEU A 4 -9.816 -9.552 -13.395 1.00 0.00 H new ATOM 0 HA LEU A 4 -7.870 -11.606 -14.273 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -7.359 -8.836 -13.137 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -6.146 -9.974 -13.688 1.00 0.00 H new ATOM 0 HG LEU A 4 -8.221 -8.597 -15.422 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -6.273 -7.450 -16.403 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -6.442 -7.101 -14.666 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -5.211 -8.258 -15.225 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -7.031 -9.608 -17.322 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -5.999 -10.513 -16.189 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -7.747 -10.840 -16.255 1.00 0.00 H new ATOM 63 N ARG A 5 -7.100 -12.156 -11.908 1.00 0.00 N ATOM 64 CA ARG A 5 -6.906 -12.671 -10.558 1.00 0.00 C ATOM 65 C ARG A 5 -5.664 -12.054 -9.926 1.00 0.00 C ATOM 66 O ARG A 5 -4.616 -11.964 -10.569 1.00 0.00 O ATOM 67 CB ARG A 5 -6.779 -14.198 -10.577 1.00 0.00 C ATOM 68 CG ARG A 5 -8.001 -14.906 -11.143 1.00 0.00 C ATOM 69 CD ARG A 5 -9.196 -14.792 -10.207 1.00 0.00 C ATOM 70 NE ARG A 5 -10.360 -15.513 -10.715 1.00 0.00 N ATOM 71 CZ ARG A 5 -11.256 -14.982 -11.543 1.00 0.00 C ATOM 72 NH1 ARG A 5 -11.118 -13.730 -11.961 1.00 0.00 N ATOM 73 NH2 ARG A 5 -12.291 -15.705 -11.953 1.00 0.00 N ATOM 0 H ARG A 5 -6.476 -12.556 -12.609 1.00 0.00 H new ATOM 0 HA ARG A 5 -7.777 -12.400 -9.962 1.00 0.00 H new ATOM 0 HB2 ARG A 5 -5.905 -14.474 -11.167 1.00 0.00 H new ATOM 0 HB3 ARG A 5 -6.603 -14.552 -9.561 1.00 0.00 H new ATOM 0 HG2 ARG A 5 -8.255 -14.477 -12.112 1.00 0.00 H new ATOM 0 HG3 ARG A 5 -7.768 -15.958 -11.311 1.00 0.00 H new ATOM 0 HD2 ARG A 5 -8.927 -15.184 -9.226 1.00 0.00 H new ATOM 0 HD3 ARG A 5 -9.451 -13.741 -10.071 1.00 0.00 H new ATOM 0 HE ARG A 5 -10.494 -16.480 -10.418 1.00 0.00 H new ATOM 0 HH11 ARG A 5 -10.324 -13.172 -11.648 1.00 0.00 H new ATOM 0 HH12 ARG A 5 -11.806 -13.325 -12.596 1.00 0.00 H new ATOM 0 HH21 ARG A 5 -12.399 -16.668 -11.633 1.00 0.00 H new ATOM 0 HH22 ARG A 5 -12.978 -15.298 -12.588 1.00 0.00 H new ATOM 87 N LYS A 6 -5.802 -11.635 -8.662 1.00 0.00 N ATOM 88 CA LYS A 6 -4.714 -11.011 -7.894 1.00 0.00 C ATOM 89 C LYS A 6 -4.374 -9.621 -8.413 1.00 0.00 C ATOM 90 O LYS A 6 -4.603 -8.624 -7.731 1.00 0.00 O ATOM 91 CB LYS A 6 -3.465 -11.893 -7.873 1.00 0.00 C ATOM 92 CG LYS A 6 -3.483 -12.936 -6.768 1.00 0.00 C ATOM 93 CD LYS A 6 -2.079 -13.264 -6.298 1.00 0.00 C ATOM 94 CE LYS A 6 -2.090 -14.303 -5.188 1.00 0.00 C ATOM 95 NZ LYS A 6 -2.500 -15.644 -5.685 1.00 0.00 N ATOM 0 H LYS A 6 -6.674 -11.719 -8.140 1.00 0.00 H new ATOM 0 HA LYS A 6 -5.076 -10.905 -6.871 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -3.367 -12.395 -8.835 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -2.585 -11.261 -7.752 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -4.074 -12.569 -5.928 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -3.969 -13.842 -7.128 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -1.490 -13.634 -7.138 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -1.592 -12.356 -5.943 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -1.097 -14.369 -4.743 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -2.772 -13.984 -4.400 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -2.381 -16.346 -4.927 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -3.498 -15.616 -5.977 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -1.908 -15.909 -6.498 1.00 0.00 H new ATOM 109 N THR A 7 -3.828 -9.559 -9.613 1.00 0.00 N ATOM 110 CA THR A 7 -3.459 -8.286 -10.208 1.00 0.00 C ATOM 111 C THR A 7 -4.677 -7.552 -10.747 1.00 0.00 C ATOM 112 O THR A 7 -5.460 -8.094 -11.528 1.00 0.00 O ATOM 113 CB THR A 7 -2.430 -8.455 -11.340 1.00 0.00 C ATOM 114 OG1 THR A 7 -2.598 -9.729 -11.972 1.00 0.00 O ATOM 115 CG2 THR A 7 -1.008 -8.316 -10.813 1.00 0.00 C ATOM 0 H THR A 7 -3.630 -10.373 -10.195 1.00 0.00 H new ATOM 0 HA THR A 7 -3.006 -7.696 -9.411 1.00 0.00 H new ATOM 0 HB THR A 7 -2.599 -7.666 -12.073 1.00 0.00 H new ATOM 0 HG1 THR A 7 -1.940 -9.826 -12.692 1.00 0.00 H new ATOM 0 HG21 THR A 7 -0.302 -8.440 -11.634 1.00 0.00 H new ATOM 0 HG22 THR A 7 -0.879 -7.329 -10.370 1.00 0.00 H new ATOM 0 HG23 THR A 7 -0.824 -9.080 -10.058 1.00 0.00 H new ATOM 123 N ALA A 8 -4.816 -6.309 -10.320 1.00 0.00 N ATOM 124 CA ALA A 8 -5.920 -5.461 -10.737 1.00 0.00 C ATOM 125 C ALA A 8 -5.411 -4.256 -11.511 1.00 0.00 C ATOM 126 O ALA A 8 -4.274 -3.821 -11.321 1.00 0.00 O ATOM 127 CB ALA A 8 -6.720 -5.015 -9.529 1.00 0.00 C ATOM 0 H ALA A 8 -4.167 -5.859 -9.675 1.00 0.00 H new ATOM 0 HA ALA A 8 -6.570 -6.038 -11.395 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -7.545 -4.380 -9.853 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -7.116 -5.889 -9.012 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -6.075 -4.455 -8.852 1.00 0.00 H new ATOM 133 N VAL A 9 -6.254 -3.717 -12.382 1.00 0.00 N ATOM 134 CA VAL A 9 -5.871 -2.572 -13.186 1.00 0.00 C ATOM 135 C VAL A 9 -6.606 -1.324 -12.714 1.00 0.00 C ATOM 136 O VAL A 9 -7.838 -1.286 -12.669 1.00 0.00 O ATOM 137 CB VAL A 9 -6.163 -2.804 -14.685 1.00 0.00 C ATOM 138 CG1 VAL A 9 -5.776 -1.580 -15.515 1.00 0.00 C ATOM 139 CG2 VAL A 9 -5.429 -4.039 -15.186 1.00 0.00 C ATOM 0 H VAL A 9 -7.202 -4.055 -12.547 1.00 0.00 H new ATOM 0 HA VAL A 9 -4.797 -2.434 -13.064 1.00 0.00 H new ATOM 0 HB VAL A 9 -7.235 -2.965 -14.799 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -5.992 -1.770 -16.566 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -6.348 -0.716 -15.178 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -4.711 -1.380 -15.394 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -5.646 -4.187 -16.244 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -4.356 -3.904 -15.051 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -5.758 -4.912 -14.622 1.00 0.00 H new ATOM 149 N LEU A 10 -5.837 -0.309 -12.371 1.00 0.00 N ATOM 150 CA LEU A 10 -6.388 0.954 -11.911 1.00 0.00 C ATOM 151 C LEU A 10 -6.079 2.013 -12.954 1.00 0.00 C ATOM 152 O LEU A 10 -4.929 2.148 -13.374 1.00 0.00 O ATOM 153 CB LEU A 10 -5.769 1.343 -10.561 1.00 0.00 C ATOM 154 CG LEU A 10 -6.734 1.494 -9.371 1.00 0.00 C ATOM 155 CD1 LEU A 10 -7.826 2.512 -9.665 1.00 0.00 C ATOM 156 CD2 LEU A 10 -7.339 0.155 -8.993 1.00 0.00 C ATOM 0 H LEU A 10 -4.818 -0.334 -12.402 1.00 0.00 H new ATOM 0 HA LEU A 10 -7.466 0.865 -11.775 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -5.024 0.592 -10.300 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -5.239 2.287 -10.690 1.00 0.00 H new ATOM 0 HG LEU A 10 -6.155 1.862 -8.524 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -8.489 2.593 -8.804 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -7.374 3.483 -9.867 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -8.399 2.190 -10.535 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -8.017 0.287 -8.150 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -7.890 -0.248 -9.843 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -6.545 -0.538 -8.715 1.00 0.00 H new ATOM 168 N LYS A 11 -7.080 2.774 -13.374 1.00 0.00 N ATOM 169 CA LYS A 11 -6.849 3.798 -14.379 1.00 0.00 C ATOM 170 C LYS A 11 -7.091 5.181 -13.801 1.00 0.00 C ATOM 171 O LYS A 11 -8.106 5.432 -13.146 1.00 0.00 O ATOM 172 CB LYS A 11 -7.728 3.597 -15.619 1.00 0.00 C ATOM 173 CG LYS A 11 -7.349 2.386 -16.457 1.00 0.00 C ATOM 174 CD LYS A 11 -8.231 2.267 -17.689 1.00 0.00 C ATOM 175 CE LYS A 11 -7.834 1.076 -18.546 1.00 0.00 C ATOM 176 NZ LYS A 11 -8.698 0.946 -19.752 1.00 0.00 N ATOM 0 H LYS A 11 -8.042 2.704 -13.041 1.00 0.00 H new ATOM 0 HA LYS A 11 -5.807 3.710 -14.687 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -8.766 3.497 -15.303 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -7.669 4.490 -16.242 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -6.305 2.464 -16.761 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -7.439 1.482 -15.855 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -9.272 2.166 -17.384 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -8.159 3.181 -18.279 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -6.794 1.182 -18.854 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -7.900 0.164 -17.953 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -8.394 0.122 -20.309 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -9.688 0.820 -19.458 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -8.616 1.805 -20.332 1.00 0.00 H new ATOM 190 N LEU A 12 -6.142 6.069 -14.038 1.00 0.00 N ATOM 191 CA LEU A 12 -6.241 7.434 -13.565 1.00 0.00 C ATOM 192 C LEU A 12 -6.488 8.359 -14.741 1.00 0.00 C ATOM 193 O LEU A 12 -5.722 8.351 -15.707 1.00 0.00 O ATOM 194 CB LEU A 12 -4.950 7.850 -12.852 1.00 0.00 C ATOM 195 CG LEU A 12 -5.125 8.413 -11.439 1.00 0.00 C ATOM 196 CD1 LEU A 12 -3.771 8.754 -10.839 1.00 0.00 C ATOM 197 CD2 LEU A 12 -6.022 9.642 -11.449 1.00 0.00 C ATOM 0 H LEU A 12 -5.289 5.865 -14.559 1.00 0.00 H new ATOM 0 HA LEU A 12 -7.069 7.502 -12.860 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -4.290 6.984 -12.799 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -4.445 8.599 -13.462 1.00 0.00 H new ATOM 0 HG LEU A 12 -5.603 7.650 -10.825 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -3.908 9.153 -9.834 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -3.157 7.854 -10.791 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -3.275 9.499 -11.461 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -6.130 10.022 -10.433 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -5.577 10.412 -12.079 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -7.003 9.374 -11.842 1.00 0.00 H new ATOM 209 N TYR A 13 -7.540 9.153 -14.683 1.00 0.00 N ATOM 210 CA TYR A 13 -7.837 10.080 -15.757 1.00 0.00 C ATOM 211 C TYR A 13 -7.359 11.459 -15.339 1.00 0.00 C ATOM 212 O TYR A 13 -7.853 12.018 -14.360 1.00 0.00 O ATOM 213 CB TYR A 13 -9.343 10.093 -16.025 1.00 0.00 C ATOM 214 CG TYR A 13 -9.887 8.746 -16.454 1.00 0.00 C ATOM 215 CD1 TYR A 13 -10.392 7.848 -15.519 1.00 0.00 C ATOM 216 CD2 TYR A 13 -9.889 8.368 -17.791 1.00 0.00 C ATOM 217 CE1 TYR A 13 -10.882 6.615 -15.906 1.00 0.00 C ATOM 218 CE2 TYR A 13 -10.380 7.136 -18.184 1.00 0.00 C ATOM 219 CZ TYR A 13 -10.874 6.263 -17.238 1.00 0.00 C ATOM 220 OH TYR A 13 -11.362 5.035 -17.624 1.00 0.00 O ATOM 0 H TYR A 13 -8.201 9.175 -13.906 1.00 0.00 H new ATOM 0 HA TYR A 13 -7.331 9.778 -16.674 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -9.863 10.416 -15.123 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -9.561 10.828 -16.799 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -10.401 8.119 -14.474 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -9.501 9.047 -18.536 1.00 0.00 H new ATOM 0 HE1 TYR A 13 -11.270 5.930 -15.167 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -10.376 6.859 -19.228 1.00 0.00 H new ATOM 0 HH TYR A 13 -11.623 5.069 -18.568 1.00 0.00 H new ATOM 230 N VAL A 14 -6.407 12.011 -16.072 1.00 0.00 N ATOM 231 CA VAL A 14 -5.845 13.310 -15.733 1.00 0.00 C ATOM 232 C VAL A 14 -5.915 14.280 -16.901 1.00 0.00 C ATOM 233 O VAL A 14 -6.048 13.873 -18.059 1.00 0.00 O ATOM 234 CB VAL A 14 -4.377 13.178 -15.265 1.00 0.00 C ATOM 235 CG1 VAL A 14 -4.300 12.395 -13.959 1.00 0.00 C ATOM 236 CG2 VAL A 14 -3.522 12.516 -16.338 1.00 0.00 C ATOM 0 H VAL A 14 -6.006 11.581 -16.906 1.00 0.00 H new ATOM 0 HA VAL A 14 -6.449 13.707 -14.917 1.00 0.00 H new ATOM 0 HB VAL A 14 -3.985 14.180 -15.090 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -3.259 12.312 -13.645 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -4.871 12.914 -13.189 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -4.715 11.398 -14.108 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -2.494 12.435 -15.985 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -3.912 11.521 -16.552 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -3.547 13.118 -17.246 1.00 0.00 H new ATOM 246 N ALA A 15 -5.815 15.566 -16.591 1.00 0.00 N ATOM 247 CA ALA A 15 -5.873 16.598 -17.609 1.00 0.00 C ATOM 248 C ALA A 15 -4.592 17.422 -17.612 1.00 0.00 C ATOM 249 O ALA A 15 -4.432 18.341 -16.805 1.00 0.00 O ATOM 250 CB ALA A 15 -7.081 17.498 -17.395 1.00 0.00 C ATOM 0 H ALA A 15 -5.693 15.916 -15.641 1.00 0.00 H new ATOM 0 HA ALA A 15 -5.974 16.112 -18.579 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -7.105 18.265 -18.169 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -7.992 16.902 -17.446 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -7.012 17.973 -16.416 1.00 0.00 H new ATOM 256 N GLY A 16 -3.681 17.085 -18.520 1.00 0.00 N ATOM 257 CA GLY A 16 -2.429 17.811 -18.626 1.00 0.00 C ATOM 258 C GLY A 16 -1.526 17.621 -17.422 1.00 0.00 C ATOM 259 O GLY A 16 -1.553 16.578 -16.766 1.00 0.00 O ATOM 0 H GLY A 16 -3.789 16.320 -19.186 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -1.902 17.485 -19.523 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -2.641 18.873 -18.749 1.00 0.00 H new ATOM 263 N ASN A 17 -0.730 18.642 -17.128 1.00 0.00 N ATOM 264 CA ASN A 17 0.194 18.593 -16.004 1.00 0.00 C ATOM 265 C ASN A 17 -0.188 19.609 -14.940 1.00 0.00 C ATOM 266 O ASN A 17 0.666 20.316 -14.403 1.00 0.00 O ATOM 267 CB ASN A 17 1.634 18.836 -16.472 1.00 0.00 C ATOM 268 CG ASN A 17 2.088 17.843 -17.524 1.00 0.00 C ATOM 269 OD1 ASN A 17 2.421 18.220 -18.646 1.00 0.00 O ATOM 270 ND2 ASN A 17 2.106 16.564 -17.167 1.00 0.00 N ATOM 0 H ASN A 17 -0.707 19.515 -17.654 1.00 0.00 H new ATOM 0 HA ASN A 17 0.133 17.596 -15.567 1.00 0.00 H new ATOM 0 HB2 ASN A 17 1.714 19.846 -16.874 1.00 0.00 H new ATOM 0 HB3 ASN A 17 2.304 18.780 -15.614 1.00 0.00 H new ATOM 0 HD21 ASN A 17 2.404 15.852 -17.834 1.00 0.00 H new ATOM 0 HD22 ASN A 17 1.822 16.293 -16.226 1.00 0.00 H new ATOM 277 N THR A 18 -1.480 19.688 -14.652 1.00 0.00 N ATOM 278 CA THR A 18 -1.979 20.597 -13.631 1.00 0.00 C ATOM 279 C THR A 18 -1.545 20.106 -12.264 1.00 0.00 C ATOM 280 O THR A 18 -1.241 18.926 -12.097 1.00 0.00 O ATOM 281 CB THR A 18 -3.517 20.712 -13.678 1.00 0.00 C ATOM 282 OG1 THR A 18 -4.118 19.424 -13.501 1.00 0.00 O ATOM 283 CG2 THR A 18 -3.973 21.327 -14.988 1.00 0.00 C ATOM 0 H THR A 18 -2.202 19.133 -15.112 1.00 0.00 H new ATOM 0 HA THR A 18 -1.563 21.586 -13.823 1.00 0.00 H new ATOM 0 HB THR A 18 -3.834 21.364 -12.864 1.00 0.00 H new ATOM 0 HG1 THR A 18 -5.094 19.511 -13.531 1.00 0.00 H new ATOM 0 HG21 THR A 18 -5.061 21.398 -14.998 1.00 0.00 H new ATOM 0 HG22 THR A 18 -3.544 22.324 -15.091 1.00 0.00 H new ATOM 0 HG23 THR A 18 -3.643 20.702 -15.818 1.00 0.00 H new ATOM 291 N PRO A 19 -1.500 20.998 -11.267 1.00 0.00 N ATOM 292 CA PRO A 19 -1.090 20.627 -9.913 1.00 0.00 C ATOM 293 C PRO A 19 -1.946 19.512 -9.333 1.00 0.00 C ATOM 294 O PRO A 19 -1.452 18.677 -8.585 1.00 0.00 O ATOM 295 CB PRO A 19 -1.271 21.924 -9.115 1.00 0.00 C ATOM 296 CG PRO A 19 -2.125 22.800 -9.974 1.00 0.00 C ATOM 297 CD PRO A 19 -1.789 22.434 -11.381 1.00 0.00 C ATOM 0 HA PRO A 19 -0.072 20.239 -9.888 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -1.747 21.731 -8.154 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -0.310 22.394 -8.906 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -3.183 22.638 -9.769 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -1.921 23.854 -9.784 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -2.618 22.630 -12.062 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -0.931 22.994 -11.754 1.00 0.00 H new ATOM 305 N ASN A 20 -3.225 19.496 -9.689 1.00 0.00 N ATOM 306 CA ASN A 20 -4.122 18.442 -9.213 1.00 0.00 C ATOM 307 C ASN A 20 -3.733 17.110 -9.855 1.00 0.00 C ATOM 308 O ASN A 20 -3.680 16.075 -9.195 1.00 0.00 O ATOM 309 CB ASN A 20 -5.588 18.761 -9.545 1.00 0.00 C ATOM 310 CG ASN A 20 -6.070 20.037 -8.882 1.00 0.00 C ATOM 311 OD1 ASN A 20 -6.424 21.002 -9.555 1.00 0.00 O ATOM 312 ND2 ASN A 20 -6.091 20.045 -7.555 1.00 0.00 N ATOM 0 H ASN A 20 -3.663 20.189 -10.297 1.00 0.00 H new ATOM 0 HA ASN A 20 -4.024 18.378 -8.129 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -5.701 18.852 -10.625 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -6.218 17.930 -9.227 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -6.410 20.875 -7.055 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -5.788 19.221 -7.035 1.00 0.00 H new ATOM 319 N SER A 21 -3.463 17.169 -11.165 1.00 0.00 N ATOM 320 CA SER A 21 -3.046 16.006 -11.948 1.00 0.00 C ATOM 321 C SER A 21 -1.696 15.485 -11.475 1.00 0.00 C ATOM 322 O SER A 21 -1.533 14.286 -11.246 1.00 0.00 O ATOM 323 CB SER A 21 -2.973 16.386 -13.431 1.00 0.00 C ATOM 324 OG SER A 21 -2.532 15.304 -14.230 1.00 0.00 O ATOM 0 H SER A 21 -3.529 18.028 -11.710 1.00 0.00 H new ATOM 0 HA SER A 21 -3.781 15.213 -11.810 1.00 0.00 H new ATOM 0 HB2 SER A 21 -3.956 16.712 -13.771 1.00 0.00 H new ATOM 0 HB3 SER A 21 -2.296 17.231 -13.557 1.00 0.00 H new ATOM 0 HG SER A 21 -2.195 15.645 -15.085 1.00 0.00 H new ATOM 330 N VAL A 22 -0.740 16.387 -11.315 1.00 0.00 N ATOM 331 CA VAL A 22 0.594 16.013 -10.865 1.00 0.00 C ATOM 332 C VAL A 22 0.559 15.459 -9.441 1.00 0.00 C ATOM 333 O VAL A 22 1.187 14.438 -9.147 1.00 0.00 O ATOM 334 CB VAL A 22 1.574 17.204 -10.947 1.00 0.00 C ATOM 335 CG1 VAL A 22 2.879 16.889 -10.236 1.00 0.00 C ATOM 336 CG2 VAL A 22 1.831 17.583 -12.398 1.00 0.00 C ATOM 0 H VAL A 22 -0.862 17.384 -11.490 1.00 0.00 H new ATOM 0 HA VAL A 22 0.952 15.231 -11.535 1.00 0.00 H new ATOM 0 HB VAL A 22 1.115 18.054 -10.443 1.00 0.00 H new ATOM 0 HG11 VAL A 22 3.550 17.745 -10.310 1.00 0.00 H new ATOM 0 HG12 VAL A 22 2.679 16.674 -9.186 1.00 0.00 H new ATOM 0 HG13 VAL A 22 3.346 16.021 -10.701 1.00 0.00 H new ATOM 0 HG21 VAL A 22 2.524 18.424 -12.437 1.00 0.00 H new ATOM 0 HG22 VAL A 22 2.263 16.732 -12.925 1.00 0.00 H new ATOM 0 HG23 VAL A 22 0.891 17.865 -12.872 1.00 0.00 H new ATOM 346 N ARG A 23 -0.192 16.124 -8.572 1.00 0.00 N ATOM 347 CA ARG A 23 -0.308 15.712 -7.178 1.00 0.00 C ATOM 348 C ARG A 23 -0.930 14.330 -7.078 1.00 0.00 C ATOM 349 O ARG A 23 -0.418 13.451 -6.381 1.00 0.00 O ATOM 350 CB ARG A 23 -1.195 16.702 -6.435 1.00 0.00 C ATOM 351 CG ARG A 23 -0.816 16.930 -4.986 1.00 0.00 C ATOM 352 CD ARG A 23 0.023 18.188 -4.841 1.00 0.00 C ATOM 353 NE ARG A 23 0.329 18.492 -3.444 1.00 0.00 N ATOM 354 CZ ARG A 23 -0.439 19.249 -2.664 1.00 0.00 C ATOM 355 NH1 ARG A 23 -1.562 19.775 -3.141 1.00 0.00 N ATOM 356 NH2 ARG A 23 -0.084 19.482 -1.408 1.00 0.00 N ATOM 0 H ARG A 23 -0.733 16.956 -8.810 1.00 0.00 H new ATOM 0 HA ARG A 23 0.689 15.687 -6.738 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -1.167 17.658 -6.958 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -2.225 16.347 -6.475 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -1.717 17.016 -4.379 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -0.260 16.071 -4.611 1.00 0.00 H new ATOM 0 HD2 ARG A 23 0.953 18.068 -5.397 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -0.508 19.030 -5.286 1.00 0.00 H new ATOM 0 HE ARG A 23 1.182 18.101 -3.043 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -1.837 19.599 -4.107 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -2.149 20.355 -2.541 1.00 0.00 H new ATOM 0 HH21 ARG A 23 0.778 19.081 -1.039 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -0.673 20.062 -0.811 1.00 0.00 H new ATOM 370 N ALA A 24 -2.043 14.150 -7.784 1.00 0.00 N ATOM 371 CA ALA A 24 -2.755 12.878 -7.778 1.00 0.00 C ATOM 372 C ALA A 24 -1.899 11.757 -8.360 1.00 0.00 C ATOM 373 O ALA A 24 -1.868 10.644 -7.832 1.00 0.00 O ATOM 374 CB ALA A 24 -4.057 12.996 -8.555 1.00 0.00 C ATOM 0 H ALA A 24 -2.470 14.870 -8.367 1.00 0.00 H new ATOM 0 HA ALA A 24 -2.979 12.629 -6.741 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -4.577 12.038 -8.541 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -4.687 13.758 -8.096 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -3.841 13.277 -9.586 1.00 0.00 H new ATOM 380 N LEU A 25 -1.209 12.067 -9.458 1.00 0.00 N ATOM 381 CA LEU A 25 -0.344 11.103 -10.136 1.00 0.00 C ATOM 382 C LEU A 25 0.787 10.629 -9.225 1.00 0.00 C ATOM 383 O LEU A 25 1.034 9.428 -9.119 1.00 0.00 O ATOM 384 CB LEU A 25 0.224 11.721 -11.420 1.00 0.00 C ATOM 385 CG LEU A 25 1.179 10.830 -12.218 1.00 0.00 C ATOM 386 CD1 LEU A 25 0.479 9.557 -12.674 1.00 0.00 C ATOM 387 CD2 LEU A 25 1.736 11.590 -13.414 1.00 0.00 C ATOM 0 H LEU A 25 -1.234 12.986 -9.899 1.00 0.00 H new ATOM 0 HA LEU A 25 -0.945 10.231 -10.395 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -0.608 12.001 -12.066 1.00 0.00 H new ATOM 0 HB3 LEU A 25 0.747 12.641 -11.158 1.00 0.00 H new ATOM 0 HG LEU A 25 2.007 10.547 -11.568 1.00 0.00 H new ATOM 0 HD11 LEU A 25 1.178 8.940 -13.239 1.00 0.00 H new ATOM 0 HD12 LEU A 25 0.128 9.003 -11.803 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -0.370 9.815 -13.306 1.00 0.00 H new ATOM 0 HD21 LEU A 25 2.414 10.944 -13.972 1.00 0.00 H new ATOM 0 HD22 LEU A 25 0.916 11.901 -14.061 1.00 0.00 H new ATOM 0 HD23 LEU A 25 2.278 12.470 -13.066 1.00 0.00 H new ATOM 399 N LYS A 26 1.465 11.566 -8.563 1.00 0.00 N ATOM 400 CA LYS A 26 2.557 11.209 -7.658 1.00 0.00 C ATOM 401 C LYS A 26 2.046 10.390 -6.478 1.00 0.00 C ATOM 402 O LYS A 26 2.688 9.429 -6.053 1.00 0.00 O ATOM 403 CB LYS A 26 3.274 12.462 -7.145 1.00 0.00 C ATOM 404 CG LYS A 26 4.102 13.173 -8.204 1.00 0.00 C ATOM 405 CD LYS A 26 4.808 14.392 -7.629 1.00 0.00 C ATOM 406 CE LYS A 26 5.646 15.100 -8.681 1.00 0.00 C ATOM 407 NZ LYS A 26 6.741 14.234 -9.198 1.00 0.00 N ATOM 0 H LYS A 26 1.281 12.567 -8.635 1.00 0.00 H new ATOM 0 HA LYS A 26 3.265 10.603 -8.223 1.00 0.00 H new ATOM 0 HB2 LYS A 26 2.533 13.157 -6.750 1.00 0.00 H new ATOM 0 HB3 LYS A 26 3.924 12.183 -6.316 1.00 0.00 H new ATOM 0 HG2 LYS A 26 4.839 12.484 -8.615 1.00 0.00 H new ATOM 0 HG3 LYS A 26 3.457 13.479 -9.028 1.00 0.00 H new ATOM 0 HD2 LYS A 26 4.069 15.084 -7.225 1.00 0.00 H new ATOM 0 HD3 LYS A 26 5.446 14.086 -6.800 1.00 0.00 H new ATOM 0 HE2 LYS A 26 5.006 15.407 -9.508 1.00 0.00 H new ATOM 0 HE3 LYS A 26 6.073 16.008 -8.254 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 7.406 14.809 -9.754 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 7.245 13.798 -8.400 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 6.339 13.489 -9.802 1.00 0.00 H new ATOM 421 N THR A 27 0.885 10.775 -5.957 1.00 0.00 N ATOM 422 CA THR A 27 0.274 10.093 -4.822 1.00 0.00 C ATOM 423 C THR A 27 -0.133 8.660 -5.178 1.00 0.00 C ATOM 424 O THR A 27 0.143 7.724 -4.428 1.00 0.00 O ATOM 425 CB THR A 27 -0.958 10.884 -4.337 1.00 0.00 C ATOM 426 OG1 THR A 27 -0.562 12.209 -3.964 1.00 0.00 O ATOM 427 CG2 THR A 27 -1.615 10.216 -3.145 1.00 0.00 C ATOM 0 H THR A 27 0.344 11.565 -6.308 1.00 0.00 H new ATOM 0 HA THR A 27 1.014 10.041 -4.024 1.00 0.00 H new ATOM 0 HB THR A 27 -1.676 10.916 -5.156 1.00 0.00 H new ATOM 0 HG1 THR A 27 -0.551 12.783 -4.758 1.00 0.00 H new ATOM 0 HG21 THR A 27 -2.479 10.801 -2.831 1.00 0.00 H new ATOM 0 HG22 THR A 27 -1.938 9.212 -3.422 1.00 0.00 H new ATOM 0 HG23 THR A 27 -0.901 10.153 -2.324 1.00 0.00 H new ATOM 435 N LEU A 28 -0.767 8.489 -6.337 1.00 0.00 N ATOM 436 CA LEU A 28 -1.220 7.169 -6.777 1.00 0.00 C ATOM 437 C LEU A 28 -0.057 6.262 -7.169 1.00 0.00 C ATOM 438 O LEU A 28 0.016 5.115 -6.725 1.00 0.00 O ATOM 439 CB LEU A 28 -2.171 7.302 -7.976 1.00 0.00 C ATOM 440 CG LEU A 28 -3.622 6.856 -7.743 1.00 0.00 C ATOM 441 CD1 LEU A 28 -3.675 5.519 -7.017 1.00 0.00 C ATOM 442 CD2 LEU A 28 -4.390 7.921 -6.975 1.00 0.00 C ATOM 0 H LEU A 28 -0.979 9.246 -6.987 1.00 0.00 H new ATOM 0 HA LEU A 28 -1.739 6.717 -5.932 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -2.180 8.345 -8.292 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -1.763 6.721 -8.803 1.00 0.00 H new ATOM 0 HG LEU A 28 -4.097 6.724 -8.715 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -4.715 5.228 -6.866 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -3.169 4.760 -7.614 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -3.179 5.610 -6.051 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -5.416 7.588 -6.819 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -3.912 8.089 -6.010 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -4.393 8.850 -7.545 1.00 0.00 H new ATOM 454 N ALA A 29 0.852 6.778 -7.997 1.00 0.00 N ATOM 455 CA ALA A 29 1.983 5.991 -8.482 1.00 0.00 C ATOM 456 C ALA A 29 2.904 5.501 -7.371 1.00 0.00 C ATOM 457 O ALA A 29 3.274 4.335 -7.357 1.00 0.00 O ATOM 458 CB ALA A 29 2.781 6.793 -9.500 1.00 0.00 C ATOM 0 H ALA A 29 0.826 7.737 -8.345 1.00 0.00 H new ATOM 0 HA ALA A 29 1.560 5.102 -8.950 1.00 0.00 H new ATOM 0 HB1 ALA A 29 3.622 6.197 -9.855 1.00 0.00 H new ATOM 0 HB2 ALA A 29 2.140 7.053 -10.342 1.00 0.00 H new ATOM 0 HB3 ALA A 29 3.154 7.705 -9.033 1.00 0.00 H new ATOM 464 N ASN A 30 3.253 6.368 -6.426 1.00 0.00 N ATOM 465 CA ASN A 30 4.156 5.966 -5.345 1.00 0.00 C ATOM 466 C ASN A 30 3.523 4.909 -4.446 1.00 0.00 C ATOM 467 O ASN A 30 4.200 3.979 -4.012 1.00 0.00 O ATOM 468 CB ASN A 30 4.613 7.173 -4.520 1.00 0.00 C ATOM 469 CG ASN A 30 5.602 8.049 -5.266 1.00 0.00 C ATOM 470 OD1 ASN A 30 6.247 7.608 -6.216 1.00 0.00 O ATOM 471 ND2 ASN A 30 5.727 9.298 -4.840 1.00 0.00 N ATOM 0 H ASN A 30 2.934 7.336 -6.383 1.00 0.00 H new ATOM 0 HA ASN A 30 5.035 5.523 -5.813 1.00 0.00 H new ATOM 0 HB2 ASN A 30 3.743 7.769 -4.242 1.00 0.00 H new ATOM 0 HB3 ASN A 30 5.069 6.824 -3.594 1.00 0.00 H new ATOM 0 HD21 ASN A 30 6.377 9.932 -5.304 1.00 0.00 H new ATOM 0 HD22 ASN A 30 5.173 9.625 -4.048 1.00 0.00 H new ATOM 478 N ILE A 31 2.237 5.053 -4.156 1.00 0.00 N ATOM 479 CA ILE A 31 1.544 4.077 -3.331 1.00 0.00 C ATOM 480 C ILE A 31 1.490 2.718 -4.027 1.00 0.00 C ATOM 481 O ILE A 31 1.758 1.681 -3.425 1.00 0.00 O ATOM 482 CB ILE A 31 0.136 4.562 -2.945 1.00 0.00 C ATOM 483 CG1 ILE A 31 0.266 5.692 -1.929 1.00 0.00 C ATOM 484 CG2 ILE A 31 -0.730 3.432 -2.404 1.00 0.00 C ATOM 485 CD1 ILE A 31 -1.032 6.390 -1.638 1.00 0.00 C ATOM 0 H ILE A 31 1.658 5.829 -4.477 1.00 0.00 H new ATOM 0 HA ILE A 31 2.111 3.961 -2.407 1.00 0.00 H new ATOM 0 HB ILE A 31 -0.366 4.929 -3.840 1.00 0.00 H new ATOM 0 HG12 ILE A 31 0.669 5.289 -1.000 1.00 0.00 H new ATOM 0 HG13 ILE A 31 0.986 6.421 -2.299 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -1.715 3.821 -2.144 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -0.834 2.658 -3.164 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -0.262 3.008 -1.516 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -0.864 7.181 -0.908 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -1.427 6.823 -2.557 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -1.749 5.673 -1.238 1.00 0.00 H new ATOM 497 N LEU A 32 1.153 2.740 -5.307 1.00 0.00 N ATOM 498 CA LEU A 32 1.057 1.522 -6.102 1.00 0.00 C ATOM 499 C LEU A 32 2.427 0.894 -6.405 1.00 0.00 C ATOM 500 O LEU A 32 2.525 -0.317 -6.575 1.00 0.00 O ATOM 501 CB LEU A 32 0.286 1.806 -7.390 1.00 0.00 C ATOM 502 CG LEU A 32 -1.214 2.061 -7.187 1.00 0.00 C ATOM 503 CD1 LEU A 32 -1.845 2.594 -8.462 1.00 0.00 C ATOM 504 CD2 LEU A 32 -1.905 0.784 -6.752 1.00 0.00 C ATOM 0 H LEU A 32 0.940 3.594 -5.822 1.00 0.00 H new ATOM 0 HA LEU A 32 0.514 0.787 -5.508 1.00 0.00 H new ATOM 0 HB2 LEU A 32 0.727 2.674 -7.879 1.00 0.00 H new ATOM 0 HB3 LEU A 32 0.410 0.961 -8.067 1.00 0.00 H new ATOM 0 HG LEU A 32 -1.335 2.812 -6.406 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -2.908 2.768 -8.297 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -1.363 3.531 -8.742 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -1.717 1.866 -9.263 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -2.969 0.976 -6.611 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -1.773 0.020 -7.518 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -1.471 0.437 -5.814 1.00 0.00 H new ATOM 516 N GLU A 33 3.478 1.714 -6.491 1.00 0.00 N ATOM 517 CA GLU A 33 4.825 1.201 -6.785 1.00 0.00 C ATOM 518 C GLU A 33 5.601 0.842 -5.518 1.00 0.00 C ATOM 519 O GLU A 33 6.739 0.388 -5.600 1.00 0.00 O ATOM 520 CB GLU A 33 5.641 2.218 -7.590 1.00 0.00 C ATOM 521 CG GLU A 33 5.019 2.596 -8.923 1.00 0.00 C ATOM 522 CD GLU A 33 5.920 3.486 -9.756 1.00 0.00 C ATOM 523 OE1 GLU A 33 7.044 3.051 -10.084 1.00 0.00 O ATOM 524 OE2 GLU A 33 5.500 4.615 -10.083 1.00 0.00 O ATOM 0 H GLU A 33 3.427 2.725 -6.363 1.00 0.00 H new ATOM 0 HA GLU A 33 4.680 0.294 -7.372 1.00 0.00 H new ATOM 0 HB2 GLU A 33 5.769 3.120 -6.992 1.00 0.00 H new ATOM 0 HB3 GLU A 33 6.636 1.810 -7.768 1.00 0.00 H new ATOM 0 HG2 GLU A 33 4.792 1.689 -9.484 1.00 0.00 H new ATOM 0 HG3 GLU A 33 4.073 3.107 -8.746 1.00 0.00 H new ATOM 531 N LYS A 34 5.006 1.062 -4.354 1.00 0.00 N ATOM 532 CA LYS A 34 5.684 0.741 -3.101 1.00 0.00 C ATOM 533 C LYS A 34 4.787 -0.063 -2.167 1.00 0.00 C ATOM 534 O LYS A 34 5.096 -1.202 -1.821 1.00 0.00 O ATOM 535 CB LYS A 34 6.146 2.025 -2.402 1.00 0.00 C ATOM 536 CG LYS A 34 7.497 2.540 -2.882 1.00 0.00 C ATOM 537 CD LYS A 34 8.640 1.627 -2.455 1.00 0.00 C ATOM 538 CE LYS A 34 8.891 1.708 -0.956 1.00 0.00 C ATOM 539 NZ LYS A 34 10.074 0.900 -0.548 1.00 0.00 N ATOM 0 H LYS A 34 4.071 1.455 -4.248 1.00 0.00 H new ATOM 0 HA LYS A 34 6.552 0.129 -3.344 1.00 0.00 H new ATOM 0 HB2 LYS A 34 5.397 2.801 -2.558 1.00 0.00 H new ATOM 0 HB3 LYS A 34 6.198 1.843 -1.329 1.00 0.00 H new ATOM 0 HG2 LYS A 34 7.487 2.625 -3.969 1.00 0.00 H new ATOM 0 HG3 LYS A 34 7.665 3.541 -2.485 1.00 0.00 H new ATOM 0 HD2 LYS A 34 8.407 0.598 -2.731 1.00 0.00 H new ATOM 0 HD3 LYS A 34 9.547 1.903 -2.992 1.00 0.00 H new ATOM 0 HE2 LYS A 34 9.045 2.748 -0.669 1.00 0.00 H new ATOM 0 HE3 LYS A 34 8.009 1.357 -0.420 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 10.212 0.981 0.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 9.917 -0.097 -0.799 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 10.921 1.251 -1.040 1.00 0.00 H new ATOM 553 N GLU A 35 3.674 0.541 -1.769 1.00 0.00 N ATOM 554 CA GLU A 35 2.725 -0.093 -0.858 1.00 0.00 C ATOM 555 C GLU A 35 2.073 -1.338 -1.462 1.00 0.00 C ATOM 556 O GLU A 35 1.920 -2.354 -0.785 1.00 0.00 O ATOM 557 CB GLU A 35 1.640 0.919 -0.464 1.00 0.00 C ATOM 558 CG GLU A 35 2.142 2.031 0.449 1.00 0.00 C ATOM 559 CD GLU A 35 2.699 1.511 1.760 1.00 0.00 C ATOM 560 OE1 GLU A 35 2.012 0.704 2.420 1.00 0.00 O ATOM 561 OE2 GLU A 35 3.823 1.913 2.126 1.00 0.00 O ATOM 0 H GLU A 35 3.403 1.479 -2.066 1.00 0.00 H new ATOM 0 HA GLU A 35 3.283 -0.416 0.021 1.00 0.00 H new ATOM 0 HB2 GLU A 35 1.224 1.363 -1.368 1.00 0.00 H new ATOM 0 HB3 GLU A 35 0.827 0.391 0.034 1.00 0.00 H new ATOM 0 HG2 GLU A 35 2.915 2.598 -0.069 1.00 0.00 H new ATOM 0 HG3 GLU A 35 1.324 2.722 0.656 1.00 0.00 H new ATOM 568 N PHE A 36 1.689 -1.259 -2.733 1.00 0.00 N ATOM 569 CA PHE A 36 1.031 -2.382 -3.397 1.00 0.00 C ATOM 570 C PHE A 36 1.757 -2.806 -4.672 1.00 0.00 C ATOM 571 O PHE A 36 1.126 -3.279 -5.623 1.00 0.00 O ATOM 572 CB PHE A 36 -0.428 -2.030 -3.700 1.00 0.00 C ATOM 573 CG PHE A 36 -1.244 -1.793 -2.459 1.00 0.00 C ATOM 574 CD1 PHE A 36 -1.365 -0.519 -1.926 1.00 0.00 C ATOM 575 CD2 PHE A 36 -1.880 -2.845 -1.820 1.00 0.00 C ATOM 576 CE1 PHE A 36 -2.105 -0.299 -0.780 1.00 0.00 C ATOM 577 CE2 PHE A 36 -2.624 -2.630 -0.676 1.00 0.00 C ATOM 578 CZ PHE A 36 -2.734 -1.356 -0.155 1.00 0.00 C ATOM 0 H PHE A 36 1.820 -0.436 -3.321 1.00 0.00 H new ATOM 0 HA PHE A 36 1.063 -3.232 -2.715 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -0.459 -1.137 -4.325 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -0.879 -2.838 -4.276 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -0.875 0.312 -2.412 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -1.793 -3.844 -2.221 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -2.191 0.698 -0.374 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -3.119 -3.458 -0.190 1.00 0.00 H new ATOM 0 HZ PHE A 36 -3.312 -1.187 0.741 1.00 0.00 H new ATOM 588 N LYS A 37 3.077 -2.627 -4.698 1.00 0.00 N ATOM 589 CA LYS A 37 3.873 -2.989 -5.871 1.00 0.00 C ATOM 590 C LYS A 37 3.750 -4.476 -6.185 1.00 0.00 C ATOM 591 O LYS A 37 3.922 -5.327 -5.311 1.00 0.00 O ATOM 592 CB LYS A 37 5.346 -2.626 -5.663 1.00 0.00 C ATOM 593 CG LYS A 37 6.219 -2.913 -6.880 1.00 0.00 C ATOM 594 CD LYS A 37 7.622 -2.348 -6.718 1.00 0.00 C ATOM 595 CE LYS A 37 8.379 -3.044 -5.600 1.00 0.00 C ATOM 596 NZ LYS A 37 9.781 -2.555 -5.487 1.00 0.00 N ATOM 0 H LYS A 37 3.616 -2.236 -3.925 1.00 0.00 H new ATOM 0 HA LYS A 37 3.483 -2.422 -6.716 1.00 0.00 H new ATOM 0 HB2 LYS A 37 5.420 -1.567 -5.414 1.00 0.00 H new ATOM 0 HB3 LYS A 37 5.732 -3.182 -4.809 1.00 0.00 H new ATOM 0 HG2 LYS A 37 6.277 -3.990 -7.039 1.00 0.00 H new ATOM 0 HG3 LYS A 37 5.755 -2.484 -7.768 1.00 0.00 H new ATOM 0 HD2 LYS A 37 8.170 -2.459 -7.654 1.00 0.00 H new ATOM 0 HD3 LYS A 37 7.563 -1.280 -6.508 1.00 0.00 H new ATOM 0 HE2 LYS A 37 7.861 -2.881 -4.655 1.00 0.00 H new ATOM 0 HE3 LYS A 37 8.383 -4.119 -5.780 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 10.262 -3.056 -4.713 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 10.284 -2.734 -6.380 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 9.778 -1.534 -5.290 1.00 0.00 H new ATOM 610 N GLY A 38 3.450 -4.779 -7.444 1.00 0.00 N ATOM 611 CA GLY A 38 3.307 -6.159 -7.865 1.00 0.00 C ATOM 612 C GLY A 38 1.884 -6.663 -7.748 1.00 0.00 C ATOM 613 O GLY A 38 1.568 -7.754 -8.220 1.00 0.00 O ATOM 0 H GLY A 38 3.303 -4.090 -8.182 1.00 0.00 H new ATOM 0 HA2 GLY A 38 3.638 -6.255 -8.899 1.00 0.00 H new ATOM 0 HA3 GLY A 38 3.961 -6.788 -7.261 1.00 0.00 H new ATOM 617 N VAL A 39 1.016 -5.873 -7.121 1.00 0.00 N ATOM 618 CA VAL A 39 -0.376 -6.269 -6.960 1.00 0.00 C ATOM 619 C VAL A 39 -1.280 -5.488 -7.913 1.00 0.00 C ATOM 620 O VAL A 39 -2.201 -6.052 -8.507 1.00 0.00 O ATOM 621 CB VAL A 39 -0.868 -6.092 -5.504 1.00 0.00 C ATOM 622 CG1 VAL A 39 -2.309 -6.565 -5.352 1.00 0.00 C ATOM 623 CG2 VAL A 39 0.045 -6.830 -4.535 1.00 0.00 C ATOM 0 H VAL A 39 1.251 -4.965 -6.721 1.00 0.00 H new ATOM 0 HA VAL A 39 -0.431 -7.330 -7.205 1.00 0.00 H new ATOM 0 HB VAL A 39 -0.836 -5.029 -5.265 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -2.629 -6.429 -4.319 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -2.954 -5.984 -6.011 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -2.375 -7.620 -5.617 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -0.318 -6.693 -3.517 1.00 0.00 H new ATOM 0 HG22 VAL A 39 0.051 -7.893 -4.778 1.00 0.00 H new ATOM 0 HG23 VAL A 39 1.057 -6.434 -4.615 1.00 0.00 H new ATOM 633 N TYR A 40 -1.022 -4.193 -8.072 1.00 0.00 N ATOM 634 CA TYR A 40 -1.850 -3.390 -8.965 1.00 0.00 C ATOM 635 C TYR A 40 -1.061 -2.825 -10.134 1.00 0.00 C ATOM 636 O TYR A 40 0.112 -2.473 -10.004 1.00 0.00 O ATOM 637 CB TYR A 40 -2.508 -2.228 -8.227 1.00 0.00 C ATOM 638 CG TYR A 40 -3.708 -2.578 -7.393 1.00 0.00 C ATOM 639 CD1 TYR A 40 -3.572 -3.095 -6.114 1.00 0.00 C ATOM 640 CD2 TYR A 40 -4.984 -2.349 -7.880 1.00 0.00 C ATOM 641 CE1 TYR A 40 -4.680 -3.376 -5.344 1.00 0.00 C ATOM 642 CE2 TYR A 40 -6.094 -2.632 -7.120 1.00 0.00 C ATOM 643 CZ TYR A 40 -5.937 -3.142 -5.855 1.00 0.00 C ATOM 644 OH TYR A 40 -7.041 -3.412 -5.096 1.00 0.00 O ATOM 0 H TYR A 40 -0.267 -3.688 -7.608 1.00 0.00 H new ATOM 0 HA TYR A 40 -2.613 -4.069 -9.345 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -1.763 -1.764 -7.581 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -2.805 -1.478 -8.960 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -2.585 -3.280 -5.716 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -5.109 -1.942 -8.872 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -4.563 -3.777 -4.348 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -7.083 -2.454 -7.515 1.00 0.00 H new ATOM 0 HH TYR A 40 -7.849 -3.266 -5.631 1.00 0.00 H new ATOM 654 N ALA A 41 -1.727 -2.743 -11.278 1.00 0.00 N ATOM 655 CA ALA A 41 -1.139 -2.164 -12.470 1.00 0.00 C ATOM 656 C ALA A 41 -1.750 -0.781 -12.678 1.00 0.00 C ATOM 657 O ALA A 41 -2.974 -0.651 -12.769 1.00 0.00 O ATOM 658 CB ALA A 41 -1.380 -3.054 -13.681 1.00 0.00 C ATOM 0 H ALA A 41 -2.684 -3.075 -11.402 1.00 0.00 H new ATOM 0 HA ALA A 41 -0.059 -2.077 -12.347 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -0.930 -2.598 -14.563 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -0.931 -4.032 -13.509 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -2.452 -3.170 -13.840 1.00 0.00 H new ATOM 664 N LEU A 42 -0.916 0.249 -12.742 1.00 0.00 N ATOM 665 CA LEU A 42 -1.420 1.609 -12.898 1.00 0.00 C ATOM 666 C LEU A 42 -1.439 2.058 -14.352 1.00 0.00 C ATOM 667 O LEU A 42 -0.437 1.971 -15.063 1.00 0.00 O ATOM 668 CB LEU A 42 -0.592 2.598 -12.069 1.00 0.00 C ATOM 669 CG LEU A 42 -0.998 4.073 -12.217 1.00 0.00 C ATOM 670 CD1 LEU A 42 -2.424 4.299 -11.735 1.00 0.00 C ATOM 671 CD2 LEU A 42 -0.031 4.973 -11.466 1.00 0.00 C ATOM 0 H LEU A 42 0.100 0.172 -12.689 1.00 0.00 H new ATOM 0 HA LEU A 42 -2.448 1.600 -12.536 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -0.668 2.320 -11.018 1.00 0.00 H new ATOM 0 HB3 LEU A 42 0.456 2.496 -12.350 1.00 0.00 H new ATOM 0 HG LEU A 42 -0.956 4.328 -13.276 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -2.685 5.351 -11.851 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -3.108 3.688 -12.324 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -2.501 4.020 -10.684 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -0.336 6.013 -11.583 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -0.036 4.710 -10.408 1.00 0.00 H new ATOM 0 HD23 LEU A 42 0.974 4.842 -11.867 1.00 0.00 H new ATOM 683 N LYS A 43 -2.599 2.535 -14.775 1.00 0.00 N ATOM 684 CA LYS A 43 -2.792 3.044 -16.118 1.00 0.00 C ATOM 685 C LYS A 43 -3.286 4.484 -16.038 1.00 0.00 C ATOM 686 O LYS A 43 -4.131 4.811 -15.213 1.00 0.00 O ATOM 687 CB LYS A 43 -3.795 2.187 -16.891 1.00 0.00 C ATOM 688 CG LYS A 43 -3.168 1.302 -17.953 1.00 0.00 C ATOM 689 CD LYS A 43 -2.774 -0.057 -17.400 1.00 0.00 C ATOM 690 CE LYS A 43 -2.598 -1.071 -18.517 1.00 0.00 C ATOM 691 NZ LYS A 43 -1.386 -0.791 -19.336 1.00 0.00 N ATOM 0 H LYS A 43 -3.435 2.579 -14.192 1.00 0.00 H new ATOM 0 HA LYS A 43 -1.841 3.007 -16.650 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -4.339 1.559 -16.186 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -4.526 2.842 -17.365 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -3.871 1.169 -18.776 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -2.287 1.796 -18.363 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -1.846 0.032 -16.835 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -3.538 -0.406 -16.705 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -2.525 -2.072 -18.091 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -3.479 -1.061 -19.158 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -1.302 -1.505 -20.087 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -1.467 0.153 -19.764 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -0.542 -0.825 -18.730 1.00 0.00 H new ATOM 705 N VAL A 44 -2.742 5.340 -16.886 1.00 0.00 N ATOM 706 CA VAL A 44 -3.122 6.747 -16.914 1.00 0.00 C ATOM 707 C VAL A 44 -3.669 7.125 -18.272 1.00 0.00 C ATOM 708 O VAL A 44 -3.082 6.824 -19.313 1.00 0.00 O ATOM 709 CB VAL A 44 -1.934 7.667 -16.537 1.00 0.00 C ATOM 710 CG1 VAL A 44 -0.676 7.284 -17.304 1.00 0.00 C ATOM 711 CG2 VAL A 44 -2.276 9.133 -16.766 1.00 0.00 C ATOM 0 H VAL A 44 -2.030 5.085 -17.570 1.00 0.00 H new ATOM 0 HA VAL A 44 -3.904 6.889 -16.168 1.00 0.00 H new ATOM 0 HB VAL A 44 -1.738 7.528 -15.474 1.00 0.00 H new ATOM 0 HG11 VAL A 44 0.140 7.947 -17.018 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -0.406 6.254 -17.069 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -0.860 7.376 -18.374 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -1.422 9.753 -16.492 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -2.516 9.291 -17.817 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -3.134 9.406 -16.153 1.00 0.00 H new ATOM 721 N ILE A 45 -4.817 7.781 -18.244 1.00 0.00 N ATOM 722 CA ILE A 45 -5.485 8.204 -19.444 1.00 0.00 C ATOM 723 C ILE A 45 -5.481 9.724 -19.516 1.00 0.00 C ATOM 724 O ILE A 45 -6.230 10.391 -18.798 1.00 0.00 O ATOM 725 CB ILE A 45 -6.945 7.699 -19.436 1.00 0.00 C ATOM 726 CG1 ILE A 45 -6.995 6.193 -19.140 1.00 0.00 C ATOM 727 CG2 ILE A 45 -7.658 8.019 -20.748 1.00 0.00 C ATOM 728 CD1 ILE A 45 -6.255 5.332 -20.141 1.00 0.00 C ATOM 0 H ILE A 45 -5.305 8.031 -17.384 1.00 0.00 H new ATOM 0 HA ILE A 45 -4.964 7.792 -20.309 1.00 0.00 H new ATOM 0 HB ILE A 45 -7.473 8.225 -18.641 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -6.577 6.016 -18.149 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -8.037 5.876 -19.108 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -8.682 7.649 -20.705 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -7.668 9.098 -20.903 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -7.133 7.539 -21.574 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -6.343 4.284 -19.855 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -6.686 5.474 -21.132 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -5.203 5.617 -20.158 1.00 0.00 H new ATOM 740 N ASP A 46 -4.615 10.270 -20.358 1.00 0.00 N ATOM 741 CA ASP A 46 -4.548 11.716 -20.530 1.00 0.00 C ATOM 742 C ASP A 46 -5.721 12.162 -21.396 1.00 0.00 C ATOM 743 O ASP A 46 -5.710 11.967 -22.613 1.00 0.00 O ATOM 744 CB ASP A 46 -3.230 12.124 -21.186 1.00 0.00 C ATOM 745 CG ASP A 46 -2.986 13.618 -21.103 1.00 0.00 C ATOM 746 OD1 ASP A 46 -3.724 14.383 -21.761 1.00 0.00 O ATOM 747 OD2 ASP A 46 -2.061 14.028 -20.374 1.00 0.00 O ATOM 0 H ASP A 46 -3.955 9.741 -20.928 1.00 0.00 H new ATOM 0 HA ASP A 46 -4.601 12.196 -19.553 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -2.407 11.596 -20.703 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -3.236 11.816 -22.232 1.00 0.00 H new ATOM 752 N VAL A 47 -6.720 12.762 -20.767 1.00 0.00 N ATOM 753 CA VAL A 47 -7.922 13.192 -21.477 1.00 0.00 C ATOM 754 C VAL A 47 -7.679 14.353 -22.452 1.00 0.00 C ATOM 755 O VAL A 47 -8.354 14.444 -23.476 1.00 0.00 O ATOM 756 CB VAL A 47 -9.048 13.566 -20.485 1.00 0.00 C ATOM 757 CG1 VAL A 47 -9.372 12.382 -19.579 1.00 0.00 C ATOM 758 CG2 VAL A 47 -8.674 14.787 -19.656 1.00 0.00 C ATOM 0 H VAL A 47 -6.725 12.964 -19.767 1.00 0.00 H new ATOM 0 HA VAL A 47 -8.230 12.335 -22.077 1.00 0.00 H new ATOM 0 HB VAL A 47 -9.936 13.818 -21.065 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -10.166 12.661 -18.886 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -9.699 11.538 -20.186 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -8.482 12.100 -19.016 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -9.487 15.023 -18.969 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -7.768 14.577 -19.088 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -8.499 15.636 -20.317 1.00 0.00 H new ATOM 768 N LEU A 48 -6.737 15.244 -22.140 1.00 0.00 N ATOM 769 CA LEU A 48 -6.456 16.380 -23.024 1.00 0.00 C ATOM 770 C LEU A 48 -5.782 15.960 -24.330 1.00 0.00 C ATOM 771 O LEU A 48 -6.094 16.502 -25.390 1.00 0.00 O ATOM 772 CB LEU A 48 -5.614 17.447 -22.319 1.00 0.00 C ATOM 773 CG LEU A 48 -6.340 18.227 -21.220 1.00 0.00 C ATOM 774 CD1 LEU A 48 -5.380 19.169 -20.512 1.00 0.00 C ATOM 775 CD2 LEU A 48 -7.517 19.000 -21.799 1.00 0.00 C ATOM 0 H LEU A 48 -6.164 15.205 -21.297 1.00 0.00 H new ATOM 0 HA LEU A 48 -7.426 16.808 -23.277 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -4.738 16.967 -21.884 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -5.252 18.154 -23.066 1.00 0.00 H new ATOM 0 HG LEU A 48 -6.724 17.514 -20.490 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -5.914 19.715 -19.734 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -4.571 18.593 -20.062 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -4.966 19.875 -21.232 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -8.020 19.548 -21.002 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -7.157 19.702 -22.551 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -8.218 18.304 -22.259 1.00 0.00 H new ATOM 787 N LYS A 49 -4.853 15.006 -24.259 1.00 0.00 N ATOM 788 CA LYS A 49 -4.155 14.543 -25.459 1.00 0.00 C ATOM 789 C LYS A 49 -5.079 13.733 -26.360 1.00 0.00 C ATOM 790 O LYS A 49 -4.999 13.826 -27.585 1.00 0.00 O ATOM 791 CB LYS A 49 -2.911 13.723 -25.111 1.00 0.00 C ATOM 792 CG LYS A 49 -1.781 14.552 -24.521 1.00 0.00 C ATOM 793 CD LYS A 49 -0.478 13.769 -24.458 1.00 0.00 C ATOM 794 CE LYS A 49 -0.538 12.640 -23.442 1.00 0.00 C ATOM 795 NZ LYS A 49 0.759 11.917 -23.338 1.00 0.00 N ATOM 0 H LYS A 49 -4.569 14.544 -23.395 1.00 0.00 H new ATOM 0 HA LYS A 49 -3.835 15.433 -26.000 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -3.187 12.943 -24.401 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -2.552 13.223 -26.011 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -1.637 15.450 -25.122 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -2.056 14.880 -23.519 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -0.254 13.359 -25.443 1.00 0.00 H new ATOM 0 HD3 LYS A 49 0.338 14.444 -24.201 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -0.808 13.044 -22.466 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -1.323 11.939 -23.725 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 0.676 11.155 -22.635 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 1.005 11.510 -24.263 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 1.504 12.581 -23.043 1.00 0.00 H new ATOM 809 N ASN A 50 -5.951 12.934 -25.759 1.00 0.00 N ATOM 810 CA ASN A 50 -6.881 12.122 -26.535 1.00 0.00 C ATOM 811 C ASN A 50 -8.297 12.306 -26.026 1.00 0.00 C ATOM 812 O ASN A 50 -8.778 11.537 -25.189 1.00 0.00 O ATOM 813 CB ASN A 50 -6.508 10.647 -26.469 1.00 0.00 C ATOM 814 CG ASN A 50 -7.143 9.836 -27.583 1.00 0.00 C ATOM 815 OD1 ASN A 50 -8.339 9.952 -27.853 1.00 0.00 O ATOM 816 ND2 ASN A 50 -6.343 9.011 -28.246 1.00 0.00 N ATOM 0 H ASN A 50 -6.034 12.831 -24.748 1.00 0.00 H new ATOM 0 HA ASN A 50 -6.823 12.452 -27.572 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -5.424 10.547 -26.524 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -6.817 10.240 -25.506 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -6.714 8.445 -29.009 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -5.357 8.943 -27.992 1.00 0.00 H new ATOM 823 N PRO A 51 -8.978 13.339 -26.528 1.00 0.00 N ATOM 824 CA PRO A 51 -10.352 13.653 -26.138 1.00 0.00 C ATOM 825 C PRO A 51 -11.330 12.535 -26.489 1.00 0.00 C ATOM 826 O PRO A 51 -12.357 12.367 -25.830 1.00 0.00 O ATOM 827 CB PRO A 51 -10.667 14.927 -26.934 1.00 0.00 C ATOM 828 CG PRO A 51 -9.329 15.482 -27.291 1.00 0.00 C ATOM 829 CD PRO A 51 -8.465 14.288 -27.527 1.00 0.00 C ATOM 0 HA PRO A 51 -10.451 13.777 -25.060 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -11.255 14.704 -27.824 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -11.245 15.634 -26.339 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -9.387 16.109 -28.181 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -8.933 16.103 -26.488 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -8.566 13.906 -28.543 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -7.409 14.511 -27.374 1.00 0.00 H new ATOM 837 N GLN A 52 -11.000 11.776 -27.533 1.00 0.00 N ATOM 838 CA GLN A 52 -11.840 10.673 -27.986 1.00 0.00 C ATOM 839 C GLN A 52 -11.957 9.615 -26.908 1.00 0.00 C ATOM 840 O GLN A 52 -13.045 9.114 -26.643 1.00 0.00 O ATOM 841 CB GLN A 52 -11.256 10.037 -29.252 1.00 0.00 C ATOM 842 CG GLN A 52 -12.152 8.973 -29.870 1.00 0.00 C ATOM 843 CD GLN A 52 -11.557 8.362 -31.123 1.00 0.00 C ATOM 844 OE1 GLN A 52 -10.987 9.062 -31.958 1.00 0.00 O ATOM 845 NE2 GLN A 52 -11.682 7.048 -31.258 1.00 0.00 N ATOM 0 H GLN A 52 -10.151 11.908 -28.083 1.00 0.00 H new ATOM 0 HA GLN A 52 -12.829 11.075 -28.206 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -11.073 10.818 -29.989 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -10.290 9.592 -29.012 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -12.333 8.186 -29.138 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -13.120 9.414 -30.110 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -12.163 6.505 -30.541 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -11.297 6.581 -32.079 1.00 0.00 H new ATOM 854 N LEU A 53 -10.839 9.302 -26.264 1.00 0.00 N ATOM 855 CA LEU A 53 -10.841 8.287 -25.224 1.00 0.00 C ATOM 856 C LEU A 53 -11.582 8.794 -23.999 1.00 0.00 C ATOM 857 O LEU A 53 -12.270 8.030 -23.317 1.00 0.00 O ATOM 858 CB LEU A 53 -9.423 7.842 -24.880 1.00 0.00 C ATOM 859 CG LEU A 53 -8.714 7.092 -26.005 1.00 0.00 C ATOM 860 CD1 LEU A 53 -7.259 6.831 -25.647 1.00 0.00 C ATOM 861 CD2 LEU A 53 -9.433 5.791 -26.320 1.00 0.00 C ATOM 0 H LEU A 53 -9.931 9.732 -26.442 1.00 0.00 H new ATOM 0 HA LEU A 53 -11.366 7.409 -25.599 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -8.833 8.719 -24.615 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -9.458 7.203 -23.998 1.00 0.00 H new ATOM 0 HG LEU A 53 -8.736 7.718 -26.897 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -6.774 6.296 -26.463 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -6.749 7.780 -25.482 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -7.210 6.230 -24.739 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -8.911 5.272 -27.124 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -9.449 5.160 -25.432 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -10.455 6.006 -26.630 1.00 0.00 H new ATOM 873 N ALA A 54 -11.436 10.092 -23.720 1.00 0.00 N ATOM 874 CA ALA A 54 -12.118 10.704 -22.592 1.00 0.00 C ATOM 875 C ALA A 54 -13.622 10.642 -22.811 1.00 0.00 C ATOM 876 O ALA A 54 -14.383 10.356 -21.894 1.00 0.00 O ATOM 877 CB ALA A 54 -11.669 12.145 -22.412 1.00 0.00 C ATOM 0 H ALA A 54 -10.853 10.731 -24.261 1.00 0.00 H new ATOM 0 HA ALA A 54 -11.865 10.154 -21.685 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -12.191 12.585 -21.563 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -10.594 12.171 -22.231 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -11.899 12.713 -23.313 1.00 0.00 H new ATOM 883 N GLU A 55 -14.033 10.923 -24.046 1.00 0.00 N ATOM 884 CA GLU A 55 -15.438 10.879 -24.432 1.00 0.00 C ATOM 885 C GLU A 55 -15.959 9.446 -24.395 1.00 0.00 C ATOM 886 O GLU A 55 -17.100 9.207 -24.001 1.00 0.00 O ATOM 887 CB GLU A 55 -15.638 11.478 -25.827 1.00 0.00 C ATOM 888 CG GLU A 55 -17.100 11.544 -26.256 1.00 0.00 C ATOM 889 CD GLU A 55 -17.284 12.173 -27.625 1.00 0.00 C ATOM 890 OE1 GLU A 55 -16.269 12.550 -28.249 1.00 0.00 O ATOM 891 OE2 GLU A 55 -18.444 12.288 -28.071 1.00 0.00 O ATOM 0 H GLU A 55 -13.402 11.186 -24.803 1.00 0.00 H new ATOM 0 HA GLU A 55 -16.004 11.475 -23.716 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -15.216 12.483 -25.846 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -15.081 10.884 -26.552 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -17.517 10.537 -26.265 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -17.664 12.116 -25.520 1.00 0.00 H new ATOM 898 N GLU A 56 -15.118 8.498 -24.812 1.00 0.00 N ATOM 899 CA GLU A 56 -15.504 7.089 -24.829 1.00 0.00 C ATOM 900 C GLU A 56 -15.850 6.614 -23.419 1.00 0.00 C ATOM 901 O GLU A 56 -16.808 5.865 -23.229 1.00 0.00 O ATOM 902 CB GLU A 56 -14.380 6.220 -25.411 1.00 0.00 C ATOM 903 CG GLU A 56 -14.111 6.459 -26.893 1.00 0.00 C ATOM 904 CD GLU A 56 -13.097 5.492 -27.473 1.00 0.00 C ATOM 905 OE1 GLU A 56 -12.600 4.628 -26.723 1.00 0.00 O ATOM 906 OE2 GLU A 56 -12.798 5.604 -28.682 1.00 0.00 O ATOM 0 H GLU A 56 -14.170 8.681 -25.141 1.00 0.00 H new ATOM 0 HA GLU A 56 -16.384 6.989 -25.464 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -13.464 6.408 -24.852 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -14.634 5.170 -25.264 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -15.046 6.371 -27.446 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -13.753 7.479 -27.032 1.00 0.00 H new ATOM 913 N ASP A 57 -15.072 7.051 -22.427 1.00 0.00 N ATOM 914 CA ASP A 57 -15.344 6.676 -21.040 1.00 0.00 C ATOM 915 C ASP A 57 -16.120 7.778 -20.316 1.00 0.00 C ATOM 916 O ASP A 57 -16.292 7.720 -19.098 1.00 0.00 O ATOM 917 CB ASP A 57 -14.053 6.324 -20.282 1.00 0.00 C ATOM 918 CG ASP A 57 -13.451 5.002 -20.714 1.00 0.00 C ATOM 919 OD1 ASP A 57 -14.143 4.225 -21.403 1.00 0.00 O ATOM 920 OD2 ASP A 57 -12.281 4.743 -20.356 1.00 0.00 O ATOM 0 H ASP A 57 -14.261 7.656 -22.555 1.00 0.00 H new ATOM 0 HA ASP A 57 -15.965 5.780 -21.061 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -13.321 7.117 -20.435 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -14.265 6.288 -19.213 1.00 0.00 H new ATOM 925 N LYS A 58 -16.586 8.769 -21.086 1.00 0.00 N ATOM 926 CA LYS A 58 -17.381 9.891 -20.564 1.00 0.00 C ATOM 927 C LYS A 58 -16.726 10.567 -19.359 1.00 0.00 C ATOM 928 O LYS A 58 -17.356 10.756 -18.318 1.00 0.00 O ATOM 929 CB LYS A 58 -18.796 9.424 -20.215 1.00 0.00 C ATOM 930 CG LYS A 58 -19.593 8.962 -21.428 1.00 0.00 C ATOM 931 CD LYS A 58 -20.994 8.519 -21.041 1.00 0.00 C ATOM 932 CE LYS A 58 -21.799 8.088 -22.257 1.00 0.00 C ATOM 933 NZ LYS A 58 -21.192 6.911 -22.938 1.00 0.00 N ATOM 0 H LYS A 58 -16.423 8.817 -22.092 1.00 0.00 H new ATOM 0 HA LYS A 58 -17.434 10.639 -21.355 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -18.735 8.607 -19.496 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -19.330 10.239 -19.727 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -19.655 9.773 -22.154 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -19.071 8.138 -21.914 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -20.933 7.693 -20.333 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -21.508 9.336 -20.534 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -22.817 7.845 -21.951 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -21.867 8.918 -22.960 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -21.866 6.524 -23.629 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -20.323 7.204 -23.428 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -20.963 6.182 -22.233 1.00 0.00 H new ATOM 947 N ILE A 59 -15.464 10.937 -19.514 1.00 0.00 N ATOM 948 CA ILE A 59 -14.724 11.588 -18.443 1.00 0.00 C ATOM 949 C ILE A 59 -14.956 13.097 -18.464 1.00 0.00 C ATOM 950 O ILE A 59 -14.450 13.804 -19.337 1.00 0.00 O ATOM 951 CB ILE A 59 -13.213 11.295 -18.568 1.00 0.00 C ATOM 952 CG1 ILE A 59 -12.971 9.785 -18.615 1.00 0.00 C ATOM 953 CG2 ILE A 59 -12.440 11.927 -17.418 1.00 0.00 C ATOM 954 CD1 ILE A 59 -13.472 9.052 -17.390 1.00 0.00 C ATOM 0 H ILE A 59 -14.930 10.798 -20.372 1.00 0.00 H new ATOM 0 HA ILE A 59 -15.087 11.188 -17.496 1.00 0.00 H new ATOM 0 HB ILE A 59 -12.852 11.736 -19.497 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -13.460 9.375 -19.499 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -11.903 9.600 -18.727 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -11.378 11.706 -17.529 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -12.589 13.007 -17.429 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -12.798 11.521 -16.472 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -13.266 7.987 -17.494 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -12.965 9.435 -16.504 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -14.546 9.206 -17.288 1.00 0.00 H new ATOM 966 N LEU A 60 -15.733 13.580 -17.500 1.00 0.00 N ATOM 967 CA LEU A 60 -16.038 15.005 -17.400 1.00 0.00 C ATOM 968 C LEU A 60 -15.310 15.652 -16.224 1.00 0.00 C ATOM 969 O LEU A 60 -15.465 16.847 -15.972 1.00 0.00 O ATOM 970 CB LEU A 60 -17.548 15.215 -17.256 1.00 0.00 C ATOM 971 CG LEU A 60 -18.399 14.672 -18.409 1.00 0.00 C ATOM 972 CD1 LEU A 60 -19.878 14.866 -18.118 1.00 0.00 C ATOM 973 CD2 LEU A 60 -18.021 15.348 -19.719 1.00 0.00 C ATOM 0 H LEU A 60 -16.164 13.006 -16.776 1.00 0.00 H new ATOM 0 HA LEU A 60 -15.692 15.483 -18.317 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -17.877 14.743 -16.330 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -17.741 16.283 -17.155 1.00 0.00 H new ATOM 0 HG LEU A 60 -18.204 13.604 -18.505 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -20.466 14.474 -18.948 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -20.142 14.335 -17.204 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -20.088 15.928 -17.994 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -18.636 14.949 -20.525 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -18.185 16.422 -19.635 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -16.970 15.158 -19.937 1.00 0.00 H new ATOM 985 N ALA A 61 -14.514 14.864 -15.507 1.00 0.00 N ATOM 986 CA ALA A 61 -13.778 15.371 -14.354 1.00 0.00 C ATOM 987 C ALA A 61 -12.371 14.787 -14.294 1.00 0.00 C ATOM 988 O ALA A 61 -12.144 13.650 -14.704 1.00 0.00 O ATOM 989 CB ALA A 61 -14.531 15.060 -13.067 1.00 0.00 C ATOM 0 H ALA A 61 -14.363 13.875 -15.704 1.00 0.00 H new ATOM 0 HA ALA A 61 -13.690 16.452 -14.463 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -13.970 15.444 -12.215 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -15.513 15.532 -13.097 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -14.650 13.981 -12.966 1.00 0.00 H new ATOM 995 N THR A 62 -11.433 15.576 -13.780 1.00 0.00 N ATOM 996 CA THR A 62 -10.046 15.161 -13.648 1.00 0.00 C ATOM 997 C THR A 62 -9.408 15.812 -12.423 1.00 0.00 C ATOM 998 O THR A 62 -9.643 16.990 -12.151 1.00 0.00 O ATOM 999 CB THR A 62 -9.208 15.554 -14.887 1.00 0.00 C ATOM 1000 OG1 THR A 62 -9.430 16.933 -15.205 1.00 0.00 O ATOM 1001 CG2 THR A 62 -9.536 14.690 -16.095 1.00 0.00 C ATOM 0 H THR A 62 -11.616 16.521 -13.444 1.00 0.00 H new ATOM 0 HA THR A 62 -10.052 14.076 -13.547 1.00 0.00 H new ATOM 0 HB THR A 62 -8.159 15.392 -14.640 1.00 0.00 H new ATOM 0 HG1 THR A 62 -9.795 17.005 -16.112 1.00 0.00 H new ATOM 0 HG21 THR A 62 -8.924 15.001 -16.942 1.00 0.00 H new ATOM 0 HG22 THR A 62 -9.329 13.645 -15.862 1.00 0.00 H new ATOM 0 HG23 THR A 62 -10.590 14.803 -16.348 1.00 0.00 H new ATOM 1009 N PRO A 63 -8.594 15.057 -11.668 1.00 0.00 N ATOM 1010 CA PRO A 63 -8.329 13.647 -11.946 1.00 0.00 C ATOM 1011 C PRO A 63 -9.448 12.726 -11.454 1.00 0.00 C ATOM 1012 O PRO A 63 -10.155 13.038 -10.496 1.00 0.00 O ATOM 1013 CB PRO A 63 -7.036 13.385 -11.178 1.00 0.00 C ATOM 1014 CG PRO A 63 -7.082 14.322 -10.025 1.00 0.00 C ATOM 1015 CD PRO A 63 -7.844 15.538 -10.489 1.00 0.00 C ATOM 0 HA PRO A 63 -8.260 13.445 -13.015 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -6.978 12.349 -10.844 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -6.161 13.568 -11.802 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -7.574 13.860 -9.169 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -6.076 14.594 -9.706 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -8.514 15.910 -9.714 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -7.172 16.356 -10.749 1.00 0.00 H new ATOM 1023 N THR A 64 -9.591 11.591 -12.119 1.00 0.00 N ATOM 1024 CA THR A 64 -10.589 10.595 -11.745 1.00 0.00 C ATOM 1025 C THR A 64 -9.911 9.241 -11.573 1.00 0.00 C ATOM 1026 O THR A 64 -9.153 8.803 -12.439 1.00 0.00 O ATOM 1027 CB THR A 64 -11.729 10.473 -12.784 1.00 0.00 C ATOM 1028 OG1 THR A 64 -12.404 11.728 -12.917 1.00 0.00 O ATOM 1029 CG2 THR A 64 -12.739 9.407 -12.379 1.00 0.00 C ATOM 0 H THR A 64 -9.025 11.333 -12.927 1.00 0.00 H new ATOM 0 HA THR A 64 -11.040 10.922 -10.808 1.00 0.00 H new ATOM 0 HB THR A 64 -11.281 10.185 -13.735 1.00 0.00 H new ATOM 0 HG1 THR A 64 -12.004 12.238 -13.652 1.00 0.00 H new ATOM 0 HG21 THR A 64 -13.526 9.347 -13.131 1.00 0.00 H new ATOM 0 HG22 THR A 64 -12.238 8.442 -12.301 1.00 0.00 H new ATOM 0 HG23 THR A 64 -13.176 9.668 -11.415 1.00 0.00 H new ATOM 1037 N LEU A 65 -10.183 8.591 -10.454 1.00 0.00 N ATOM 1038 CA LEU A 65 -9.599 7.293 -10.155 1.00 0.00 C ATOM 1039 C LEU A 65 -10.643 6.200 -10.352 1.00 0.00 C ATOM 1040 O LEU A 65 -11.664 6.191 -9.674 1.00 0.00 O ATOM 1041 CB LEU A 65 -9.100 7.281 -8.705 1.00 0.00 C ATOM 1042 CG LEU A 65 -8.347 6.020 -8.278 1.00 0.00 C ATOM 1043 CD1 LEU A 65 -7.058 5.877 -9.073 1.00 0.00 C ATOM 1044 CD2 LEU A 65 -8.052 6.056 -6.785 1.00 0.00 C ATOM 0 H LEU A 65 -10.810 8.944 -9.731 1.00 0.00 H new ATOM 0 HA LEU A 65 -8.761 7.109 -10.827 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -8.447 8.141 -8.557 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -9.956 7.413 -8.043 1.00 0.00 H new ATOM 0 HG LEU A 65 -8.977 5.155 -8.483 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -6.534 4.975 -8.757 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -7.292 5.808 -10.135 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -6.424 6.746 -8.897 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -7.516 5.151 -6.498 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -7.440 6.928 -6.556 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -8.989 6.114 -6.230 1.00 0.00 H new ATOM 1056 N ALA A 66 -10.400 5.285 -11.281 1.00 0.00 N ATOM 1057 CA ALA A 66 -11.349 4.206 -11.531 1.00 0.00 C ATOM 1058 C ALA A 66 -10.642 2.876 -11.737 1.00 0.00 C ATOM 1059 O ALA A 66 -9.646 2.783 -12.454 1.00 0.00 O ATOM 1060 CB ALA A 66 -12.223 4.518 -12.737 1.00 0.00 C ATOM 0 H ALA A 66 -9.566 5.266 -11.867 1.00 0.00 H new ATOM 0 HA ALA A 66 -11.981 4.124 -10.647 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -12.922 3.698 -12.902 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -12.779 5.438 -12.555 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -11.595 4.642 -13.619 1.00 0.00 H new ATOM 1066 N LYS A 67 -11.176 1.844 -11.095 1.00 0.00 N ATOM 1067 CA LYS A 67 -10.635 0.507 -11.215 1.00 0.00 C ATOM 1068 C LYS A 67 -11.432 -0.222 -12.275 1.00 0.00 C ATOM 1069 O LYS A 67 -12.571 -0.625 -12.038 1.00 0.00 O ATOM 1070 CB LYS A 67 -10.724 -0.224 -9.867 1.00 0.00 C ATOM 1071 CG LYS A 67 -10.411 -1.717 -9.938 1.00 0.00 C ATOM 1072 CD LYS A 67 -10.156 -2.320 -8.559 1.00 0.00 C ATOM 1073 CE LYS A 67 -11.416 -2.923 -7.947 1.00 0.00 C ATOM 1074 NZ LYS A 67 -12.032 -3.947 -8.834 1.00 0.00 N ATOM 0 H LYS A 67 -11.989 1.915 -10.483 1.00 0.00 H new ATOM 0 HA LYS A 67 -9.584 0.544 -11.500 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -10.035 0.247 -9.166 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -11.728 -0.094 -9.463 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -11.242 -2.238 -10.412 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -9.536 -1.873 -10.568 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -9.389 -3.091 -8.638 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -9.766 -1.549 -7.895 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -11.171 -3.376 -6.986 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -12.139 -2.131 -7.751 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -12.966 -3.616 -9.150 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -11.422 -4.102 -9.662 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -12.139 -4.840 -8.311 1.00 0.00 H new ATOM 1088 N VAL A 68 -10.847 -0.380 -13.445 1.00 0.00 N ATOM 1089 CA VAL A 68 -11.536 -1.036 -14.539 1.00 0.00 C ATOM 1090 C VAL A 68 -11.485 -2.550 -14.410 1.00 0.00 C ATOM 1091 O VAL A 68 -12.391 -3.247 -14.869 1.00 0.00 O ATOM 1092 CB VAL A 68 -10.967 -0.605 -15.903 1.00 0.00 C ATOM 1093 CG1 VAL A 68 -11.225 0.877 -16.140 1.00 0.00 C ATOM 1094 CG2 VAL A 68 -9.480 -0.914 -15.998 1.00 0.00 C ATOM 0 H VAL A 68 -9.901 -0.065 -13.663 1.00 0.00 H new ATOM 0 HA VAL A 68 -12.579 -0.723 -14.484 1.00 0.00 H new ATOM 0 HB VAL A 68 -11.477 -1.175 -16.680 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -10.817 1.167 -17.108 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -12.298 1.066 -16.127 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -10.744 1.460 -15.354 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -9.104 -0.599 -16.972 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -8.946 -0.379 -15.213 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -9.323 -1.986 -15.878 1.00 0.00 H new ATOM 1104 N LEU A 69 -10.434 -3.062 -13.777 1.00 0.00 N ATOM 1105 CA LEU A 69 -10.297 -4.508 -13.614 1.00 0.00 C ATOM 1106 C LEU A 69 -9.833 -4.868 -12.208 1.00 0.00 C ATOM 1107 O LEU A 69 -8.948 -4.213 -11.662 1.00 0.00 O ATOM 1108 CB LEU A 69 -9.306 -5.075 -14.640 1.00 0.00 C ATOM 1109 CG LEU A 69 -9.710 -4.916 -16.110 1.00 0.00 C ATOM 1110 CD1 LEU A 69 -8.565 -5.317 -17.026 1.00 0.00 C ATOM 1111 CD2 LEU A 69 -10.947 -5.747 -16.421 1.00 0.00 C ATOM 0 H LEU A 69 -9.676 -2.510 -13.374 1.00 0.00 H new ATOM 0 HA LEU A 69 -11.280 -4.949 -13.778 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -8.341 -4.590 -14.493 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -9.164 -6.136 -14.434 1.00 0.00 H new ATOM 0 HG LEU A 69 -9.945 -3.866 -16.285 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -8.871 -5.197 -18.065 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -7.701 -4.683 -16.827 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -8.301 -6.359 -16.843 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -11.217 -5.620 -17.469 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -10.738 -6.799 -16.225 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -11.774 -5.418 -15.791 1.00 0.00 H new ATOM 1123 N PRO A 70 -10.415 -5.923 -11.600 1.00 0.00 N ATOM 1124 CA PRO A 70 -11.500 -6.726 -12.192 1.00 0.00 C ATOM 1125 C PRO A 70 -12.834 -5.969 -12.233 1.00 0.00 C ATOM 1126 O PRO A 70 -13.069 -5.084 -11.412 1.00 0.00 O ATOM 1127 CB PRO A 70 -11.611 -7.939 -11.250 1.00 0.00 C ATOM 1128 CG PRO A 70 -10.388 -7.891 -10.396 1.00 0.00 C ATOM 1129 CD PRO A 70 -10.037 -6.439 -10.279 1.00 0.00 C ATOM 0 HA PRO A 70 -11.284 -6.989 -13.228 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -12.516 -7.884 -10.644 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -11.660 -8.871 -11.813 1.00 0.00 H new ATOM 0 HG2 PRO A 70 -10.576 -8.329 -9.416 1.00 0.00 H new ATOM 0 HG3 PRO A 70 -9.572 -8.457 -10.847 1.00 0.00 H new ATOM 0 HD2 PRO A 70 -10.590 -5.950 -9.477 1.00 0.00 H new ATOM 0 HD3 PRO A 70 -8.977 -6.291 -10.072 1.00 0.00 H new ATOM 1137 N PRO A 71 -13.717 -6.304 -13.193 1.00 0.00 N ATOM 1138 CA PRO A 71 -15.035 -5.663 -13.315 1.00 0.00 C ATOM 1139 C PRO A 71 -15.974 -6.073 -12.174 1.00 0.00 C ATOM 1140 O PRO A 71 -15.786 -7.129 -11.565 1.00 0.00 O ATOM 1141 CB PRO A 71 -15.556 -6.183 -14.659 1.00 0.00 C ATOM 1142 CG PRO A 71 -14.868 -7.489 -14.842 1.00 0.00 C ATOM 1143 CD PRO A 71 -13.501 -7.313 -14.245 1.00 0.00 C ATOM 0 HA PRO A 71 -14.976 -4.576 -13.263 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -16.639 -6.303 -14.646 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -15.322 -5.493 -15.470 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -15.412 -8.292 -14.345 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -14.804 -7.754 -15.897 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -13.119 -8.247 -13.834 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -12.779 -6.972 -14.987 1.00 0.00 H new ATOM 1151 N PRO A 72 -17.008 -5.260 -11.863 1.00 0.00 N ATOM 1152 CA PRO A 72 -17.309 -3.996 -12.558 1.00 0.00 C ATOM 1153 C PRO A 72 -16.330 -2.870 -12.222 1.00 0.00 C ATOM 1154 O PRO A 72 -15.560 -2.962 -11.267 1.00 0.00 O ATOM 1155 CB PRO A 72 -18.711 -3.648 -12.055 1.00 0.00 C ATOM 1156 CG PRO A 72 -18.776 -4.258 -10.699 1.00 0.00 C ATOM 1157 CD PRO A 72 -17.983 -5.533 -10.787 1.00 0.00 C ATOM 0 HA PRO A 72 -17.232 -4.108 -13.639 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -18.863 -2.569 -12.014 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -19.481 -4.053 -12.711 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -18.358 -3.588 -9.948 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -19.807 -4.458 -10.409 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -17.486 -5.763 -9.844 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -18.619 -6.385 -11.028 1.00 0.00 H new ATOM 1165 N VAL A 73 -16.375 -1.808 -13.023 1.00 0.00 N ATOM 1166 CA VAL A 73 -15.492 -0.662 -12.835 1.00 0.00 C ATOM 1167 C VAL A 73 -15.862 0.126 -11.575 1.00 0.00 C ATOM 1168 O VAL A 73 -17.009 0.539 -11.398 1.00 0.00 O ATOM 1169 CB VAL A 73 -15.544 0.281 -14.062 1.00 0.00 C ATOM 1170 CG1 VAL A 73 -14.646 1.495 -13.864 1.00 0.00 C ATOM 1171 CG2 VAL A 73 -15.165 -0.471 -15.330 1.00 0.00 C ATOM 0 H VAL A 73 -17.016 -1.718 -13.811 1.00 0.00 H new ATOM 0 HA VAL A 73 -14.480 -1.051 -12.722 1.00 0.00 H new ATOM 0 HB VAL A 73 -16.568 0.640 -14.167 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -14.704 2.138 -14.742 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -14.974 2.051 -12.985 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -13.616 1.167 -13.722 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -15.207 0.208 -16.182 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -14.154 -0.866 -15.230 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -15.862 -1.294 -15.487 1.00 0.00 H new ATOM 1181 N ARG A 74 -14.874 0.326 -10.709 1.00 0.00 N ATOM 1182 CA ARG A 74 -15.067 1.063 -9.465 1.00 0.00 C ATOM 1183 C ARG A 74 -14.508 2.468 -9.616 1.00 0.00 C ATOM 1184 O ARG A 74 -13.301 2.649 -9.753 1.00 0.00 O ATOM 1185 CB ARG A 74 -14.353 0.326 -8.324 1.00 0.00 C ATOM 1186 CG ARG A 74 -14.524 0.948 -6.943 1.00 0.00 C ATOM 1187 CD ARG A 74 -15.962 0.842 -6.446 1.00 0.00 C ATOM 1188 NE ARG A 74 -16.133 1.427 -5.115 1.00 0.00 N ATOM 1189 CZ ARG A 74 -16.349 2.719 -4.891 1.00 0.00 C ATOM 1190 NH1 ARG A 74 -16.446 3.563 -5.906 1.00 0.00 N ATOM 1191 NH2 ARG A 74 -16.477 3.164 -3.648 1.00 0.00 N ATOM 0 H ARG A 74 -13.923 -0.016 -10.848 1.00 0.00 H new ATOM 0 HA ARG A 74 -16.130 1.130 -9.235 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -14.719 -0.700 -8.291 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -13.289 0.278 -8.554 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -13.858 0.452 -6.237 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -14.228 1.997 -6.978 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -16.626 1.345 -7.150 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -16.259 -0.206 -6.421 1.00 0.00 H new ATOM 0 HE ARG A 74 -16.083 0.804 -4.309 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -16.355 3.222 -6.863 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -16.612 4.554 -5.731 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -16.410 2.515 -2.864 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -16.643 4.156 -3.476 1.00 0.00 H new ATOM 1205 N ARG A 75 -15.380 3.466 -9.578 1.00 0.00 N ATOM 1206 CA ARG A 75 -14.939 4.843 -9.724 1.00 0.00 C ATOM 1207 C ARG A 75 -14.870 5.531 -8.372 1.00 0.00 C ATOM 1208 O ARG A 75 -15.862 5.616 -7.647 1.00 0.00 O ATOM 1209 CB ARG A 75 -15.866 5.617 -10.654 1.00 0.00 C ATOM 1210 CG ARG A 75 -15.865 5.103 -12.083 1.00 0.00 C ATOM 1211 CD ARG A 75 -16.603 6.050 -13.014 1.00 0.00 C ATOM 1212 NE ARG A 75 -18.016 6.180 -12.661 1.00 0.00 N ATOM 1213 CZ ARG A 75 -18.973 5.375 -13.120 1.00 0.00 C ATOM 1214 NH1 ARG A 75 -18.671 4.386 -13.952 1.00 0.00 N ATOM 1215 NH2 ARG A 75 -20.232 5.561 -12.745 1.00 0.00 N ATOM 0 H ARG A 75 -16.385 3.349 -9.449 1.00 0.00 H new ATOM 0 HA ARG A 75 -13.941 4.828 -10.162 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -16.882 5.571 -10.261 1.00 0.00 H new ATOM 0 HB3 ARG A 75 -15.572 6.667 -10.655 1.00 0.00 H new ATOM 0 HG2 ARG A 75 -14.838 4.980 -12.426 1.00 0.00 H new ATOM 0 HG3 ARG A 75 -16.332 4.119 -12.117 1.00 0.00 H new ATOM 0 HD2 ARG A 75 -16.130 7.031 -12.981 1.00 0.00 H new ATOM 0 HD3 ARG A 75 -16.518 5.689 -14.039 1.00 0.00 H new ATOM 0 HE ARG A 75 -18.285 6.931 -12.026 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -17.704 4.241 -14.242 1.00 0.00 H new ATOM 0 HH12 ARG A 75 -19.406 3.771 -14.302 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -20.467 6.320 -12.106 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -20.965 4.945 -13.096 1.00 0.00 H new ATOM 1229 N ILE A 76 -13.694 6.037 -8.050 1.00 0.00 N ATOM 1230 CA ILE A 76 -13.470 6.717 -6.785 1.00 0.00 C ATOM 1231 C ILE A 76 -13.359 8.226 -7.009 1.00 0.00 C ATOM 1232 O ILE A 76 -12.466 8.693 -7.718 1.00 0.00 O ATOM 1233 CB ILE A 76 -12.195 6.191 -6.094 1.00 0.00 C ATOM 1234 CG1 ILE A 76 -12.302 4.677 -5.901 1.00 0.00 C ATOM 1235 CG2 ILE A 76 -11.975 6.889 -4.755 1.00 0.00 C ATOM 1236 CD1 ILE A 76 -11.063 4.052 -5.316 1.00 0.00 C ATOM 0 H ILE A 76 -12.872 5.990 -8.652 1.00 0.00 H new ATOM 0 HA ILE A 76 -14.321 6.514 -6.135 1.00 0.00 H new ATOM 0 HB ILE A 76 -11.336 6.409 -6.729 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -13.149 4.462 -5.250 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -12.514 4.211 -6.863 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -11.070 6.501 -4.287 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -11.869 7.962 -4.917 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -12.829 6.703 -4.103 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -11.213 2.978 -5.208 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -10.216 4.235 -5.977 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -10.861 4.490 -4.338 1.00 0.00 H new ATOM 1248 N ILE A 77 -14.272 8.982 -6.404 1.00 0.00 N ATOM 1249 CA ILE A 77 -14.281 10.436 -6.553 1.00 0.00 C ATOM 1250 C ILE A 77 -14.032 11.117 -5.209 1.00 0.00 C ATOM 1251 O ILE A 77 -14.728 10.850 -4.228 1.00 0.00 O ATOM 1252 CB ILE A 77 -15.624 10.937 -7.137 1.00 0.00 C ATOM 1253 CG1 ILE A 77 -15.930 10.245 -8.472 1.00 0.00 C ATOM 1254 CG2 ILE A 77 -15.605 12.451 -7.320 1.00 0.00 C ATOM 1255 CD1 ILE A 77 -14.888 10.492 -9.545 1.00 0.00 C ATOM 0 H ILE A 77 -15.013 8.614 -5.808 1.00 0.00 H new ATOM 0 HA ILE A 77 -13.480 10.694 -7.246 1.00 0.00 H new ATOM 0 HB ILE A 77 -16.412 10.685 -6.428 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -16.015 9.172 -8.302 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -16.899 10.588 -8.834 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -16.559 12.780 -7.732 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -15.441 12.932 -6.356 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -14.801 12.725 -8.004 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -15.175 9.970 -10.458 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -14.818 11.561 -9.745 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -13.921 10.122 -9.205 1.00 0.00 H new ATOM 1267 N GLY A 78 -13.033 11.991 -5.169 1.00 0.00 N ATOM 1268 CA GLY A 78 -12.707 12.698 -3.945 1.00 0.00 C ATOM 1269 C GLY A 78 -11.370 13.399 -4.041 1.00 0.00 C ATOM 1270 O GLY A 78 -10.814 13.532 -5.132 1.00 0.00 O ATOM 0 H GLY A 78 -12.441 12.223 -5.966 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -13.486 13.429 -3.729 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -12.690 11.995 -3.112 1.00 0.00 H new ATOM 1274 N ASP A 79 -10.847 13.850 -2.906 1.00 0.00 N ATOM 1275 CA ASP A 79 -9.557 14.528 -2.885 1.00 0.00 C ATOM 1276 C ASP A 79 -8.440 13.493 -2.859 1.00 0.00 C ATOM 1277 O ASP A 79 -8.145 12.910 -1.815 1.00 0.00 O ATOM 1278 CB ASP A 79 -9.449 15.452 -1.667 1.00 0.00 C ATOM 1279 CG ASP A 79 -8.161 16.255 -1.652 1.00 0.00 C ATOM 1280 OD1 ASP A 79 -7.477 16.309 -2.698 1.00 0.00 O ATOM 1281 OD2 ASP A 79 -7.835 16.828 -0.593 1.00 0.00 O ATOM 0 H ASP A 79 -11.294 13.759 -1.994 1.00 0.00 H new ATOM 0 HA ASP A 79 -9.465 15.138 -3.783 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -10.298 16.135 -1.658 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -9.511 14.855 -0.757 1.00 0.00 H new ATOM 1286 N LEU A 80 -7.810 13.282 -4.009 1.00 0.00 N ATOM 1287 CA LEU A 80 -6.742 12.295 -4.123 1.00 0.00 C ATOM 1288 C LEU A 80 -5.374 12.886 -3.791 1.00 0.00 C ATOM 1289 O LEU A 80 -4.370 12.178 -3.815 1.00 0.00 O ATOM 1290 CB LEU A 80 -6.709 11.706 -5.536 1.00 0.00 C ATOM 1291 CG LEU A 80 -7.979 10.979 -5.982 1.00 0.00 C ATOM 1292 CD1 LEU A 80 -7.852 10.542 -7.433 1.00 0.00 C ATOM 1293 CD2 LEU A 80 -8.255 9.779 -5.087 1.00 0.00 C ATOM 0 H LEU A 80 -8.019 13.780 -4.874 1.00 0.00 H new ATOM 0 HA LEU A 80 -6.956 11.510 -3.398 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -6.507 12.512 -6.241 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -5.873 11.010 -5.600 1.00 0.00 H new ATOM 0 HG LEU A 80 -8.819 11.668 -5.896 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -8.762 10.026 -7.739 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -7.702 11.417 -8.065 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -7.001 9.869 -7.537 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -9.162 9.276 -5.422 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -7.416 9.085 -5.139 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -8.385 10.115 -4.058 1.00 0.00 H new ATOM 1305 N SER A 81 -5.329 14.183 -3.503 1.00 0.00 N ATOM 1306 CA SER A 81 -4.068 14.837 -3.156 1.00 0.00 C ATOM 1307 C SER A 81 -3.571 14.337 -1.800 1.00 0.00 C ATOM 1308 O SER A 81 -2.389 14.448 -1.475 1.00 0.00 O ATOM 1309 CB SER A 81 -4.236 16.357 -3.133 1.00 0.00 C ATOM 1310 OG SER A 81 -4.618 16.849 -4.407 1.00 0.00 O ATOM 0 H SER A 81 -6.142 14.799 -3.502 1.00 0.00 H new ATOM 0 HA SER A 81 -3.328 14.586 -3.916 1.00 0.00 H new ATOM 0 HB2 SER A 81 -4.988 16.631 -2.394 1.00 0.00 H new ATOM 0 HB3 SER A 81 -3.301 16.824 -2.825 1.00 0.00 H new ATOM 0 HG SER A 81 -4.720 17.823 -4.364 1.00 0.00 H new ATOM 1316 N ASN A 82 -4.497 13.810 -1.007 1.00 0.00 N ATOM 1317 CA ASN A 82 -4.174 13.260 0.301 1.00 0.00 C ATOM 1318 C ASN A 82 -3.770 11.798 0.146 1.00 0.00 C ATOM 1319 O ASN A 82 -4.564 10.971 -0.309 1.00 0.00 O ATOM 1320 CB ASN A 82 -5.371 13.395 1.246 1.00 0.00 C ATOM 1321 CG ASN A 82 -5.079 12.907 2.658 1.00 0.00 C ATOM 1322 OD1 ASN A 82 -3.957 12.518 2.982 1.00 0.00 O ATOM 1323 ND2 ASN A 82 -6.096 12.925 3.509 1.00 0.00 N ATOM 0 H ASN A 82 -5.486 13.753 -1.252 1.00 0.00 H new ATOM 0 HA ASN A 82 -3.341 13.815 0.733 1.00 0.00 H new ATOM 0 HB2 ASN A 82 -5.678 14.440 1.286 1.00 0.00 H new ATOM 0 HB3 ASN A 82 -6.211 12.831 0.840 1.00 0.00 H new ATOM 0 HD21 ASN A 82 -5.963 12.609 4.470 1.00 0.00 H new ATOM 0 HD22 ASN A 82 -7.011 13.255 3.203 1.00 0.00 H new ATOM 1330 N ARG A 83 -2.534 11.490 0.531 1.00 0.00 N ATOM 1331 CA ARG A 83 -2.006 10.133 0.409 1.00 0.00 C ATOM 1332 C ARG A 83 -2.836 9.132 1.209 1.00 0.00 C ATOM 1333 O ARG A 83 -3.011 7.995 0.774 1.00 0.00 O ATOM 1334 CB ARG A 83 -0.537 10.072 0.833 1.00 0.00 C ATOM 1335 CG ARG A 83 0.418 10.722 -0.159 1.00 0.00 C ATOM 1336 CD ARG A 83 1.047 11.981 0.414 1.00 0.00 C ATOM 1337 NE ARG A 83 0.221 13.160 0.164 1.00 0.00 N ATOM 1338 CZ ARG A 83 0.341 14.304 0.828 1.00 0.00 C ATOM 1339 NH1 ARG A 83 1.252 14.427 1.785 1.00 0.00 N ATOM 1340 NH2 ARG A 83 -0.450 15.326 0.529 1.00 0.00 N ATOM 0 H ARG A 83 -1.879 12.162 0.930 1.00 0.00 H new ATOM 0 HA ARG A 83 -2.071 9.856 -0.643 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -0.428 10.560 1.801 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -0.251 9.029 0.968 1.00 0.00 H new ATOM 0 HG2 ARG A 83 1.201 10.014 -0.429 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -0.119 10.967 -1.075 1.00 0.00 H new ATOM 0 HD2 ARG A 83 1.192 11.859 1.487 1.00 0.00 H new ATOM 0 HD3 ARG A 83 2.033 12.128 -0.026 1.00 0.00 H new ATOM 0 HE ARG A 83 -0.491 13.101 -0.564 1.00 0.00 H new ATOM 0 HH11 ARG A 83 1.862 13.642 2.012 1.00 0.00 H new ATOM 0 HH12 ARG A 83 1.342 15.307 2.293 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -1.148 15.232 -0.209 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -0.360 16.206 1.037 1.00 0.00 H new ATOM 1354 N GLU A 84 -3.340 9.539 2.371 1.00 0.00 N ATOM 1355 CA GLU A 84 -4.153 8.646 3.192 1.00 0.00 C ATOM 1356 C GLU A 84 -5.415 8.183 2.474 1.00 0.00 C ATOM 1357 O GLU A 84 -5.736 7.001 2.523 1.00 0.00 O ATOM 1358 CB GLU A 84 -4.526 9.315 4.512 1.00 0.00 C ATOM 1359 CG GLU A 84 -3.367 9.401 5.485 1.00 0.00 C ATOM 1360 CD GLU A 84 -3.667 10.277 6.686 1.00 0.00 C ATOM 1361 OE1 GLU A 84 -4.650 11.047 6.629 1.00 0.00 O ATOM 1362 OE2 GLU A 84 -2.920 10.193 7.682 1.00 0.00 O ATOM 0 H GLU A 84 -3.202 10.471 2.762 1.00 0.00 H new ATOM 0 HA GLU A 84 -3.544 7.764 3.391 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -4.898 10.319 4.311 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -5.341 8.760 4.976 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -3.112 8.398 5.828 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -2.492 9.792 4.966 1.00 0.00 H new ATOM 1369 N LYS A 85 -6.127 9.083 1.797 1.00 0.00 N ATOM 1370 CA LYS A 85 -7.339 8.672 1.084 1.00 0.00 C ATOM 1371 C LYS A 85 -6.994 7.709 -0.043 1.00 0.00 C ATOM 1372 O LYS A 85 -7.707 6.730 -0.263 1.00 0.00 O ATOM 1373 CB LYS A 85 -8.128 9.862 0.538 1.00 0.00 C ATOM 1374 CG LYS A 85 -8.832 10.697 1.589 1.00 0.00 C ATOM 1375 CD LYS A 85 -9.580 11.850 0.937 1.00 0.00 C ATOM 1376 CE LYS A 85 -10.221 12.760 1.973 1.00 0.00 C ATOM 1377 NZ LYS A 85 -11.242 12.044 2.788 1.00 0.00 N ATOM 0 H LYS A 85 -5.896 10.074 1.726 1.00 0.00 H new ATOM 0 HA LYS A 85 -7.977 8.166 1.809 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -7.448 10.505 -0.020 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -8.871 9.493 -0.170 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -9.529 10.074 2.150 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -8.104 11.084 2.302 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -8.892 12.428 0.320 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -10.349 11.456 0.273 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -9.449 13.162 2.630 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -10.687 13.609 1.472 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -11.761 12.729 3.374 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -11.908 11.553 2.157 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -10.771 11.349 3.402 1.00 0.00 H new ATOM 1391 N VAL A 86 -5.909 7.985 -0.750 1.00 0.00 N ATOM 1392 CA VAL A 86 -5.468 7.114 -1.829 1.00 0.00 C ATOM 1393 C VAL A 86 -5.057 5.748 -1.275 1.00 0.00 C ATOM 1394 O VAL A 86 -5.396 4.712 -1.844 1.00 0.00 O ATOM 1395 CB VAL A 86 -4.309 7.748 -2.630 1.00 0.00 C ATOM 1396 CG1 VAL A 86 -3.744 6.762 -3.642 1.00 0.00 C ATOM 1397 CG2 VAL A 86 -4.797 9.007 -3.327 1.00 0.00 C ATOM 0 H VAL A 86 -5.319 8.803 -0.597 1.00 0.00 H new ATOM 0 HA VAL A 86 -6.305 6.978 -2.513 1.00 0.00 H new ATOM 0 HB VAL A 86 -3.509 8.011 -1.938 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -2.930 7.233 -4.193 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -3.369 5.881 -3.121 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -4.529 6.465 -4.338 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -3.977 9.452 -3.891 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -5.610 8.754 -4.007 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -5.154 9.719 -2.583 1.00 0.00 H new ATOM 1407 N LEU A 87 -4.343 5.756 -0.150 1.00 0.00 N ATOM 1408 CA LEU A 87 -3.893 4.522 0.497 1.00 0.00 C ATOM 1409 C LEU A 87 -5.062 3.742 1.088 1.00 0.00 C ATOM 1410 O LEU A 87 -5.152 2.532 0.903 1.00 0.00 O ATOM 1411 CB LEU A 87 -2.888 4.833 1.604 1.00 0.00 C ATOM 1412 CG LEU A 87 -1.467 4.331 1.370 1.00 0.00 C ATOM 1413 CD1 LEU A 87 -0.524 4.933 2.404 1.00 0.00 C ATOM 1414 CD2 LEU A 87 -1.429 2.808 1.423 1.00 0.00 C ATOM 0 H LEU A 87 -4.062 6.608 0.335 1.00 0.00 H new ATOM 0 HA LEU A 87 -3.417 3.911 -0.270 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -2.853 5.913 1.744 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -3.257 4.402 2.535 1.00 0.00 H new ATOM 0 HG LEU A 87 -1.138 4.645 0.379 1.00 0.00 H new ATOM 0 HD11 LEU A 87 0.488 4.569 2.229 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -0.538 6.020 2.320 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -0.846 4.642 3.404 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -0.409 2.463 1.254 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -1.769 2.469 2.402 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -2.082 2.401 0.651 1.00 0.00 H new ATOM 1426 N ILE A 88 -5.943 4.431 1.802 1.00 0.00 N ATOM 1427 CA ILE A 88 -7.100 3.788 2.412 1.00 0.00 C ATOM 1428 C ILE A 88 -8.005 3.171 1.344 1.00 0.00 C ATOM 1429 O ILE A 88 -8.430 2.021 1.471 1.00 0.00 O ATOM 1430 CB ILE A 88 -7.878 4.787 3.296 1.00 0.00 C ATOM 1431 CG1 ILE A 88 -7.036 5.112 4.535 1.00 0.00 C ATOM 1432 CG2 ILE A 88 -9.240 4.228 3.692 1.00 0.00 C ATOM 1433 CD1 ILE A 88 -7.500 6.331 5.298 1.00 0.00 C ATOM 0 H ILE A 88 -5.879 5.435 1.973 1.00 0.00 H new ATOM 0 HA ILE A 88 -6.745 2.981 3.053 1.00 0.00 H new ATOM 0 HB ILE A 88 -8.060 5.701 2.731 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -7.048 4.252 5.204 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -6.001 5.262 4.228 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -9.764 4.954 4.314 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -9.826 4.028 2.795 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -9.105 3.302 4.251 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -6.851 6.490 6.159 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -7.460 7.204 4.647 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -8.524 6.179 5.639 1.00 0.00 H new ATOM 1445 N ALA A 89 -8.285 3.935 0.287 1.00 0.00 N ATOM 1446 CA ALA A 89 -9.112 3.444 -0.811 1.00 0.00 C ATOM 1447 C ALA A 89 -8.431 2.274 -1.519 1.00 0.00 C ATOM 1448 O ALA A 89 -9.081 1.295 -1.888 1.00 0.00 O ATOM 1449 CB ALA A 89 -9.419 4.563 -1.793 1.00 0.00 C ATOM 0 H ALA A 89 -7.952 4.892 0.170 1.00 0.00 H new ATOM 0 HA ALA A 89 -10.054 3.087 -0.396 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -10.036 4.176 -2.604 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -9.954 5.362 -1.279 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -8.487 4.954 -2.201 1.00 0.00 H new ATOM 1455 N LEU A 90 -7.111 2.382 -1.692 1.00 0.00 N ATOM 1456 CA LEU A 90 -6.321 1.341 -2.345 1.00 0.00 C ATOM 1457 C LEU A 90 -6.302 0.072 -1.491 1.00 0.00 C ATOM 1458 O LEU A 90 -6.431 -1.039 -2.009 1.00 0.00 O ATOM 1459 CB LEU A 90 -4.883 1.840 -2.591 1.00 0.00 C ATOM 1460 CG LEU A 90 -4.275 1.485 -3.949 1.00 0.00 C ATOM 1461 CD1 LEU A 90 -3.959 0.003 -4.020 1.00 0.00 C ATOM 1462 CD2 LEU A 90 -5.205 1.900 -5.079 1.00 0.00 C ATOM 0 H LEU A 90 -6.566 3.188 -1.385 1.00 0.00 H new ATOM 0 HA LEU A 90 -6.780 1.106 -3.305 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -4.872 2.925 -2.482 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -4.240 1.435 -1.810 1.00 0.00 H new ATOM 0 HG LEU A 90 -3.341 2.036 -4.063 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -3.527 -0.231 -4.993 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -3.247 -0.255 -3.236 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -4.875 -0.571 -3.882 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -4.754 1.639 -6.036 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -6.159 1.383 -4.974 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -5.370 2.977 -5.038 1.00 0.00 H new ATOM 1474 N ARG A 91 -6.149 0.249 -0.178 1.00 0.00 N ATOM 1475 CA ARG A 91 -6.118 -0.868 0.764 1.00 0.00 C ATOM 1476 C ARG A 91 -7.449 -1.621 0.776 1.00 0.00 C ATOM 1477 O ARG A 91 -7.473 -2.854 0.741 1.00 0.00 O ATOM 1478 CB ARG A 91 -5.798 -0.354 2.172 1.00 0.00 C ATOM 1479 CG ARG A 91 -5.676 -1.454 3.218 1.00 0.00 C ATOM 1480 CD ARG A 91 -5.273 -0.893 4.572 1.00 0.00 C ATOM 1481 NE ARG A 91 -6.299 -0.014 5.129 1.00 0.00 N ATOM 1482 CZ ARG A 91 -6.134 0.704 6.236 1.00 0.00 C ATOM 1483 NH1 ARG A 91 -4.988 0.647 6.903 1.00 0.00 N ATOM 1484 NH2 ARG A 91 -7.117 1.479 6.678 1.00 0.00 N ATOM 0 H ARG A 91 -6.044 1.165 0.259 1.00 0.00 H new ATOM 0 HA ARG A 91 -5.340 -1.560 0.443 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -4.865 0.208 2.139 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -6.578 0.342 2.480 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -6.627 -1.978 3.309 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -4.938 -2.187 2.892 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -5.086 -1.715 5.263 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -4.338 -0.341 4.472 1.00 0.00 H new ATOM 0 HE ARG A 91 -7.192 0.053 4.641 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -4.231 0.051 6.567 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -4.864 1.199 7.752 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -7.999 1.524 6.168 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -6.990 2.030 7.527 1.00 0.00 H new ATOM 1498 N LEU A 92 -8.554 -0.875 0.828 1.00 0.00 N ATOM 1499 CA LEU A 92 -9.887 -1.477 0.848 1.00 0.00 C ATOM 1500 C LEU A 92 -10.175 -2.249 -0.438 1.00 0.00 C ATOM 1501 O LEU A 92 -10.777 -3.325 -0.399 1.00 0.00 O ATOM 1502 CB LEU A 92 -10.961 -0.409 1.072 1.00 0.00 C ATOM 1503 CG LEU A 92 -10.977 0.217 2.470 1.00 0.00 C ATOM 1504 CD1 LEU A 92 -11.924 1.407 2.509 1.00 0.00 C ATOM 1505 CD2 LEU A 92 -11.377 -0.816 3.515 1.00 0.00 C ATOM 0 H LEU A 92 -8.552 0.145 0.857 1.00 0.00 H new ATOM 0 HA LEU A 92 -9.912 -2.183 1.678 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -10.820 0.384 0.338 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -11.938 -0.853 0.879 1.00 0.00 H new ATOM 0 HG LEU A 92 -9.971 0.568 2.701 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -11.923 1.840 3.509 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -11.596 2.157 1.789 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -12.932 1.078 2.257 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -11.383 -0.352 4.501 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -12.373 -1.197 3.287 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -10.663 -1.639 3.505 1.00 0.00 H new ATOM 1517 N LEU A 93 -9.748 -1.703 -1.575 1.00 0.00 N ATOM 1518 CA LEU A 93 -9.962 -2.369 -2.858 1.00 0.00 C ATOM 1519 C LEU A 93 -9.183 -3.680 -2.922 1.00 0.00 C ATOM 1520 O LEU A 93 -9.683 -4.689 -3.421 1.00 0.00 O ATOM 1521 CB LEU A 93 -9.539 -1.468 -4.022 1.00 0.00 C ATOM 1522 CG LEU A 93 -10.433 -0.255 -4.275 1.00 0.00 C ATOM 1523 CD1 LEU A 93 -9.792 0.667 -5.301 1.00 0.00 C ATOM 1524 CD2 LEU A 93 -11.814 -0.696 -4.741 1.00 0.00 C ATOM 0 H LEU A 93 -9.257 -0.811 -1.635 1.00 0.00 H new ATOM 0 HA LEU A 93 -11.028 -2.580 -2.945 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -8.524 -1.117 -3.836 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -9.507 -2.069 -4.931 1.00 0.00 H new ATOM 0 HG LEU A 93 -10.547 0.293 -3.340 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -10.439 1.527 -5.472 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -8.826 1.008 -4.930 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -9.651 0.127 -6.237 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -12.436 0.182 -4.916 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -11.721 -1.265 -5.666 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -12.274 -1.320 -3.975 1.00 0.00 H new ATOM 1536 N ALA A 94 -7.952 -3.650 -2.408 1.00 0.00 N ATOM 1537 CA ALA A 94 -7.078 -4.823 -2.408 1.00 0.00 C ATOM 1538 C ALA A 94 -7.646 -5.954 -1.571 1.00 0.00 C ATOM 1539 O ALA A 94 -7.523 -7.124 -1.939 1.00 0.00 O ATOM 1540 CB ALA A 94 -5.683 -4.452 -1.938 1.00 0.00 C ATOM 0 H ALA A 94 -7.537 -2.820 -1.984 1.00 0.00 H new ATOM 0 HA ALA A 94 -7.015 -5.182 -3.435 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -5.049 -5.338 -1.945 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -5.262 -3.699 -2.605 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -5.735 -4.051 -0.926 1.00 0.00 H new ATOM 1546 N GLU A 95 -8.255 -5.613 -0.440 1.00 0.00 N ATOM 1547 CA GLU A 95 -8.848 -6.611 0.438 1.00 0.00 C ATOM 1548 C GLU A 95 -9.958 -7.360 -0.291 1.00 0.00 C ATOM 1549 O GLU A 95 -10.121 -8.569 -0.125 1.00 0.00 O ATOM 1550 CB GLU A 95 -9.403 -5.939 1.696 1.00 0.00 C ATOM 1551 CG GLU A 95 -8.323 -5.419 2.635 1.00 0.00 C ATOM 1552 CD GLU A 95 -8.884 -4.580 3.766 1.00 0.00 C ATOM 1553 OE1 GLU A 95 -10.048 -4.140 3.662 1.00 0.00 O ATOM 1554 OE2 GLU A 95 -8.157 -4.365 4.760 1.00 0.00 O ATOM 0 H GLU A 95 -8.350 -4.652 -0.111 1.00 0.00 H new ATOM 0 HA GLU A 95 -8.078 -7.325 0.730 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -10.047 -5.110 1.401 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -10.028 -6.652 2.234 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -7.773 -6.263 3.052 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -7.609 -4.823 2.066 1.00 0.00 H new ATOM 1561 N GLU A 96 -10.719 -6.621 -1.094 1.00 0.00 N ATOM 1562 CA GLU A 96 -11.806 -7.198 -1.874 1.00 0.00 C ATOM 1563 C GLU A 96 -11.264 -8.214 -2.879 1.00 0.00 C ATOM 1564 O GLU A 96 -11.844 -9.283 -3.077 1.00 0.00 O ATOM 1565 CB GLU A 96 -12.555 -6.086 -2.620 1.00 0.00 C ATOM 1566 CG GLU A 96 -13.361 -5.169 -1.708 1.00 0.00 C ATOM 1567 CD GLU A 96 -14.420 -5.909 -0.914 1.00 0.00 C ATOM 1568 OE1 GLU A 96 -15.188 -6.681 -1.525 1.00 0.00 O ATOM 1569 OE2 GLU A 96 -14.480 -5.717 0.317 1.00 0.00 O ATOM 0 H GLU A 96 -10.600 -5.616 -1.221 1.00 0.00 H new ATOM 0 HA GLU A 96 -12.490 -7.707 -1.195 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -11.835 -5.487 -3.178 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -13.226 -6.539 -3.350 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -12.684 -4.664 -1.019 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -13.839 -4.396 -2.309 1.00 0.00 H new ATOM 1576 N ILE A 97 -10.144 -7.864 -3.505 1.00 0.00 N ATOM 1577 CA ILE A 97 -9.506 -8.723 -4.497 1.00 0.00 C ATOM 1578 C ILE A 97 -8.872 -9.949 -3.841 1.00 0.00 C ATOM 1579 O ILE A 97 -9.006 -11.066 -4.336 1.00 0.00 O ATOM 1580 CB ILE A 97 -8.440 -7.935 -5.284 1.00 0.00 C ATOM 1581 CG1 ILE A 97 -9.114 -6.753 -5.970 1.00 0.00 C ATOM 1582 CG2 ILE A 97 -7.739 -8.823 -6.311 1.00 0.00 C ATOM 1583 CD1 ILE A 97 -8.151 -5.802 -6.615 1.00 0.00 C ATOM 0 H ILE A 97 -9.656 -6.983 -3.341 1.00 0.00 H new ATOM 0 HA ILE A 97 -10.277 -9.066 -5.187 1.00 0.00 H new ATOM 0 HB ILE A 97 -7.677 -7.577 -4.593 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -9.803 -7.128 -6.727 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -9.711 -6.210 -5.237 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -6.993 -8.238 -6.849 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -7.250 -9.653 -5.801 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -8.473 -9.213 -7.016 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -8.703 -4.987 -7.083 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -7.478 -5.398 -5.859 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -7.571 -6.329 -7.373 1.00 0.00 H new ATOM 1595 N GLY A 98 -8.180 -9.722 -2.723 1.00 0.00 N ATOM 1596 CA GLY A 98 -7.534 -10.808 -2.000 1.00 0.00 C ATOM 1597 C GLY A 98 -8.522 -11.835 -1.476 1.00 0.00 C ATOM 1598 O GLY A 98 -8.219 -13.026 -1.429 1.00 0.00 O ATOM 0 H GLY A 98 -8.055 -8.800 -2.304 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -6.819 -11.301 -2.658 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -6.968 -10.396 -1.165 1.00 0.00 H new ATOM 1602 N ASP A 99 -9.696 -11.362 -1.063 1.00 0.00 N ATOM 1603 CA ASP A 99 -10.748 -12.233 -0.539 1.00 0.00 C ATOM 1604 C ASP A 99 -11.218 -13.237 -1.591 1.00 0.00 C ATOM 1605 O ASP A 99 -11.469 -14.402 -1.279 1.00 0.00 O ATOM 1606 CB ASP A 99 -11.936 -11.399 -0.052 1.00 0.00 C ATOM 1607 CG ASP A 99 -12.997 -12.242 0.626 1.00 0.00 C ATOM 1608 OD1 ASP A 99 -12.708 -12.806 1.702 1.00 0.00 O ATOM 1609 OD2 ASP A 99 -14.118 -12.335 0.083 1.00 0.00 O ATOM 0 H ASP A 99 -9.945 -10.373 -1.081 1.00 0.00 H new ATOM 0 HA ASP A 99 -10.329 -12.789 0.299 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -11.581 -10.639 0.644 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -12.379 -10.875 -0.899 1.00 0.00 H new ATOM 1614 N TYR A 100 -11.339 -12.779 -2.833 1.00 0.00 N ATOM 1615 CA TYR A 100 -11.788 -13.639 -3.919 1.00 0.00 C ATOM 1616 C TYR A 100 -10.620 -14.445 -4.482 1.00 0.00 C ATOM 1617 O TYR A 100 -9.717 -13.901 -5.116 1.00 0.00 O ATOM 1618 CB TYR A 100 -12.436 -12.802 -5.027 1.00 0.00 C ATOM 1619 CG TYR A 100 -12.988 -13.622 -6.174 1.00 0.00 C ATOM 1620 CD1 TYR A 100 -14.198 -14.293 -6.054 1.00 0.00 C ATOM 1621 CD2 TYR A 100 -12.298 -13.724 -7.376 1.00 0.00 C ATOM 1622 CE1 TYR A 100 -14.705 -15.043 -7.098 1.00 0.00 C ATOM 1623 CE2 TYR A 100 -12.799 -14.471 -8.425 1.00 0.00 C ATOM 1624 CZ TYR A 100 -14.002 -15.128 -8.281 1.00 0.00 C ATOM 1625 OH TYR A 100 -14.504 -15.873 -9.324 1.00 0.00 O ATOM 0 H TYR A 100 -11.133 -11.819 -3.111 1.00 0.00 H new ATOM 0 HA TYR A 100 -12.530 -14.333 -3.524 1.00 0.00 H new ATOM 0 HB2 TYR A 100 -13.243 -12.209 -4.596 1.00 0.00 H new ATOM 0 HB3 TYR A 100 -11.699 -12.101 -5.417 1.00 0.00 H new ATOM 0 HD1 TYR A 100 -14.752 -14.228 -5.129 1.00 0.00 H new ATOM 0 HD2 TYR A 100 -11.355 -13.211 -7.492 1.00 0.00 H new ATOM 0 HE1 TYR A 100 -15.647 -15.560 -6.988 1.00 0.00 H new ATOM 0 HE2 TYR A 100 -12.251 -14.540 -9.353 1.00 0.00 H new ATOM 0 HH TYR A 100 -14.209 -15.486 -10.174 1.00 0.00 H new ATOM 1635 N LYS A 101 -10.653 -15.746 -4.247 1.00 0.00 N ATOM 1636 CA LYS A 101 -9.607 -16.640 -4.725 1.00 0.00 C ATOM 1637 C LYS A 101 -10.144 -17.568 -5.810 1.00 0.00 C ATOM 1638 O LYS A 101 -11.305 -17.978 -5.769 1.00 0.00 O ATOM 1639 CB LYS A 101 -9.042 -17.462 -3.563 1.00 0.00 C ATOM 1640 CG LYS A 101 -8.387 -16.615 -2.480 1.00 0.00 C ATOM 1641 CD LYS A 101 -7.806 -17.472 -1.366 1.00 0.00 C ATOM 1642 CE LYS A 101 -8.898 -18.155 -0.552 1.00 0.00 C ATOM 1643 NZ LYS A 101 -9.776 -17.171 0.141 1.00 0.00 N ATOM 0 H LYS A 101 -11.396 -16.210 -3.725 1.00 0.00 H new ATOM 0 HA LYS A 101 -8.808 -16.035 -5.153 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -9.846 -18.048 -3.118 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -8.310 -18.170 -3.952 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -7.596 -16.008 -2.922 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -9.122 -15.926 -2.063 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -7.146 -18.226 -1.794 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -7.197 -16.851 -0.709 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -9.502 -18.780 -1.209 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -8.441 -18.815 0.185 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -10.321 -17.654 0.883 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -9.191 -16.426 0.570 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -10.430 -16.745 -0.546 1.00 0.00 H new ATOM 1657 N ASP A 102 -9.295 -17.898 -6.777 1.00 0.00 N ATOM 1658 CA ASP A 102 -9.693 -18.779 -7.871 1.00 0.00 C ATOM 1659 C ASP A 102 -9.453 -20.238 -7.498 1.00 0.00 C ATOM 1660 O ASP A 102 -8.329 -20.733 -7.582 1.00 0.00 O ATOM 1661 CB ASP A 102 -8.917 -18.435 -9.145 1.00 0.00 C ATOM 1662 CG ASP A 102 -9.403 -19.214 -10.353 1.00 0.00 C ATOM 1663 OD1 ASP A 102 -10.575 -19.648 -10.350 1.00 0.00 O ATOM 1664 OD2 ASP A 102 -8.612 -19.388 -11.302 1.00 0.00 O ATOM 0 H ASP A 102 -8.330 -17.571 -6.827 1.00 0.00 H new ATOM 0 HA ASP A 102 -10.757 -18.633 -8.055 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -9.009 -17.367 -9.345 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -7.858 -18.640 -8.987 1.00 0.00 H new ATOM 1669 N ASP A 103 -10.514 -20.920 -7.085 1.00 0.00 N ATOM 1670 CA ASP A 103 -10.417 -22.324 -6.702 1.00 0.00 C ATOM 1671 C ASP A 103 -11.417 -23.157 -7.498 1.00 0.00 C ATOM 1672 O ASP A 103 -12.625 -23.016 -7.325 1.00 0.00 O ATOM 1673 CB ASP A 103 -10.673 -22.488 -5.199 1.00 0.00 C ATOM 1674 CG ASP A 103 -10.334 -23.877 -4.684 1.00 0.00 C ATOM 1675 OD1 ASP A 103 -10.018 -24.764 -5.508 1.00 0.00 O ATOM 1676 OD2 ASP A 103 -10.374 -24.076 -3.453 1.00 0.00 O ATOM 0 H ASP A 103 -11.451 -20.525 -7.007 1.00 0.00 H new ATOM 0 HA ASP A 103 -9.409 -22.675 -6.924 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -10.083 -21.751 -4.654 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -11.721 -22.275 -4.990 1.00 0.00 H new ATOM 1681 N ASP A 104 -10.902 -24.015 -8.378 1.00 0.00 N ATOM 1682 CA ASP A 104 -11.746 -24.876 -9.208 1.00 0.00 C ATOM 1683 C ASP A 104 -12.517 -25.888 -8.359 1.00 0.00 C ATOM 1684 O ASP A 104 -13.610 -26.315 -8.727 1.00 0.00 O ATOM 1685 CB ASP A 104 -10.898 -25.611 -10.249 1.00 0.00 C ATOM 1686 CG ASP A 104 -11.742 -26.333 -11.281 1.00 0.00 C ATOM 1687 OD1 ASP A 104 -12.486 -25.654 -12.019 1.00 0.00 O ATOM 1688 OD2 ASP A 104 -11.655 -27.577 -11.353 1.00 0.00 O ATOM 0 H ASP A 104 -9.901 -24.133 -8.535 1.00 0.00 H new ATOM 0 HA ASP A 104 -12.468 -24.238 -9.717 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -10.247 -24.896 -10.753 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -10.252 -26.330 -9.745 1.00 0.00 H new ATOM 1693 N ASP A 105 -11.939 -26.272 -7.225 1.00 0.00 N ATOM 1694 CA ASP A 105 -12.576 -27.235 -6.334 1.00 0.00 C ATOM 1695 C ASP A 105 -13.482 -26.522 -5.333 1.00 0.00 C ATOM 1696 O ASP A 105 -12.999 -25.897 -4.389 1.00 0.00 O ATOM 1697 CB ASP A 105 -11.519 -28.054 -5.586 1.00 0.00 C ATOM 1698 CG ASP A 105 -12.122 -29.154 -4.731 1.00 0.00 C ATOM 1699 OD1 ASP A 105 -13.289 -29.529 -4.974 1.00 0.00 O ATOM 1700 OD2 ASP A 105 -11.423 -29.644 -3.820 1.00 0.00 O ATOM 0 H ASP A 105 -11.033 -25.932 -6.902 1.00 0.00 H new ATOM 0 HA ASP A 105 -13.182 -27.909 -6.940 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -10.832 -28.496 -6.307 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -10.932 -27.389 -4.953 1.00 0.00 H new ATOM 1705 N LYS A 106 -14.795 -26.627 -5.555 1.00 0.00 N ATOM 1706 CA LYS A 106 -15.794 -26.006 -4.680 1.00 0.00 C ATOM 1707 C LYS A 106 -15.596 -24.491 -4.592 1.00 0.00 C ATOM 1708 O LYS A 106 -15.575 -23.836 -5.654 1.00 0.00 O ATOM 1709 CB LYS A 106 -15.746 -26.632 -3.280 1.00 0.00 C ATOM 1710 CG LYS A 106 -16.171 -28.092 -3.250 1.00 0.00 C ATOM 1711 CD LYS A 106 -16.103 -28.665 -1.843 1.00 0.00 C ATOM 1712 CE LYS A 106 -16.557 -30.114 -1.809 1.00 0.00 C ATOM 1713 NZ LYS A 106 -15.675 -30.994 -2.627 1.00 0.00 N ATOM 1714 OXT LYS A 106 -15.474 -23.971 -3.460 1.00 0.00 O ATOM 0 H LYS A 106 -15.194 -27.141 -6.341 1.00 0.00 H new ATOM 0 HA LYS A 106 -16.776 -26.191 -5.115 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -14.732 -26.550 -2.889 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -16.392 -26.061 -2.613 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -17.188 -28.184 -3.632 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -15.528 -28.673 -3.912 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -15.082 -28.594 -1.469 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -16.728 -28.071 -1.177 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -16.566 -30.467 -0.778 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -17.580 -30.182 -2.178 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -15.913 -31.990 -2.444 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -15.815 -30.784 -3.636 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -14.681 -30.823 -2.372 1.00 0.00 H new TER 1728 LYS A 106