USER MOD reduce.3.24.130724 H: found=0, std=0, add=828, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 821 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 99 HIS : no HD1:sc= 0.108 K(o=0.22,f=-0.41) USER MOD Set 1.2: A 100 HIS : no HE2:sc= 0.114 K(o=0.22,f=-0.99) USER MOD Set 2.1: A 38 HIS : no HD1:sc= -1.68! C(o=-1.7!,f=-2.9!) USER MOD Set 2.2: A 89 THR OG1 : rot 180:sc= -0.0219 USER MOD Set 3.1: A 72 ASN : amide:sc= -2.05! C(o=-1.7!,f=-6.2!) USER MOD Set 3.2: A 92 LYS NZ :NH3+ -121:sc= 0.329 (180deg=0) USER MOD Set 4.1: A 23 ASN : amide:sc= 0.428 K(o=-0.45,f=-1.3) USER MOD Set 4.2: A 66 MET CE :methyl -173:sc= -0.882 (180deg=-0.864) USER MOD Set 5.1: A 19 GLN : amide:sc= -0.36! C(o=0.88!,f=-8.5!) USER MOD Set 5.2: A 62 LYS NZ :NH3+ 138:sc= 1.24 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ -164:sc= 1.3 (180deg=1.22) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ -105:sc= 0.386 (180deg=0) USER MOD Single : A 20 ASN : amide:sc= -0.0523 X(o=-0.052,f=-0.034) USER MOD Single : A 24 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 HIS : no HD1:sc= -0.291 X(o=-0.29,f=0.046) USER MOD Single : A 35 GLN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 37 LYS NZ :NH3+ 167:sc= 0.81 (180deg=0.617) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 MET CE :methyl 151:sc= -0.0537 (180deg=-1.18) USER MOD Single : A 52 THR OG1 : rot 39:sc= 0.198 USER MOD Single : A 65 THR OG1 : rot 79:sc= 1.24 USER MOD Single : A 69 ASN : amide:sc= -0.142! C(o=-0.14!,f=-4.1!) USER MOD Single : A 75 LYS NZ :NH3+ -138:sc= 1.12 (180deg=-0.926!) USER MOD Single : A 78 ASN : amide:sc= -0.0108 X(o=-0.011,f=-0.0011) USER MOD Single : A 83 TYR OH : rot 30:sc= 0 USER MOD Single : A 85 ASN : amide:sc= 1.07 K(o=1.1,f=-0.026) USER MOD Single : A 86 MET CE :methyl -123:sc= -0.776 (180deg=-1.33) USER MOD Single : A 91 LYS NZ :NH3+ 168:sc= 0.775 (180deg=0.486) USER MOD Single : A 96 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 97 HIS : no HD1:sc= 1.14 K(o=1.1,f=-4.1!) USER MOD Single : A 98 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 101 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 4 -9.737 -45.984 14.837 1.00 0.00 N ATOM 2 CA LYS A 4 -9.756 -45.545 16.239 1.00 0.00 C ATOM 3 C LYS A 4 -10.940 -46.181 16.983 1.00 0.00 C ATOM 4 O LYS A 4 -12.008 -45.577 17.121 1.00 0.00 O ATOM 5 CB LYS A 4 -9.792 -43.996 16.320 1.00 0.00 C ATOM 6 CG LYS A 4 -9.251 -43.388 17.617 1.00 0.00 C ATOM 7 CD LYS A 4 -10.160 -43.646 18.803 1.00 0.00 C ATOM 8 CE LYS A 4 -9.618 -42.992 20.062 1.00 0.00 C ATOM 9 NZ LYS A 4 -10.527 -43.183 21.216 1.00 0.00 N ATOM 0 HA LYS A 4 -8.841 -45.879 16.728 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -9.219 -43.593 15.485 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -10.823 -43.667 16.188 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -8.264 -43.801 17.824 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -9.126 -42.313 17.486 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -11.158 -43.261 18.591 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -10.260 -44.720 18.962 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -8.639 -43.411 20.297 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -9.474 -41.926 19.885 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -10.275 -42.513 21.971 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -11.509 -43.014 20.916 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -10.436 -44.156 21.572 1.00 0.00 H new ATOM 23 N VAL A 5 -10.751 -47.416 17.423 1.00 0.00 N ATOM 24 CA VAL A 5 -11.800 -48.154 18.118 1.00 0.00 C ATOM 25 C VAL A 5 -11.483 -48.278 19.604 1.00 0.00 C ATOM 26 O VAL A 5 -12.325 -48.683 20.414 1.00 0.00 O ATOM 27 CB VAL A 5 -11.997 -49.564 17.504 1.00 0.00 C ATOM 28 CG1 VAL A 5 -13.254 -50.242 18.046 1.00 0.00 C ATOM 29 CG2 VAL A 5 -12.041 -49.487 15.987 1.00 0.00 C ATOM 0 H VAL A 5 -9.878 -47.932 17.311 1.00 0.00 H new ATOM 0 HA VAL A 5 -12.727 -47.592 17.999 1.00 0.00 H new ATOM 0 HB VAL A 5 -11.142 -50.173 17.796 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -13.360 -51.228 17.593 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -13.173 -50.346 19.128 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -14.127 -49.636 17.804 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -12.180 -50.487 15.576 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -12.870 -48.850 15.679 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -11.105 -49.069 15.617 1.00 0.00 H new ATOM 39 N ILE A 6 -10.281 -47.908 19.965 1.00 0.00 N ATOM 40 CA ILE A 6 -9.874 -47.988 21.349 1.00 0.00 C ATOM 41 C ILE A 6 -10.418 -46.806 22.120 1.00 0.00 C ATOM 42 O ILE A 6 -9.899 -45.692 22.035 1.00 0.00 O ATOM 43 CB ILE A 6 -8.334 -48.051 21.514 1.00 0.00 C ATOM 44 CG1 ILE A 6 -7.774 -49.303 20.835 1.00 0.00 C ATOM 45 CG2 ILE A 6 -7.953 -48.042 22.997 1.00 0.00 C ATOM 46 CD1 ILE A 6 -6.260 -49.361 20.812 1.00 0.00 C ATOM 0 H ILE A 6 -9.570 -47.551 19.327 1.00 0.00 H new ATOM 0 HA ILE A 6 -10.284 -48.916 21.747 1.00 0.00 H new ATOM 0 HB ILE A 6 -7.902 -47.171 21.037 1.00 0.00 H new ATOM 0 HG12 ILE A 6 -8.154 -50.185 21.350 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -8.146 -49.347 19.811 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -6.868 -48.087 23.094 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -8.322 -47.128 23.462 1.00 0.00 H new ATOM 0 HG23 ILE A 6 -8.398 -48.905 23.492 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -5.938 -50.276 20.315 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -5.871 -48.498 20.271 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -5.880 -49.350 21.834 1.00 0.00 H new ATOM 58 N ASP A 7 -11.483 -47.046 22.847 1.00 0.00 N ATOM 59 CA ASP A 7 -12.092 -46.027 23.663 1.00 0.00 C ATOM 60 C ASP A 7 -11.282 -45.874 24.911 1.00 0.00 C ATOM 61 O ASP A 7 -11.178 -46.801 25.712 1.00 0.00 O ATOM 62 CB ASP A 7 -13.528 -46.402 24.026 1.00 0.00 C ATOM 63 CG ASP A 7 -14.401 -46.626 22.818 1.00 0.00 C ATOM 64 OD1 ASP A 7 -14.809 -45.638 22.174 1.00 0.00 O ATOM 65 OD2 ASP A 7 -14.684 -47.796 22.511 1.00 0.00 O ATOM 0 H ASP A 7 -11.950 -47.952 22.889 1.00 0.00 H new ATOM 0 HA ASP A 7 -12.119 -45.090 23.106 1.00 0.00 H new ATOM 0 HB2 ASP A 7 -13.519 -47.307 24.634 1.00 0.00 H new ATOM 0 HB3 ASP A 7 -13.961 -45.611 24.639 1.00 0.00 H new ATOM 70 N ILE A 8 -10.689 -44.731 25.077 1.00 0.00 N ATOM 71 CA ILE A 8 -9.860 -44.510 26.213 1.00 0.00 C ATOM 72 C ILE A 8 -10.687 -43.923 27.320 1.00 0.00 C ATOM 73 O ILE A 8 -11.275 -42.852 27.178 1.00 0.00 O ATOM 74 CB ILE A 8 -8.676 -43.602 25.863 1.00 0.00 C ATOM 75 CG1 ILE A 8 -7.891 -44.248 24.719 1.00 0.00 C ATOM 76 CG2 ILE A 8 -7.783 -43.382 27.084 1.00 0.00 C ATOM 77 CD1 ILE A 8 -6.752 -43.422 24.199 1.00 0.00 C ATOM 0 H ILE A 8 -10.766 -43.940 24.438 1.00 0.00 H new ATOM 0 HA ILE A 8 -9.446 -45.462 26.545 1.00 0.00 H new ATOM 0 HB ILE A 8 -9.041 -42.624 25.549 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -7.501 -45.207 25.060 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -8.576 -44.456 23.897 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -6.949 -42.735 26.813 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -8.363 -42.913 27.879 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -7.400 -44.341 27.432 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -6.253 -43.958 23.391 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -7.133 -42.472 23.824 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -6.041 -43.235 25.004 1.00 0.00 H new ATOM 89 N LYS A 9 -10.738 -44.637 28.404 1.00 0.00 N ATOM 90 CA LYS A 9 -11.571 -44.278 29.500 1.00 0.00 C ATOM 91 C LYS A 9 -10.822 -43.370 30.438 1.00 0.00 C ATOM 92 O LYS A 9 -9.719 -43.693 30.886 1.00 0.00 O ATOM 93 CB LYS A 9 -12.009 -45.540 30.225 1.00 0.00 C ATOM 94 CG LYS A 9 -12.595 -46.607 29.290 1.00 0.00 C ATOM 95 CD LYS A 9 -13.845 -46.118 28.571 1.00 0.00 C ATOM 96 CE LYS A 9 -14.394 -47.162 27.614 1.00 0.00 C ATOM 97 NZ LYS A 9 -15.646 -46.701 26.957 1.00 0.00 N ATOM 0 H LYS A 9 -10.197 -45.490 28.549 1.00 0.00 H new ATOM 0 HA LYS A 9 -12.451 -43.748 29.135 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -11.154 -45.961 30.755 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -12.753 -45.278 30.977 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -11.844 -46.895 28.554 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -12.836 -47.500 29.866 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -14.609 -45.861 29.305 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -13.613 -45.207 28.020 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -13.646 -47.388 26.854 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -14.587 -48.087 28.157 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -15.991 -47.439 26.311 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -16.368 -46.509 27.681 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -15.456 -45.832 26.419 1.00 0.00 H new ATOM 111 N GLU A 10 -11.403 -42.242 30.734 1.00 0.00 N ATOM 112 CA GLU A 10 -10.777 -41.307 31.628 1.00 0.00 C ATOM 113 C GLU A 10 -11.403 -41.382 32.995 1.00 0.00 C ATOM 114 O GLU A 10 -12.560 -40.996 33.182 1.00 0.00 O ATOM 115 CB GLU A 10 -10.860 -39.875 31.094 1.00 0.00 C ATOM 116 CG GLU A 10 -10.067 -39.641 29.820 1.00 0.00 C ATOM 117 CD GLU A 10 -10.098 -38.195 29.373 1.00 0.00 C ATOM 118 OE1 GLU A 10 -11.199 -37.635 29.206 1.00 0.00 O ATOM 119 OE2 GLU A 10 -9.012 -37.602 29.213 1.00 0.00 O ATOM 0 H GLU A 10 -12.309 -41.947 30.370 1.00 0.00 H new ATOM 0 HA GLU A 10 -9.724 -41.580 31.701 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -11.905 -39.628 30.909 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -10.502 -39.191 31.863 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -9.033 -39.946 29.979 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -10.467 -40.272 29.026 1.00 0.00 H new ATOM 126 N ILE A 11 -10.650 -41.883 33.942 1.00 0.00 N ATOM 127 CA ILE A 11 -11.100 -41.957 35.305 1.00 0.00 C ATOM 128 C ILE A 11 -10.609 -40.720 36.049 1.00 0.00 C ATOM 129 O ILE A 11 -9.414 -40.558 36.310 1.00 0.00 O ATOM 130 CB ILE A 11 -10.638 -43.281 35.996 1.00 0.00 C ATOM 131 CG1 ILE A 11 -11.371 -44.477 35.367 1.00 0.00 C ATOM 132 CG2 ILE A 11 -10.879 -43.239 37.510 1.00 0.00 C ATOM 133 CD1 ILE A 11 -10.880 -45.824 35.850 1.00 0.00 C ATOM 0 H ILE A 11 -9.711 -42.250 33.788 1.00 0.00 H new ATOM 0 HA ILE A 11 -12.190 -41.976 35.326 1.00 0.00 H new ATOM 0 HB ILE A 11 -9.565 -43.392 35.839 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -12.436 -44.391 35.583 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -11.260 -44.429 34.284 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -10.546 -44.176 37.958 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -10.320 -42.410 37.945 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -11.942 -43.101 37.705 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -11.447 -46.615 35.360 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -9.822 -45.933 35.610 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -11.016 -45.895 36.929 1.00 0.00 H new ATOM 145 N LYS A 12 -11.546 -39.836 36.345 1.00 0.00 N ATOM 146 CA LYS A 12 -11.250 -38.560 36.966 1.00 0.00 C ATOM 147 C LYS A 12 -11.483 -38.601 38.465 1.00 0.00 C ATOM 148 O LYS A 12 -12.580 -38.907 38.934 1.00 0.00 O ATOM 149 CB LYS A 12 -12.075 -37.454 36.290 1.00 0.00 C ATOM 150 CG LYS A 12 -11.955 -36.069 36.913 1.00 0.00 C ATOM 151 CD LYS A 12 -12.627 -35.029 36.023 1.00 0.00 C ATOM 152 CE LYS A 12 -12.715 -33.660 36.684 1.00 0.00 C ATOM 153 NZ LYS A 12 -13.844 -33.577 37.646 1.00 0.00 N ATOM 0 H LYS A 12 -12.538 -39.985 36.160 1.00 0.00 H new ATOM 0 HA LYS A 12 -10.192 -38.338 36.825 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -11.775 -37.389 35.244 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -13.124 -37.749 36.303 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -12.417 -36.066 37.900 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -10.904 -35.815 37.052 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -12.072 -34.942 35.089 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -13.630 -35.370 35.767 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -11.780 -33.447 37.203 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -12.835 -32.895 35.917 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -13.867 -32.629 38.073 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -14.739 -33.754 37.147 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -13.717 -34.290 38.393 1.00 0.00 H new ATOM 167 N LEU A 13 -10.440 -38.285 39.201 1.00 0.00 N ATOM 168 CA LEU A 13 -10.464 -38.307 40.644 1.00 0.00 C ATOM 169 C LEU A 13 -10.095 -36.945 41.203 1.00 0.00 C ATOM 170 O LEU A 13 -9.827 -35.996 40.456 1.00 0.00 O ATOM 171 CB LEU A 13 -9.481 -39.358 41.161 1.00 0.00 C ATOM 172 CG LEU A 13 -9.711 -40.779 40.654 1.00 0.00 C ATOM 173 CD1 LEU A 13 -8.677 -41.722 41.227 1.00 0.00 C ATOM 174 CD2 LEU A 13 -11.107 -41.249 40.999 1.00 0.00 C ATOM 0 H LEU A 13 -9.542 -38.003 38.808 1.00 0.00 H new ATOM 0 HA LEU A 13 -11.473 -38.559 40.972 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -8.471 -39.052 40.887 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -9.526 -39.368 42.250 1.00 0.00 H new ATOM 0 HG LEU A 13 -9.609 -40.775 39.569 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -8.858 -42.730 40.854 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -7.681 -41.397 40.926 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -8.746 -41.720 42.315 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -11.251 -42.264 40.629 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -11.239 -41.235 42.081 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -11.839 -40.587 40.536 1.00 0.00 H new ATOM 186 N SER A 14 -10.098 -36.848 42.508 1.00 0.00 N ATOM 187 CA SER A 14 -9.707 -35.638 43.188 1.00 0.00 C ATOM 188 C SER A 14 -8.723 -35.992 44.287 1.00 0.00 C ATOM 189 O SER A 14 -8.741 -37.099 44.794 1.00 0.00 O ATOM 190 CB SER A 14 -10.938 -34.937 43.775 1.00 0.00 C ATOM 191 OG SER A 14 -11.869 -34.604 42.755 1.00 0.00 O ATOM 0 H SER A 14 -10.372 -37.607 43.131 1.00 0.00 H new ATOM 0 HA SER A 14 -9.235 -34.955 42.482 1.00 0.00 H new ATOM 0 HB2 SER A 14 -11.415 -35.586 44.510 1.00 0.00 H new ATOM 0 HB3 SER A 14 -10.630 -34.033 44.300 1.00 0.00 H new ATOM 0 HG SER A 14 -12.646 -34.160 43.154 1.00 0.00 H new ATOM 197 N VAL A 15 -7.851 -35.067 44.625 1.00 0.00 N ATOM 198 CA VAL A 15 -6.887 -35.278 45.697 1.00 0.00 C ATOM 199 C VAL A 15 -7.623 -35.456 47.029 1.00 0.00 C ATOM 200 O VAL A 15 -7.271 -36.313 47.849 1.00 0.00 O ATOM 201 CB VAL A 15 -5.861 -34.118 45.769 1.00 0.00 C ATOM 202 CG1 VAL A 15 -4.949 -34.261 46.973 1.00 0.00 C ATOM 203 CG2 VAL A 15 -5.039 -34.094 44.498 1.00 0.00 C ATOM 0 H VAL A 15 -7.785 -34.155 44.173 1.00 0.00 H new ATOM 0 HA VAL A 15 -6.325 -36.188 45.486 1.00 0.00 H new ATOM 0 HB VAL A 15 -6.408 -33.181 45.874 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -4.242 -33.432 46.994 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -5.546 -34.252 47.885 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -4.403 -35.202 46.906 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -4.317 -33.279 44.547 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -4.510 -35.041 44.389 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -5.697 -33.945 43.642 1.00 0.00 H new ATOM 213 N LYS A 16 -8.650 -34.650 47.222 1.00 0.00 N ATOM 214 CA LYS A 16 -9.507 -34.722 48.404 1.00 0.00 C ATOM 215 C LYS A 16 -10.507 -35.899 48.273 1.00 0.00 C ATOM 216 O LYS A 16 -11.709 -35.730 48.466 1.00 0.00 O ATOM 217 CB LYS A 16 -10.265 -33.393 48.541 1.00 0.00 C ATOM 218 CG LYS A 16 -9.355 -32.201 48.791 1.00 0.00 C ATOM 219 CD LYS A 16 -10.123 -30.890 48.831 1.00 0.00 C ATOM 220 CE LYS A 16 -9.188 -29.717 49.086 1.00 0.00 C ATOM 221 NZ LYS A 16 -9.909 -28.420 49.095 1.00 0.00 N ATOM 0 H LYS A 16 -8.920 -33.920 46.562 1.00 0.00 H new ATOM 0 HA LYS A 16 -8.897 -34.893 49.291 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -10.841 -33.217 47.633 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -10.979 -33.474 49.361 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -8.828 -32.340 49.735 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -8.599 -32.153 48.008 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -10.647 -30.743 47.887 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -10.881 -30.932 49.613 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -8.683 -29.857 50.042 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -8.415 -29.696 48.318 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -9.714 -27.909 48.211 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -10.931 -28.592 49.178 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -9.587 -27.849 49.903 1.00 0.00 H new ATOM 235 N ILE A 17 -9.986 -37.082 47.948 1.00 0.00 N ATOM 236 CA ILE A 17 -10.809 -38.281 47.745 1.00 0.00 C ATOM 237 C ILE A 17 -10.656 -39.249 48.923 1.00 0.00 C ATOM 238 O ILE A 17 -9.696 -39.161 49.693 1.00 0.00 O ATOM 239 CB ILE A 17 -10.389 -39.015 46.434 1.00 0.00 C ATOM 240 CG1 ILE A 17 -11.383 -40.130 46.068 1.00 0.00 C ATOM 241 CG2 ILE A 17 -8.981 -39.589 46.577 1.00 0.00 C ATOM 242 CD1 ILE A 17 -11.124 -40.751 44.714 1.00 0.00 C ATOM 0 H ILE A 17 -8.987 -37.239 47.818 1.00 0.00 H new ATOM 0 HA ILE A 17 -11.848 -37.962 47.670 1.00 0.00 H new ATOM 0 HB ILE A 17 -10.396 -38.283 45.626 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -11.340 -40.908 46.830 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -12.394 -39.724 46.085 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -8.700 -40.099 45.655 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -8.277 -38.781 46.774 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -8.959 -40.298 47.404 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -11.863 -41.529 44.523 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -11.196 -39.985 43.942 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -10.125 -41.188 44.699 1.00 0.00 H new ATOM 254 N ALA A 18 -11.617 -40.144 49.072 1.00 0.00 N ATOM 255 CA ALA A 18 -11.554 -41.178 50.085 1.00 0.00 C ATOM 256 C ALA A 18 -10.723 -42.353 49.569 1.00 0.00 C ATOM 257 O ALA A 18 -10.747 -42.657 48.374 1.00 0.00 O ATOM 258 CB ALA A 18 -12.955 -41.639 50.459 1.00 0.00 C ATOM 0 H ALA A 18 -12.458 -40.173 48.496 1.00 0.00 H new ATOM 0 HA ALA A 18 -11.079 -40.774 50.979 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -12.891 -42.416 51.221 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -13.524 -40.795 50.848 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -13.455 -42.037 49.576 1.00 0.00 H new ATOM 264 N GLN A 19 -10.008 -43.012 50.463 1.00 0.00 N ATOM 265 CA GLN A 19 -9.145 -44.135 50.090 1.00 0.00 C ATOM 266 C GLN A 19 -9.957 -45.304 49.527 1.00 0.00 C ATOM 267 O GLN A 19 -9.521 -45.991 48.599 1.00 0.00 O ATOM 268 CB GLN A 19 -8.313 -44.592 51.297 1.00 0.00 C ATOM 269 CG GLN A 19 -7.397 -45.778 51.015 1.00 0.00 C ATOM 270 CD GLN A 19 -6.339 -45.481 49.971 1.00 0.00 C ATOM 271 OE1 GLN A 19 -5.874 -44.352 49.839 1.00 0.00 O ATOM 272 NE2 GLN A 19 -5.948 -46.501 49.232 1.00 0.00 N ATOM 0 H GLN A 19 -10.003 -42.793 51.459 1.00 0.00 H new ATOM 0 HA GLN A 19 -8.471 -43.791 49.305 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -7.707 -43.755 51.644 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -8.989 -44.855 52.111 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -6.909 -46.080 51.942 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -8.000 -46.623 50.682 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -6.361 -47.423 49.375 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -5.233 -46.368 48.517 1.00 0.00 H new ATOM 281 N ASN A 20 -11.137 -45.520 50.081 1.00 0.00 N ATOM 282 CA ASN A 20 -11.989 -46.620 49.641 1.00 0.00 C ATOM 283 C ASN A 20 -12.438 -46.451 48.184 1.00 0.00 C ATOM 284 O ASN A 20 -12.535 -47.432 47.447 1.00 0.00 O ATOM 285 CB ASN A 20 -13.205 -46.815 50.570 1.00 0.00 C ATOM 286 CG ASN A 20 -14.116 -45.602 50.651 1.00 0.00 C ATOM 287 OD1 ASN A 20 -14.981 -45.404 49.804 1.00 0.00 O ATOM 288 ND2 ASN A 20 -13.945 -44.803 51.685 1.00 0.00 N ATOM 0 H ASN A 20 -11.529 -44.953 50.833 1.00 0.00 H new ATOM 0 HA ASN A 20 -11.381 -47.523 49.697 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -13.784 -47.670 50.220 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -12.850 -47.059 51.571 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -14.544 -43.986 51.802 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -13.214 -45.002 52.368 1.00 0.00 H new ATOM 295 N ASP A 21 -12.688 -45.206 47.766 1.00 0.00 N ATOM 296 CA ASP A 21 -13.137 -44.941 46.392 1.00 0.00 C ATOM 297 C ASP A 21 -12.048 -45.302 45.389 1.00 0.00 C ATOM 298 O ASP A 21 -12.331 -45.812 44.306 1.00 0.00 O ATOM 299 CB ASP A 21 -13.573 -43.483 46.215 1.00 0.00 C ATOM 300 CG ASP A 21 -14.314 -43.262 44.904 1.00 0.00 C ATOM 301 OD1 ASP A 21 -15.415 -43.847 44.731 1.00 0.00 O ATOM 302 OD2 ASP A 21 -13.821 -42.505 44.060 1.00 0.00 O ATOM 0 H ASP A 21 -12.589 -44.375 48.349 1.00 0.00 H new ATOM 0 HA ASP A 21 -14.005 -45.572 46.202 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -14.215 -43.194 47.047 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -12.696 -42.836 46.249 1.00 0.00 H new ATOM 307 N ILE A 22 -10.798 -45.073 45.785 1.00 0.00 N ATOM 308 CA ILE A 22 -9.636 -45.382 44.947 1.00 0.00 C ATOM 309 C ILE A 22 -9.585 -46.878 44.652 1.00 0.00 C ATOM 310 O ILE A 22 -9.306 -47.297 43.524 1.00 0.00 O ATOM 311 CB ILE A 22 -8.315 -44.957 45.632 1.00 0.00 C ATOM 312 CG1 ILE A 22 -8.360 -43.474 46.005 1.00 0.00 C ATOM 313 CG2 ILE A 22 -7.125 -45.242 44.720 1.00 0.00 C ATOM 314 CD1 ILE A 22 -7.155 -43.007 46.792 1.00 0.00 C ATOM 0 H ILE A 22 -10.560 -44.670 46.691 1.00 0.00 H new ATOM 0 HA ILE A 22 -9.743 -44.822 44.018 1.00 0.00 H new ATOM 0 HB ILE A 22 -8.197 -45.540 46.546 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -8.439 -42.882 45.093 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -9.260 -43.283 46.589 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -6.204 -44.937 45.217 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -7.082 -46.309 44.500 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -7.237 -44.684 43.790 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -7.258 -41.946 47.020 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -7.086 -43.573 47.721 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -6.252 -43.165 46.203 1.00 0.00 H new ATOM 326 N ASN A 23 -9.871 -47.671 45.674 1.00 0.00 N ATOM 327 CA ASN A 23 -9.877 -49.130 45.560 1.00 0.00 C ATOM 328 C ASN A 23 -10.858 -49.585 44.498 1.00 0.00 C ATOM 329 O ASN A 23 -10.574 -50.497 43.715 1.00 0.00 O ATOM 330 CB ASN A 23 -10.268 -49.744 46.896 1.00 0.00 C ATOM 331 CG ASN A 23 -9.103 -49.880 47.859 1.00 0.00 C ATOM 332 OD1 ASN A 23 -8.411 -50.898 47.875 1.00 0.00 O ATOM 333 ND2 ASN A 23 -8.874 -48.860 48.670 1.00 0.00 N ATOM 0 H ASN A 23 -10.105 -47.327 46.605 1.00 0.00 H new ATOM 0 HA ASN A 23 -8.876 -49.456 45.276 1.00 0.00 H new ATOM 0 HB2 ASN A 23 -11.042 -49.130 47.357 1.00 0.00 H new ATOM 0 HB3 ASN A 23 -10.703 -50.728 46.722 1.00 0.00 H new ATOM 0 HD21 ASN A 23 -8.103 -48.902 49.337 1.00 0.00 H new ATOM 0 HD22 ASN A 23 -9.468 -48.032 48.629 1.00 0.00 H new ATOM 340 N TYR A 24 -12.007 -48.961 44.481 1.00 0.00 N ATOM 341 CA TYR A 24 -13.011 -49.232 43.477 1.00 0.00 C ATOM 342 C TYR A 24 -12.511 -48.854 42.078 1.00 0.00 C ATOM 343 O TYR A 24 -12.703 -49.604 41.118 1.00 0.00 O ATOM 344 CB TYR A 24 -14.296 -48.477 43.813 1.00 0.00 C ATOM 345 CG TYR A 24 -15.293 -48.413 42.675 1.00 0.00 C ATOM 346 CD1 TYR A 24 -16.117 -49.481 42.387 1.00 0.00 C ATOM 347 CD2 TYR A 24 -15.390 -47.277 41.885 1.00 0.00 C ATOM 348 CE1 TYR A 24 -17.019 -49.427 41.335 1.00 0.00 C ATOM 349 CE2 TYR A 24 -16.284 -47.206 40.837 1.00 0.00 C ATOM 350 CZ TYR A 24 -17.097 -48.283 40.564 1.00 0.00 C ATOM 351 OH TYR A 24 -17.985 -48.218 39.510 1.00 0.00 O ATOM 0 H TYR A 24 -12.276 -48.250 45.161 1.00 0.00 H new ATOM 0 HA TYR A 24 -13.218 -50.302 43.475 1.00 0.00 H new ATOM 0 HB2 TYR A 24 -14.771 -48.954 44.671 1.00 0.00 H new ATOM 0 HB3 TYR A 24 -14.039 -47.461 44.114 1.00 0.00 H new ATOM 0 HD1 TYR A 24 -16.059 -50.374 42.991 1.00 0.00 H new ATOM 0 HD2 TYR A 24 -14.753 -46.431 42.095 1.00 0.00 H new ATOM 0 HE1 TYR A 24 -17.656 -50.273 41.120 1.00 0.00 H new ATOM 0 HE2 TYR A 24 -16.346 -46.312 40.235 1.00 0.00 H new ATOM 0 HH TYR A 24 -17.912 -47.343 39.074 1.00 0.00 H new ATOM 361 N LYS A 25 -11.863 -47.699 41.980 1.00 0.00 N ATOM 362 CA LYS A 25 -11.413 -47.177 40.697 1.00 0.00 C ATOM 363 C LYS A 25 -10.410 -48.116 40.026 1.00 0.00 C ATOM 364 O LYS A 25 -10.545 -48.417 38.848 1.00 0.00 O ATOM 365 CB LYS A 25 -10.798 -45.787 40.875 1.00 0.00 C ATOM 366 CG LYS A 25 -11.743 -44.773 41.505 1.00 0.00 C ATOM 367 CD LYS A 25 -12.947 -44.488 40.625 1.00 0.00 C ATOM 368 CE LYS A 25 -13.863 -43.471 41.278 1.00 0.00 C ATOM 369 NZ LYS A 25 -15.062 -43.188 40.459 1.00 0.00 N ATOM 0 H LYS A 25 -11.637 -47.105 42.778 1.00 0.00 H new ATOM 0 HA LYS A 25 -12.285 -47.102 40.047 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -9.905 -45.872 41.495 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -10.477 -45.415 39.902 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -12.082 -45.146 42.472 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -11.204 -43.844 41.693 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -12.615 -44.115 39.656 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -13.495 -45.412 40.440 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -14.172 -43.839 42.256 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -13.313 -42.545 41.445 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -15.658 -42.488 40.946 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -14.770 -42.811 39.535 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -15.603 -44.066 40.320 1.00 0.00 H new ATOM 383 N VAL A 26 -9.422 -48.595 40.783 1.00 0.00 N ATOM 384 CA VAL A 26 -8.426 -49.517 40.232 1.00 0.00 C ATOM 385 C VAL A 26 -9.044 -50.861 39.858 1.00 0.00 C ATOM 386 O VAL A 26 -8.724 -51.435 38.817 1.00 0.00 O ATOM 387 CB VAL A 26 -7.224 -49.753 41.188 1.00 0.00 C ATOM 388 CG1 VAL A 26 -6.281 -48.567 41.181 1.00 0.00 C ATOM 389 CG2 VAL A 26 -7.691 -50.048 42.604 1.00 0.00 C ATOM 0 H VAL A 26 -9.290 -48.364 41.768 1.00 0.00 H new ATOM 0 HA VAL A 26 -8.050 -49.031 39.332 1.00 0.00 H new ATOM 0 HB VAL A 26 -6.684 -50.626 40.821 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -5.449 -48.759 41.859 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -5.899 -48.412 40.172 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -6.816 -47.675 41.507 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -6.825 -50.208 43.247 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -8.270 -49.204 42.979 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -8.313 -50.943 42.603 1.00 0.00 H new ATOM 399 N LYS A 27 -9.934 -51.346 40.705 1.00 0.00 N ATOM 400 CA LYS A 27 -10.576 -52.633 40.497 1.00 0.00 C ATOM 401 C LYS A 27 -11.426 -52.625 39.224 1.00 0.00 C ATOM 402 O LYS A 27 -11.398 -53.571 38.437 1.00 0.00 O ATOM 403 CB LYS A 27 -11.442 -52.976 41.711 1.00 0.00 C ATOM 404 CG LYS A 27 -12.073 -54.355 41.665 1.00 0.00 C ATOM 405 CD LYS A 27 -12.881 -54.622 42.922 1.00 0.00 C ATOM 406 CE LYS A 27 -13.498 -56.009 42.909 1.00 0.00 C ATOM 407 NZ LYS A 27 -14.283 -56.270 44.139 1.00 0.00 N ATOM 0 H LYS A 27 -10.231 -50.862 41.552 1.00 0.00 H new ATOM 0 HA LYS A 27 -9.803 -53.392 40.378 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -10.831 -52.900 42.610 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -12.233 -52.231 41.799 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -12.717 -54.436 40.790 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -11.296 -55.112 41.560 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -12.239 -54.518 43.796 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -13.669 -53.874 43.014 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -14.143 -56.112 42.037 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -12.711 -56.757 42.814 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -14.689 -57.226 44.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -13.662 -56.196 44.970 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -15.049 -55.571 44.216 1.00 0.00 H new ATOM 421 N HIS A 28 -12.158 -51.546 39.020 1.00 0.00 N ATOM 422 CA HIS A 28 -13.038 -51.430 37.868 1.00 0.00 C ATOM 423 C HIS A 28 -12.247 -51.041 36.622 1.00 0.00 C ATOM 424 O HIS A 28 -12.662 -51.332 35.499 1.00 0.00 O ATOM 425 CB HIS A 28 -14.149 -50.413 38.150 1.00 0.00 C ATOM 426 CG HIS A 28 -15.401 -50.650 37.360 1.00 0.00 C ATOM 427 ND1 HIS A 28 -16.457 -51.401 37.835 1.00 0.00 N ATOM 428 CD2 HIS A 28 -15.772 -50.231 36.127 1.00 0.00 C ATOM 429 CE1 HIS A 28 -17.418 -51.436 36.931 1.00 0.00 C ATOM 430 NE2 HIS A 28 -17.028 -50.734 35.886 1.00 0.00 N ATOM 0 H HIS A 28 -12.162 -50.734 39.638 1.00 0.00 H new ATOM 0 HA HIS A 28 -13.499 -52.400 37.683 1.00 0.00 H new ATOM 0 HB2 HIS A 28 -14.391 -50.438 39.213 1.00 0.00 H new ATOM 0 HB3 HIS A 28 -13.777 -49.412 37.932 1.00 0.00 H new ATOM 0 HD2 HIS A 28 -15.189 -49.616 35.457 1.00 0.00 H new ATOM 0 HE1 HIS A 28 -18.362 -51.951 37.031 1.00 0.00 H new ATOM 0 HE2 HIS A 28 -17.571 -50.588 35.035 1.00 0.00 H new ATOM 438 N ALA A 29 -11.110 -50.383 36.824 1.00 0.00 N ATOM 439 CA ALA A 29 -10.252 -49.970 35.718 1.00 0.00 C ATOM 440 C ALA A 29 -9.709 -51.176 34.969 1.00 0.00 C ATOM 441 O ALA A 29 -9.608 -51.160 33.744 1.00 0.00 O ATOM 442 CB ALA A 29 -9.102 -49.112 36.224 1.00 0.00 C ATOM 0 H ALA A 29 -10.760 -50.123 37.746 1.00 0.00 H new ATOM 0 HA ALA A 29 -10.857 -49.380 35.030 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -8.474 -48.814 35.385 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -9.499 -48.223 36.713 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -8.508 -49.684 36.937 1.00 0.00 H new ATOM 448 N LEU A 30 -9.399 -52.230 35.712 1.00 0.00 N ATOM 449 CA LEU A 30 -8.833 -53.443 35.133 1.00 0.00 C ATOM 450 C LEU A 30 -9.790 -54.093 34.140 1.00 0.00 C ATOM 451 O LEU A 30 -9.356 -54.671 33.149 1.00 0.00 O ATOM 452 CB LEU A 30 -8.420 -54.439 36.224 1.00 0.00 C ATOM 453 CG LEU A 30 -7.294 -53.972 37.160 1.00 0.00 C ATOM 454 CD1 LEU A 30 -6.903 -55.077 38.129 1.00 0.00 C ATOM 455 CD2 LEU A 30 -6.083 -53.509 36.365 1.00 0.00 C ATOM 0 H LEU A 30 -9.531 -52.270 36.723 1.00 0.00 H new ATOM 0 HA LEU A 30 -7.937 -53.150 34.585 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -9.297 -54.672 36.828 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -8.108 -55.367 35.744 1.00 0.00 H new ATOM 0 HG LEU A 30 -7.668 -53.126 37.736 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -6.105 -54.723 38.781 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -7.768 -55.355 38.732 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -6.556 -55.946 37.569 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -5.300 -53.184 37.050 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -5.712 -54.332 35.755 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -6.368 -52.679 35.719 1.00 0.00 H new ATOM 467 N GLU A 31 -11.088 -53.983 34.404 1.00 0.00 N ATOM 468 CA GLU A 31 -12.101 -54.537 33.511 1.00 0.00 C ATOM 469 C GLU A 31 -11.950 -53.940 32.108 1.00 0.00 C ATOM 470 O GLU A 31 -12.065 -54.646 31.106 1.00 0.00 O ATOM 471 CB GLU A 31 -13.496 -54.211 34.042 1.00 0.00 C ATOM 472 CG GLU A 31 -13.842 -54.847 35.380 1.00 0.00 C ATOM 473 CD GLU A 31 -13.960 -56.353 35.312 1.00 0.00 C ATOM 474 OE1 GLU A 31 -14.729 -56.863 34.459 1.00 0.00 O ATOM 475 OE2 GLU A 31 -13.308 -57.037 36.128 1.00 0.00 O ATOM 0 H GLU A 31 -11.464 -53.515 35.229 1.00 0.00 H new ATOM 0 HA GLU A 31 -11.968 -55.618 33.463 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -13.588 -53.129 34.137 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -14.232 -54.530 33.304 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -13.077 -54.582 36.110 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -14.783 -54.431 35.740 1.00 0.00 H new ATOM 482 N PHE A 32 -11.691 -52.633 32.047 1.00 0.00 N ATOM 483 CA PHE A 32 -11.509 -51.948 30.764 1.00 0.00 C ATOM 484 C PHE A 32 -10.254 -52.447 30.063 1.00 0.00 C ATOM 485 O PHE A 32 -10.215 -52.568 28.839 1.00 0.00 O ATOM 486 CB PHE A 32 -11.432 -50.431 30.942 1.00 0.00 C ATOM 487 CG PHE A 32 -12.684 -49.820 31.493 1.00 0.00 C ATOM 488 CD1 PHE A 32 -13.787 -49.622 30.683 1.00 0.00 C ATOM 489 CD2 PHE A 32 -12.758 -49.454 32.821 1.00 0.00 C ATOM 490 CE1 PHE A 32 -14.943 -49.065 31.191 1.00 0.00 C ATOM 491 CE2 PHE A 32 -13.910 -48.896 33.337 1.00 0.00 C ATOM 492 CZ PHE A 32 -15.003 -48.700 32.520 1.00 0.00 C ATOM 0 H PHE A 32 -11.603 -52.030 32.865 1.00 0.00 H new ATOM 0 HA PHE A 32 -12.379 -52.176 30.149 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -10.601 -50.195 31.607 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -11.209 -49.973 29.978 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -13.743 -49.906 29.642 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -11.904 -49.606 33.465 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -15.799 -48.915 30.549 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -13.955 -48.614 34.378 1.00 0.00 H new ATOM 0 HZ PHE A 32 -15.905 -48.261 32.920 1.00 0.00 H new ATOM 502 N LEU A 33 -9.238 -52.743 30.854 1.00 0.00 N ATOM 503 CA LEU A 33 -7.973 -53.246 30.340 1.00 0.00 C ATOM 504 C LEU A 33 -8.177 -54.583 29.642 1.00 0.00 C ATOM 505 O LEU A 33 -7.625 -54.831 28.575 1.00 0.00 O ATOM 506 CB LEU A 33 -6.953 -53.387 31.483 1.00 0.00 C ATOM 507 CG LEU A 33 -6.112 -52.140 31.810 1.00 0.00 C ATOM 508 CD1 LEU A 33 -6.980 -50.958 32.185 1.00 0.00 C ATOM 509 CD2 LEU A 33 -5.133 -52.445 32.923 1.00 0.00 C ATOM 0 H LEU A 33 -9.265 -52.642 31.869 1.00 0.00 H new ATOM 0 HA LEU A 33 -7.585 -52.533 29.612 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -7.489 -53.683 32.385 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -6.273 -54.202 31.235 1.00 0.00 H new ATOM 0 HG LEU A 33 -5.560 -51.870 30.910 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -6.348 -50.099 32.408 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -7.642 -50.715 31.354 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -7.576 -51.208 33.063 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -4.545 -51.555 33.144 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -5.680 -52.749 33.815 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -4.468 -53.251 32.612 1.00 0.00 H new ATOM 521 N GLU A 34 -8.990 -55.419 30.247 1.00 0.00 N ATOM 522 CA GLU A 34 -9.324 -56.725 29.701 1.00 0.00 C ATOM 523 C GLU A 34 -10.043 -56.577 28.357 1.00 0.00 C ATOM 524 O GLU A 34 -9.953 -57.445 27.485 1.00 0.00 O ATOM 525 CB GLU A 34 -10.222 -57.479 30.669 1.00 0.00 C ATOM 526 CG GLU A 34 -9.667 -57.578 32.072 1.00 0.00 C ATOM 527 CD GLU A 34 -10.477 -58.492 32.947 1.00 0.00 C ATOM 528 OE1 GLU A 34 -11.486 -58.041 33.509 1.00 0.00 O ATOM 529 OE2 GLU A 34 -10.109 -59.673 33.080 1.00 0.00 O ATOM 0 H GLU A 34 -9.444 -55.215 31.138 1.00 0.00 H new ATOM 0 HA GLU A 34 -8.398 -57.281 29.551 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -11.193 -56.985 30.707 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -10.391 -58.485 30.284 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -8.639 -57.938 32.028 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -9.638 -56.584 32.519 1.00 0.00 H new ATOM 536 N GLN A 35 -10.767 -55.479 28.211 1.00 0.00 N ATOM 537 CA GLN A 35 -11.502 -55.186 26.996 1.00 0.00 C ATOM 538 C GLN A 35 -10.571 -54.629 25.915 1.00 0.00 C ATOM 539 O GLN A 35 -10.966 -54.475 24.760 1.00 0.00 O ATOM 540 CB GLN A 35 -12.615 -54.184 27.298 1.00 0.00 C ATOM 541 CG GLN A 35 -13.650 -54.702 28.282 1.00 0.00 C ATOM 542 CD GLN A 35 -14.719 -53.674 28.606 1.00 0.00 C ATOM 543 OE1 GLN A 35 -15.104 -52.862 27.757 1.00 0.00 O ATOM 544 NE2 GLN A 35 -15.208 -53.702 29.830 1.00 0.00 N ATOM 0 H GLN A 35 -10.860 -54.766 28.934 1.00 0.00 H new ATOM 0 HA GLN A 35 -11.939 -56.112 26.622 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -12.172 -53.271 27.696 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -13.114 -53.916 26.367 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -14.123 -55.593 27.870 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -13.151 -55.003 29.203 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -14.863 -54.388 30.501 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -15.931 -53.037 30.106 1.00 0.00 H new ATOM 553 N GLY A 36 -9.330 -54.339 26.297 1.00 0.00 N ATOM 554 CA GLY A 36 -8.375 -53.788 25.357 1.00 0.00 C ATOM 555 C GLY A 36 -8.433 -52.275 25.303 1.00 0.00 C ATOM 556 O GLY A 36 -7.979 -51.658 24.336 1.00 0.00 O ATOM 0 H GLY A 36 -8.971 -54.477 27.242 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -7.369 -54.102 25.637 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -8.570 -54.193 24.364 1.00 0.00 H new ATOM 560 N LYS A 37 -8.993 -51.679 26.341 1.00 0.00 N ATOM 561 CA LYS A 37 -9.126 -50.234 26.429 1.00 0.00 C ATOM 562 C LYS A 37 -7.979 -49.646 27.229 1.00 0.00 C ATOM 563 O LYS A 37 -7.252 -50.364 27.913 1.00 0.00 O ATOM 564 CB LYS A 37 -10.454 -49.861 27.095 1.00 0.00 C ATOM 565 CG LYS A 37 -11.674 -50.393 26.376 1.00 0.00 C ATOM 566 CD LYS A 37 -11.870 -49.742 25.017 1.00 0.00 C ATOM 567 CE LYS A 37 -12.973 -50.470 24.245 1.00 0.00 C ATOM 568 NZ LYS A 37 -13.187 -49.942 22.868 1.00 0.00 N ATOM 0 H LYS A 37 -9.368 -52.181 27.146 1.00 0.00 H new ATOM 0 HA LYS A 37 -9.104 -49.827 25.418 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -10.454 -50.238 28.118 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -10.526 -48.775 27.156 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -11.577 -51.471 26.250 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -12.558 -50.222 26.990 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -12.134 -48.692 25.142 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -10.938 -49.772 24.452 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -12.723 -51.529 24.184 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -13.906 -50.394 24.803 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -13.779 -50.606 22.330 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -13.662 -49.018 22.920 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -12.269 -49.833 22.392 1.00 0.00 H new ATOM 582 N HIS A 38 -7.808 -48.349 27.129 1.00 0.00 N ATOM 583 CA HIS A 38 -6.792 -47.652 27.894 1.00 0.00 C ATOM 584 C HIS A 38 -7.467 -46.790 28.935 1.00 0.00 C ATOM 585 O HIS A 38 -8.581 -46.313 28.719 1.00 0.00 O ATOM 586 CB HIS A 38 -5.925 -46.759 26.994 1.00 0.00 C ATOM 587 CG HIS A 38 -4.966 -47.483 26.092 1.00 0.00 C ATOM 588 ND1 HIS A 38 -3.807 -46.905 25.624 1.00 0.00 N ATOM 589 CD2 HIS A 38 -5.006 -48.724 25.546 1.00 0.00 C ATOM 590 CE1 HIS A 38 -3.176 -47.752 24.834 1.00 0.00 C ATOM 591 NE2 HIS A 38 -3.883 -48.863 24.768 1.00 0.00 N ATOM 0 H HIS A 38 -8.363 -47.747 26.521 1.00 0.00 H new ATOM 0 HA HIS A 38 -6.147 -48.395 28.364 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -6.583 -46.146 26.378 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -5.356 -46.078 27.628 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -5.777 -49.465 25.695 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -2.240 -47.567 24.328 1.00 0.00 H new ATOM 0 HE2 HIS A 38 -3.636 -49.691 24.227 1.00 0.00 H new ATOM 599 N VAL A 39 -6.812 -46.601 30.055 1.00 0.00 N ATOM 600 CA VAL A 39 -7.342 -45.751 31.097 1.00 0.00 C ATOM 601 C VAL A 39 -6.421 -44.583 31.352 1.00 0.00 C ATOM 602 O VAL A 39 -5.202 -44.746 31.504 1.00 0.00 O ATOM 603 CB VAL A 39 -7.602 -46.517 32.434 1.00 0.00 C ATOM 604 CG1 VAL A 39 -7.775 -45.542 33.590 1.00 0.00 C ATOM 605 CG2 VAL A 39 -8.853 -47.361 32.325 1.00 0.00 C ATOM 0 H VAL A 39 -5.909 -47.025 30.270 1.00 0.00 H new ATOM 0 HA VAL A 39 -8.305 -45.389 30.736 1.00 0.00 H new ATOM 0 HB VAL A 39 -6.739 -47.156 32.622 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -7.955 -46.097 34.511 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -6.871 -44.942 33.699 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -8.623 -44.887 33.390 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -9.020 -47.888 33.265 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -9.708 -46.719 32.113 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -8.734 -48.085 31.519 1.00 0.00 H new ATOM 615 N ARG A 40 -6.998 -43.413 31.365 1.00 0.00 N ATOM 616 CA ARG A 40 -6.276 -42.214 31.680 1.00 0.00 C ATOM 617 C ARG A 40 -6.770 -41.691 33.009 1.00 0.00 C ATOM 618 O ARG A 40 -7.924 -41.282 33.130 1.00 0.00 O ATOM 619 CB ARG A 40 -6.485 -41.150 30.596 1.00 0.00 C ATOM 620 CG ARG A 40 -5.826 -39.812 30.915 1.00 0.00 C ATOM 621 CD ARG A 40 -6.126 -38.762 29.853 1.00 0.00 C ATOM 622 NE ARG A 40 -5.466 -39.042 28.582 1.00 0.00 N ATOM 623 CZ ARG A 40 -6.009 -38.809 27.380 1.00 0.00 C ATOM 624 NH1 ARG A 40 -7.245 -38.313 27.278 1.00 0.00 N ATOM 625 NH2 ARG A 40 -5.309 -39.059 26.277 1.00 0.00 N ATOM 0 H ARG A 40 -7.985 -43.265 31.157 1.00 0.00 H new ATOM 0 HA ARG A 40 -5.211 -42.439 31.732 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -6.090 -41.524 29.652 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -7.554 -40.994 30.454 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -6.176 -39.457 31.885 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -4.748 -39.949 30.996 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -7.203 -38.709 29.694 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -5.809 -37.784 30.215 1.00 0.00 H new ATOM 0 HE ARG A 40 -4.528 -39.442 28.611 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -7.784 -38.108 28.120 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -7.650 -38.139 26.358 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -4.361 -39.427 26.347 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -5.721 -38.882 25.361 1.00 0.00 H new ATOM 639 N PHE A 41 -5.921 -41.719 34.001 1.00 0.00 N ATOM 640 CA PHE A 41 -6.292 -41.224 35.303 1.00 0.00 C ATOM 641 C PHE A 41 -6.034 -39.743 35.356 1.00 0.00 C ATOM 642 O PHE A 41 -4.916 -39.298 35.120 1.00 0.00 O ATOM 643 CB PHE A 41 -5.515 -41.932 36.413 1.00 0.00 C ATOM 644 CG PHE A 41 -5.860 -43.385 36.579 1.00 0.00 C ATOM 645 CD1 PHE A 41 -6.993 -43.767 37.282 1.00 0.00 C ATOM 646 CD2 PHE A 41 -5.047 -44.370 36.043 1.00 0.00 C ATOM 647 CE1 PHE A 41 -7.311 -45.102 37.444 1.00 0.00 C ATOM 648 CE2 PHE A 41 -5.359 -45.706 36.202 1.00 0.00 C ATOM 649 CZ PHE A 41 -6.492 -46.073 36.904 1.00 0.00 C ATOM 0 H PHE A 41 -4.969 -42.078 33.935 1.00 0.00 H new ATOM 0 HA PHE A 41 -7.351 -41.425 35.463 1.00 0.00 H new ATOM 0 HB2 PHE A 41 -4.448 -41.845 36.206 1.00 0.00 H new ATOM 0 HB3 PHE A 41 -5.700 -41.417 37.356 1.00 0.00 H new ATOM 0 HD1 PHE A 41 -7.635 -43.011 37.709 1.00 0.00 H new ATOM 0 HD2 PHE A 41 -4.160 -44.090 35.495 1.00 0.00 H new ATOM 0 HE1 PHE A 41 -8.198 -45.385 37.992 1.00 0.00 H new ATOM 0 HE2 PHE A 41 -4.718 -46.464 35.778 1.00 0.00 H new ATOM 0 HZ PHE A 41 -6.736 -47.118 37.030 1.00 0.00 H new ATOM 659 N ARG A 42 -7.065 -38.985 35.625 1.00 0.00 N ATOM 660 CA ARG A 42 -6.947 -37.547 35.691 1.00 0.00 C ATOM 661 C ARG A 42 -7.437 -37.063 37.023 1.00 0.00 C ATOM 662 O ARG A 42 -8.501 -37.452 37.474 1.00 0.00 O ATOM 663 CB ARG A 42 -7.746 -36.888 34.566 1.00 0.00 C ATOM 664 CG ARG A 42 -7.243 -37.241 33.181 1.00 0.00 C ATOM 665 CD ARG A 42 -8.117 -36.653 32.087 1.00 0.00 C ATOM 666 NE ARG A 42 -8.124 -35.191 32.103 1.00 0.00 N ATOM 667 CZ ARG A 42 -8.757 -34.440 31.195 1.00 0.00 C ATOM 668 NH1 ARG A 42 -9.322 -35.010 30.134 1.00 0.00 N ATOM 669 NH2 ARG A 42 -8.792 -33.118 31.331 1.00 0.00 N ATOM 0 H ARG A 42 -8.004 -39.341 35.804 1.00 0.00 H new ATOM 0 HA ARG A 42 -5.898 -37.275 35.571 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -8.791 -37.185 34.651 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -7.711 -35.806 34.692 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -6.222 -36.877 33.063 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -7.209 -38.325 33.074 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -7.763 -37.001 31.117 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -9.137 -37.020 32.204 1.00 0.00 H new ATOM 0 HE ARG A 42 -7.617 -34.716 32.850 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -9.273 -36.021 30.012 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -9.804 -34.436 29.443 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -8.336 -32.675 32.129 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -9.275 -32.547 30.638 1.00 0.00 H new ATOM 683 N VAL A 43 -6.674 -36.213 37.646 1.00 0.00 N ATOM 684 CA VAL A 43 -7.037 -35.701 38.937 1.00 0.00 C ATOM 685 C VAL A 43 -7.024 -34.189 38.938 1.00 0.00 C ATOM 686 O VAL A 43 -6.110 -33.556 38.396 1.00 0.00 O ATOM 687 CB VAL A 43 -6.118 -36.252 40.061 1.00 0.00 C ATOM 688 CG1 VAL A 43 -4.655 -36.065 39.716 1.00 0.00 C ATOM 689 CG2 VAL A 43 -6.432 -35.590 41.394 1.00 0.00 C ATOM 0 H VAL A 43 -5.791 -35.857 37.279 1.00 0.00 H new ATOM 0 HA VAL A 43 -8.051 -36.044 39.145 1.00 0.00 H new ATOM 0 HB VAL A 43 -6.314 -37.321 40.149 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -4.038 -36.461 40.522 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -4.428 -36.596 38.791 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -4.445 -35.003 39.586 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -5.775 -35.993 42.164 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -6.277 -34.514 41.311 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -7.470 -35.787 41.663 1.00 0.00 H new ATOM 699 N PHE A 44 -8.054 -33.620 39.516 1.00 0.00 N ATOM 700 CA PHE A 44 -8.175 -32.193 39.619 1.00 0.00 C ATOM 701 C PHE A 44 -7.794 -31.746 41.012 1.00 0.00 C ATOM 702 O PHE A 44 -8.304 -32.280 42.007 1.00 0.00 O ATOM 703 CB PHE A 44 -9.609 -31.753 39.294 1.00 0.00 C ATOM 704 CG PHE A 44 -9.836 -30.268 39.395 1.00 0.00 C ATOM 705 CD1 PHE A 44 -9.436 -29.422 38.373 1.00 0.00 C ATOM 706 CD2 PHE A 44 -10.459 -29.720 40.506 1.00 0.00 C ATOM 707 CE1 PHE A 44 -9.648 -28.060 38.458 1.00 0.00 C ATOM 708 CE2 PHE A 44 -10.673 -28.359 40.599 1.00 0.00 C ATOM 709 CZ PHE A 44 -10.269 -27.528 39.573 1.00 0.00 C ATOM 0 H PHE A 44 -8.831 -34.137 39.928 1.00 0.00 H new ATOM 0 HA PHE A 44 -7.500 -31.729 38.899 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -9.857 -32.079 38.284 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -10.295 -32.261 39.971 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -8.952 -29.833 37.499 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -10.781 -30.366 41.309 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -9.329 -27.412 37.655 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -11.155 -27.945 41.472 1.00 0.00 H new ATOM 0 HZ PHE A 44 -10.438 -26.463 39.641 1.00 0.00 H new ATOM 719 N LEU A 45 -6.885 -30.804 41.087 1.00 0.00 N ATOM 720 CA LEU A 45 -6.478 -30.261 42.356 1.00 0.00 C ATOM 721 C LEU A 45 -7.499 -29.214 42.748 1.00 0.00 C ATOM 722 O LEU A 45 -7.655 -28.210 42.057 1.00 0.00 O ATOM 723 CB LEU A 45 -5.087 -29.634 42.243 1.00 0.00 C ATOM 724 CG LEU A 45 -4.005 -30.516 41.612 1.00 0.00 C ATOM 725 CD1 LEU A 45 -2.689 -29.783 41.550 1.00 0.00 C ATOM 726 CD2 LEU A 45 -3.849 -31.797 42.383 1.00 0.00 C ATOM 0 H LEU A 45 -6.413 -30.398 40.279 1.00 0.00 H new ATOM 0 HA LEU A 45 -6.426 -31.045 43.111 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -5.169 -28.718 41.658 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -4.757 -29.346 43.241 1.00 0.00 H new ATOM 0 HG LEU A 45 -4.316 -30.757 40.596 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -1.935 -30.427 41.099 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -2.803 -28.881 40.949 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -2.377 -29.510 42.558 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -3.076 -32.409 41.919 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -3.564 -31.571 43.411 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -4.793 -32.341 42.380 1.00 0.00 H new ATOM 738 N LYS A 46 -8.197 -29.442 43.833 1.00 0.00 N ATOM 739 CA LYS A 46 -9.288 -28.570 44.197 1.00 0.00 C ATOM 740 C LYS A 46 -8.902 -27.612 45.310 1.00 0.00 C ATOM 741 O LYS A 46 -8.657 -28.017 46.447 1.00 0.00 O ATOM 742 CB LYS A 46 -10.515 -29.412 44.574 1.00 0.00 C ATOM 743 CG LYS A 46 -11.773 -28.607 44.863 1.00 0.00 C ATOM 744 CD LYS A 46 -12.986 -29.512 45.045 1.00 0.00 C ATOM 745 CE LYS A 46 -12.835 -30.433 46.248 1.00 0.00 C ATOM 746 NZ LYS A 46 -14.034 -31.284 46.449 1.00 0.00 N ATOM 0 H LYS A 46 -8.032 -30.217 44.475 1.00 0.00 H new ATOM 0 HA LYS A 46 -9.538 -27.951 43.335 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -10.724 -30.109 43.762 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -10.273 -30.010 45.453 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -11.625 -28.010 45.763 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -11.957 -27.911 44.045 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -13.880 -28.900 45.167 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -13.130 -30.111 44.146 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -11.959 -31.067 46.112 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -12.660 -29.835 47.143 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -13.890 -31.896 47.278 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -14.866 -30.680 46.605 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -14.187 -31.873 45.606 1.00 0.00 H new ATOM 760 N GLY A 47 -8.861 -26.334 44.973 1.00 0.00 N ATOM 761 CA GLY A 47 -8.518 -25.323 45.939 1.00 0.00 C ATOM 762 C GLY A 47 -7.052 -24.955 45.892 1.00 0.00 C ATOM 763 O GLY A 47 -6.467 -24.826 44.813 1.00 0.00 O ATOM 0 H GLY A 47 -9.062 -25.980 44.038 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -9.119 -24.432 45.758 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -8.769 -25.679 46.938 1.00 0.00 H new ATOM 767 N ARG A 48 -6.454 -24.814 47.063 1.00 0.00 N ATOM 768 CA ARG A 48 -5.048 -24.436 47.188 1.00 0.00 C ATOM 769 C ARG A 48 -4.124 -25.560 46.718 1.00 0.00 C ATOM 770 O ARG A 48 -2.927 -25.351 46.528 1.00 0.00 O ATOM 771 CB ARG A 48 -4.722 -24.066 48.641 1.00 0.00 C ATOM 772 CG ARG A 48 -4.887 -25.222 49.619 1.00 0.00 C ATOM 773 CD ARG A 48 -4.542 -24.811 51.041 1.00 0.00 C ATOM 774 NE ARG A 48 -4.679 -25.929 51.978 1.00 0.00 N ATOM 775 CZ ARG A 48 -5.745 -26.144 52.760 1.00 0.00 C ATOM 776 NH1 ARG A 48 -6.782 -25.306 52.733 1.00 0.00 N ATOM 777 NH2 ARG A 48 -5.770 -27.203 53.563 1.00 0.00 N ATOM 0 H ARG A 48 -6.925 -24.957 47.956 1.00 0.00 H new ATOM 0 HA ARG A 48 -4.880 -23.569 46.550 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -3.696 -23.702 48.692 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -5.368 -23.244 48.951 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -5.915 -25.584 49.584 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -4.247 -26.050 49.314 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -3.520 -24.433 51.073 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -5.193 -23.994 51.352 1.00 0.00 H new ATOM 0 HE ARG A 48 -3.906 -26.592 52.039 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -6.767 -24.495 52.114 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -7.591 -25.476 53.331 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -4.980 -27.848 53.582 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -6.579 -27.371 54.160 1.00 0.00 H new ATOM 791 N GLU A 49 -4.695 -26.745 46.517 1.00 0.00 N ATOM 792 CA GLU A 49 -3.938 -27.921 46.100 1.00 0.00 C ATOM 793 C GLU A 49 -3.260 -27.702 44.754 1.00 0.00 C ATOM 794 O GLU A 49 -2.282 -28.372 44.431 1.00 0.00 O ATOM 795 CB GLU A 49 -4.861 -29.130 46.006 1.00 0.00 C ATOM 796 CG GLU A 49 -5.500 -29.513 47.320 1.00 0.00 C ATOM 797 CD GLU A 49 -6.399 -30.720 47.203 1.00 0.00 C ATOM 798 OE1 GLU A 49 -7.156 -30.816 46.210 1.00 0.00 O ATOM 799 OE2 GLU A 49 -6.365 -31.572 48.125 1.00 0.00 O ATOM 0 H GLU A 49 -5.693 -26.916 46.638 1.00 0.00 H new ATOM 0 HA GLU A 49 -3.167 -28.098 46.849 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -5.645 -28.921 45.279 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -4.293 -29.980 45.627 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -4.719 -29.717 48.053 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -6.079 -28.670 47.697 1.00 0.00 H new ATOM 806 N MET A 50 -3.769 -26.743 43.984 1.00 0.00 N ATOM 807 CA MET A 50 -3.251 -26.454 42.656 1.00 0.00 C ATOM 808 C MET A 50 -1.803 -25.989 42.708 1.00 0.00 C ATOM 809 O MET A 50 -1.041 -26.207 41.769 1.00 0.00 O ATOM 810 CB MET A 50 -4.116 -25.423 41.945 1.00 0.00 C ATOM 811 CG MET A 50 -5.523 -25.911 41.660 1.00 0.00 C ATOM 812 SD MET A 50 -6.493 -24.735 40.707 1.00 0.00 S ATOM 813 CE MET A 50 -5.677 -24.869 39.121 1.00 0.00 C ATOM 0 H MET A 50 -4.549 -26.149 44.265 1.00 0.00 H new ATOM 0 HA MET A 50 -3.283 -27.383 42.087 1.00 0.00 H new ATOM 0 HB2 MET A 50 -4.169 -24.521 42.555 1.00 0.00 H new ATOM 0 HB3 MET A 50 -3.639 -25.145 41.005 1.00 0.00 H new ATOM 0 HG2 MET A 50 -5.472 -26.855 41.118 1.00 0.00 H new ATOM 0 HG3 MET A 50 -6.030 -26.112 42.604 1.00 0.00 H new ATOM 0 HE1 MET A 50 -6.390 -24.652 38.326 1.00 0.00 H new ATOM 0 HE2 MET A 50 -4.853 -24.157 39.074 1.00 0.00 H new ATOM 0 HE3 MET A 50 -5.290 -25.880 38.995 1.00 0.00 H new ATOM 823 N ALA A 51 -1.431 -25.344 43.807 1.00 0.00 N ATOM 824 CA ALA A 51 -0.072 -24.853 43.974 1.00 0.00 C ATOM 825 C ALA A 51 0.915 -26.002 44.159 1.00 0.00 C ATOM 826 O ALA A 51 2.129 -25.811 44.064 1.00 0.00 O ATOM 827 CB ALA A 51 0.009 -23.890 45.147 1.00 0.00 C ATOM 0 H ALA A 51 -2.051 -25.150 44.593 1.00 0.00 H new ATOM 0 HA ALA A 51 0.202 -24.319 43.064 1.00 0.00 H new ATOM 0 HB1 ALA A 51 1.033 -23.534 45.255 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -0.653 -23.042 44.968 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -0.296 -24.402 46.060 1.00 0.00 H new ATOM 833 N THR A 52 0.395 -27.194 44.424 1.00 0.00 N ATOM 834 CA THR A 52 1.232 -28.362 44.612 1.00 0.00 C ATOM 835 C THR A 52 0.821 -29.497 43.671 1.00 0.00 C ATOM 836 O THR A 52 -0.073 -30.290 43.979 1.00 0.00 O ATOM 837 CB THR A 52 1.203 -28.848 46.075 1.00 0.00 C ATOM 838 OG1 THR A 52 -0.157 -28.956 46.528 1.00 0.00 O ATOM 839 CG2 THR A 52 1.968 -27.890 46.981 1.00 0.00 C ATOM 0 H THR A 52 -0.605 -27.373 44.513 1.00 0.00 H new ATOM 0 HA THR A 52 2.253 -28.066 44.371 1.00 0.00 H new ATOM 0 HB THR A 52 1.682 -29.826 46.119 1.00 0.00 H new ATOM 0 HG1 THR A 52 -0.715 -29.313 45.806 1.00 0.00 H new ATOM 0 HG21 THR A 52 1.933 -28.254 48.008 1.00 0.00 H new ATOM 0 HG22 THR A 52 3.006 -27.829 46.653 1.00 0.00 H new ATOM 0 HG23 THR A 52 1.513 -26.901 46.931 1.00 0.00 H new ATOM 847 N PRO A 53 1.483 -29.587 42.508 1.00 0.00 N ATOM 848 CA PRO A 53 1.204 -30.620 41.490 1.00 0.00 C ATOM 849 C PRO A 53 1.522 -32.021 42.004 1.00 0.00 C ATOM 850 O PRO A 53 1.018 -33.024 41.488 1.00 0.00 O ATOM 851 CB PRO A 53 2.157 -30.245 40.342 1.00 0.00 C ATOM 852 CG PRO A 53 2.500 -28.815 40.591 1.00 0.00 C ATOM 853 CD PRO A 53 2.552 -28.675 42.072 1.00 0.00 C ATOM 0 HA PRO A 53 0.153 -30.646 41.201 1.00 0.00 H new ATOM 0 HB2 PRO A 53 3.048 -30.873 40.345 1.00 0.00 H new ATOM 0 HB3 PRO A 53 1.679 -30.375 39.371 1.00 0.00 H new ATOM 0 HG2 PRO A 53 3.457 -28.555 40.138 1.00 0.00 H new ATOM 0 HG3 PRO A 53 1.752 -28.150 40.159 1.00 0.00 H new ATOM 0 HD2 PRO A 53 3.523 -28.964 42.474 1.00 0.00 H new ATOM 0 HD3 PRO A 53 2.367 -27.649 42.391 1.00 0.00 H new ATOM 861 N GLU A 54 2.351 -32.068 43.036 1.00 0.00 N ATOM 862 CA GLU A 54 2.784 -33.312 43.659 1.00 0.00 C ATOM 863 C GLU A 54 1.603 -34.075 44.243 1.00 0.00 C ATOM 864 O GLU A 54 1.615 -35.299 44.298 1.00 0.00 O ATOM 865 CB GLU A 54 3.794 -33.010 44.754 1.00 0.00 C ATOM 866 CG GLU A 54 5.037 -32.308 44.247 1.00 0.00 C ATOM 867 CD GLU A 54 6.001 -31.963 45.352 1.00 0.00 C ATOM 868 OE1 GLU A 54 6.617 -32.887 45.918 1.00 0.00 O ATOM 869 OE2 GLU A 54 6.134 -30.764 45.676 1.00 0.00 O ATOM 0 H GLU A 54 2.747 -31.234 43.470 1.00 0.00 H new ATOM 0 HA GLU A 54 3.246 -33.936 42.894 1.00 0.00 H new ATOM 0 HB2 GLU A 54 3.320 -32.390 45.515 1.00 0.00 H new ATOM 0 HB3 GLU A 54 4.084 -33.942 45.238 1.00 0.00 H new ATOM 0 HG2 GLU A 54 5.538 -32.946 43.519 1.00 0.00 H new ATOM 0 HG3 GLU A 54 4.747 -31.396 43.725 1.00 0.00 H new ATOM 876 N ALA A 55 0.579 -33.339 44.669 1.00 0.00 N ATOM 877 CA ALA A 55 -0.610 -33.945 45.262 1.00 0.00 C ATOM 878 C ALA A 55 -1.280 -34.900 44.278 1.00 0.00 C ATOM 879 O ALA A 55 -1.676 -36.009 44.641 1.00 0.00 O ATOM 880 CB ALA A 55 -1.584 -32.865 45.705 1.00 0.00 C ATOM 0 H ALA A 55 0.549 -32.321 44.614 1.00 0.00 H new ATOM 0 HA ALA A 55 -0.304 -34.520 46.136 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -2.466 -33.329 46.145 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -1.104 -32.223 46.444 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -1.881 -32.267 44.843 1.00 0.00 H new ATOM 886 N GLY A 56 -1.393 -34.462 43.030 1.00 0.00 N ATOM 887 CA GLY A 56 -1.970 -35.298 41.999 1.00 0.00 C ATOM 888 C GLY A 56 -1.101 -36.493 41.702 1.00 0.00 C ATOM 889 O GLY A 56 -1.597 -37.597 41.479 1.00 0.00 O ATOM 0 H GLY A 56 -1.094 -33.539 42.715 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -2.958 -35.635 42.314 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -2.108 -34.713 41.090 1.00 0.00 H new ATOM 893 N VAL A 57 0.199 -36.267 41.715 1.00 0.00 N ATOM 894 CA VAL A 57 1.166 -37.317 41.451 1.00 0.00 C ATOM 895 C VAL A 57 1.092 -38.398 42.524 1.00 0.00 C ATOM 896 O VAL A 57 1.072 -39.583 42.216 1.00 0.00 O ATOM 897 CB VAL A 57 2.602 -36.749 41.377 1.00 0.00 C ATOM 898 CG1 VAL A 57 3.616 -37.861 41.171 1.00 0.00 C ATOM 899 CG2 VAL A 57 2.711 -35.714 40.266 1.00 0.00 C ATOM 0 H VAL A 57 0.614 -35.355 41.908 1.00 0.00 H new ATOM 0 HA VAL A 57 0.919 -37.757 40.485 1.00 0.00 H new ATOM 0 HB VAL A 57 2.822 -36.262 42.327 1.00 0.00 H new ATOM 0 HG11 VAL A 57 4.618 -37.435 41.122 1.00 0.00 H new ATOM 0 HG12 VAL A 57 3.560 -38.563 42.003 1.00 0.00 H new ATOM 0 HG13 VAL A 57 3.398 -38.384 40.240 1.00 0.00 H new ATOM 0 HG21 VAL A 57 3.729 -35.325 40.229 1.00 0.00 H new ATOM 0 HG22 VAL A 57 2.465 -36.178 39.311 1.00 0.00 H new ATOM 0 HG23 VAL A 57 2.017 -34.896 40.461 1.00 0.00 H new ATOM 909 N ALA A 58 1.020 -37.976 43.781 1.00 0.00 N ATOM 910 CA ALA A 58 0.953 -38.903 44.903 1.00 0.00 C ATOM 911 C ALA A 58 -0.290 -39.788 44.810 1.00 0.00 C ATOM 912 O ALA A 58 -0.239 -40.983 45.115 1.00 0.00 O ATOM 913 CB ALA A 58 0.965 -38.140 46.220 1.00 0.00 C ATOM 0 H ALA A 58 1.007 -36.992 44.049 1.00 0.00 H new ATOM 0 HA ALA A 58 1.830 -39.549 44.863 1.00 0.00 H new ATOM 0 HB1 ALA A 58 0.914 -38.845 47.050 1.00 0.00 H new ATOM 0 HB2 ALA A 58 1.883 -37.557 46.295 1.00 0.00 H new ATOM 0 HB3 ALA A 58 0.106 -37.470 46.260 1.00 0.00 H new ATOM 919 N LEU A 59 -1.406 -39.196 44.391 1.00 0.00 N ATOM 920 CA LEU A 59 -2.652 -39.939 44.216 1.00 0.00 C ATOM 921 C LEU A 59 -2.476 -41.011 43.140 1.00 0.00 C ATOM 922 O LEU A 59 -2.828 -42.177 43.337 1.00 0.00 O ATOM 923 CB LEU A 59 -3.778 -38.983 43.794 1.00 0.00 C ATOM 924 CG LEU A 59 -5.150 -39.624 43.522 1.00 0.00 C ATOM 925 CD1 LEU A 59 -5.798 -40.108 44.799 1.00 0.00 C ATOM 926 CD2 LEU A 59 -6.061 -38.658 42.804 1.00 0.00 C ATOM 0 H LEU A 59 -1.473 -38.203 44.166 1.00 0.00 H new ATOM 0 HA LEU A 59 -2.911 -40.413 45.163 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -3.900 -38.232 44.575 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -3.461 -38.458 42.893 1.00 0.00 H new ATOM 0 HG LEU A 59 -4.985 -40.489 42.880 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -6.765 -40.555 44.569 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -5.158 -40.852 45.273 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -5.939 -39.266 45.477 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -7.025 -39.133 42.623 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -6.205 -37.769 43.418 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -5.612 -38.373 41.852 1.00 0.00 H new ATOM 938 N LEU A 60 -1.899 -40.606 42.016 1.00 0.00 N ATOM 939 CA LEU A 60 -1.690 -41.493 40.890 1.00 0.00 C ATOM 940 C LEU A 60 -0.668 -42.587 41.205 1.00 0.00 C ATOM 941 O LEU A 60 -0.844 -43.735 40.807 1.00 0.00 O ATOM 942 CB LEU A 60 -1.292 -40.698 39.649 1.00 0.00 C ATOM 943 CG LEU A 60 -2.353 -39.711 39.140 1.00 0.00 C ATOM 944 CD1 LEU A 60 -1.925 -39.087 37.833 1.00 0.00 C ATOM 945 CD2 LEU A 60 -3.706 -40.385 38.990 1.00 0.00 C ATOM 0 H LEU A 60 -1.565 -39.654 41.864 1.00 0.00 H new ATOM 0 HA LEU A 60 -2.635 -41.996 40.685 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -0.379 -40.145 39.868 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -1.056 -41.398 38.848 1.00 0.00 H new ATOM 0 HG LEU A 60 -2.451 -38.920 39.884 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -2.693 -38.392 37.493 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -0.987 -38.550 37.976 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -1.786 -39.868 37.085 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -4.435 -39.660 38.628 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -3.626 -41.206 38.278 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -4.028 -40.773 39.956 1.00 0.00 H new ATOM 957 N GLU A 61 0.394 -42.223 41.920 1.00 0.00 N ATOM 958 CA GLU A 61 1.423 -43.178 42.325 1.00 0.00 C ATOM 959 C GLU A 61 0.828 -44.301 43.165 1.00 0.00 C ATOM 960 O GLU A 61 1.212 -45.466 43.023 1.00 0.00 O ATOM 961 CB GLU A 61 2.520 -42.461 43.100 1.00 0.00 C ATOM 962 CG GLU A 61 3.459 -41.653 42.222 1.00 0.00 C ATOM 963 CD GLU A 61 4.382 -42.535 41.405 1.00 0.00 C ATOM 964 OE1 GLU A 61 5.198 -43.269 42.014 1.00 0.00 O ATOM 965 OE2 GLU A 61 4.311 -42.503 40.162 1.00 0.00 O ATOM 0 H GLU A 61 0.565 -41.267 42.233 1.00 0.00 H new ATOM 0 HA GLU A 61 1.852 -43.622 41.427 1.00 0.00 H new ATOM 0 HB2 GLU A 61 2.061 -41.797 43.833 1.00 0.00 H new ATOM 0 HB3 GLU A 61 3.100 -43.197 43.656 1.00 0.00 H new ATOM 0 HG2 GLU A 61 2.874 -41.023 41.552 1.00 0.00 H new ATOM 0 HG3 GLU A 61 4.055 -40.987 42.847 1.00 0.00 H new ATOM 972 N LYS A 62 -0.104 -43.946 44.036 1.00 0.00 N ATOM 973 CA LYS A 62 -0.798 -44.926 44.855 1.00 0.00 C ATOM 974 C LYS A 62 -1.589 -45.882 43.966 1.00 0.00 C ATOM 975 O LYS A 62 -1.524 -47.105 44.124 1.00 0.00 O ATOM 976 CB LYS A 62 -1.742 -44.217 45.814 1.00 0.00 C ATOM 977 CG LYS A 62 -2.462 -45.156 46.759 1.00 0.00 C ATOM 978 CD LYS A 62 -3.421 -44.403 47.652 1.00 0.00 C ATOM 979 CE LYS A 62 -2.696 -43.548 48.678 1.00 0.00 C ATOM 980 NZ LYS A 62 -3.648 -42.784 49.521 1.00 0.00 N ATOM 0 H LYS A 62 -0.398 -42.982 44.194 1.00 0.00 H new ATOM 0 HA LYS A 62 -0.065 -45.496 45.426 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -1.176 -43.491 46.398 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -2.480 -43.658 45.238 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -3.007 -45.906 46.186 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -1.734 -45.689 47.370 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -4.063 -43.769 47.041 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -4.070 -45.112 48.166 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -2.078 -44.184 49.311 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -2.025 -42.857 48.168 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -3.332 -42.809 50.512 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -3.686 -41.797 49.195 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -4.594 -43.209 49.448 1.00 0.00 H new ATOM 994 N ILE A 63 -2.301 -45.307 43.011 1.00 0.00 N ATOM 995 CA ILE A 63 -3.126 -46.062 42.077 1.00 0.00 C ATOM 996 C ILE A 63 -2.267 -46.992 41.219 1.00 0.00 C ATOM 997 O ILE A 63 -2.588 -48.171 41.044 1.00 0.00 O ATOM 998 CB ILE A 63 -3.893 -45.086 41.149 1.00 0.00 C ATOM 999 CG1 ILE A 63 -4.913 -44.285 41.953 1.00 0.00 C ATOM 1000 CG2 ILE A 63 -4.573 -45.825 40.004 1.00 0.00 C ATOM 1001 CD1 ILE A 63 -5.556 -43.165 41.173 1.00 0.00 C ATOM 0 H ILE A 63 -2.324 -44.299 42.859 1.00 0.00 H new ATOM 0 HA ILE A 63 -3.830 -46.662 42.654 1.00 0.00 H new ATOM 0 HB ILE A 63 -3.169 -44.397 40.713 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -5.691 -44.960 42.311 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -4.423 -43.868 42.833 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -5.102 -45.111 39.373 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -3.822 -46.347 39.411 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -5.283 -46.547 40.408 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -6.269 -42.641 41.810 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -4.788 -42.468 40.837 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -6.076 -43.576 40.308 1.00 0.00 H new ATOM 1013 N TRP A 64 -1.165 -46.457 40.719 1.00 0.00 N ATOM 1014 CA TRP A 64 -0.259 -47.202 39.866 1.00 0.00 C ATOM 1015 C TRP A 64 0.310 -48.417 40.586 1.00 0.00 C ATOM 1016 O TRP A 64 0.412 -49.486 40.011 1.00 0.00 O ATOM 1017 CB TRP A 64 0.862 -46.288 39.340 1.00 0.00 C ATOM 1018 CG TRP A 64 1.937 -47.015 38.583 1.00 0.00 C ATOM 1019 CD1 TRP A 64 3.281 -46.933 38.788 1.00 0.00 C ATOM 1020 CD2 TRP A 64 1.755 -47.952 37.515 1.00 0.00 C ATOM 1021 NE1 TRP A 64 3.939 -47.752 37.901 1.00 0.00 N ATOM 1022 CE2 TRP A 64 3.029 -48.390 37.125 1.00 0.00 C ATOM 1023 CE3 TRP A 64 0.638 -48.464 36.852 1.00 0.00 C ATOM 1024 CZ2 TRP A 64 3.222 -49.312 36.110 1.00 0.00 C ATOM 1025 CZ3 TRP A 64 0.834 -49.379 35.843 1.00 0.00 C ATOM 1026 CH2 TRP A 64 2.118 -49.796 35.487 1.00 0.00 C ATOM 0 H TRP A 64 -0.875 -45.495 40.894 1.00 0.00 H new ATOM 0 HA TRP A 64 -0.826 -47.570 39.011 1.00 0.00 H new ATOM 0 HB2 TRP A 64 0.424 -45.530 38.691 1.00 0.00 H new ATOM 0 HB3 TRP A 64 1.315 -45.764 40.182 1.00 0.00 H new ATOM 0 HD1 TRP A 64 3.758 -46.317 39.535 1.00 0.00 H new ATOM 0 HE1 TRP A 64 4.951 -47.862 37.837 1.00 0.00 H new ATOM 0 HE3 TRP A 64 -0.358 -48.149 37.125 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 4.213 -49.633 35.825 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 -0.020 -49.781 35.318 1.00 0.00 H new ATOM 0 HH2 TRP A 64 2.235 -50.522 34.696 1.00 0.00 H new ATOM 1037 N THR A 65 0.642 -48.254 41.849 1.00 0.00 N ATOM 1038 CA THR A 65 1.198 -49.344 42.635 1.00 0.00 C ATOM 1039 C THR A 65 0.210 -50.520 42.733 1.00 0.00 C ATOM 1040 O THR A 65 0.606 -51.684 42.730 1.00 0.00 O ATOM 1041 CB THR A 65 1.599 -48.865 44.049 1.00 0.00 C ATOM 1042 OG1 THR A 65 2.393 -47.671 43.945 1.00 0.00 O ATOM 1043 CG2 THR A 65 2.402 -49.932 44.775 1.00 0.00 C ATOM 0 H THR A 65 0.538 -47.376 42.358 1.00 0.00 H new ATOM 0 HA THR A 65 2.095 -49.690 42.121 1.00 0.00 H new ATOM 0 HB THR A 65 0.689 -48.664 44.614 1.00 0.00 H new ATOM 0 HG1 THR A 65 1.808 -46.902 43.780 1.00 0.00 H new ATOM 0 HG21 THR A 65 2.672 -49.571 45.767 1.00 0.00 H new ATOM 0 HG22 THR A 65 1.803 -50.838 44.869 1.00 0.00 H new ATOM 0 HG23 THR A 65 3.308 -50.153 44.210 1.00 0.00 H new ATOM 1051 N MET A 66 -1.062 -50.205 42.843 1.00 0.00 N ATOM 1052 CA MET A 66 -2.095 -51.218 42.951 1.00 0.00 C ATOM 1053 C MET A 66 -2.336 -51.973 41.625 1.00 0.00 C ATOM 1054 O MET A 66 -2.617 -53.168 41.635 1.00 0.00 O ATOM 1055 CB MET A 66 -3.400 -50.604 43.460 1.00 0.00 C ATOM 1056 CG MET A 66 -3.256 -49.867 44.788 1.00 0.00 C ATOM 1057 SD MET A 66 -4.812 -49.172 45.381 1.00 0.00 S ATOM 1058 CE MET A 66 -5.735 -50.664 45.736 1.00 0.00 C ATOM 0 H MET A 66 -1.410 -49.246 42.860 1.00 0.00 H new ATOM 0 HA MET A 66 -1.738 -51.953 43.673 1.00 0.00 H new ATOM 0 HB2 MET A 66 -3.782 -49.911 42.710 1.00 0.00 H new ATOM 0 HB3 MET A 66 -4.143 -51.394 43.572 1.00 0.00 H new ATOM 0 HG2 MET A 66 -2.862 -50.554 45.537 1.00 0.00 H new ATOM 0 HG3 MET A 66 -2.526 -49.065 44.675 1.00 0.00 H new ATOM 0 HE1 MET A 66 -6.762 -50.404 45.993 1.00 0.00 H new ATOM 0 HE2 MET A 66 -5.734 -51.310 44.858 1.00 0.00 H new ATOM 0 HE3 MET A 66 -5.273 -51.187 46.573 1.00 0.00 H new ATOM 1068 N ILE A 67 -2.233 -51.272 40.492 1.00 0.00 N ATOM 1069 CA ILE A 67 -2.553 -51.879 39.180 1.00 0.00 C ATOM 1070 C ILE A 67 -1.328 -52.262 38.343 1.00 0.00 C ATOM 1071 O ILE A 67 -1.480 -52.833 37.263 1.00 0.00 O ATOM 1072 CB ILE A 67 -3.444 -50.951 38.327 1.00 0.00 C ATOM 1073 CG1 ILE A 67 -2.760 -49.590 38.121 1.00 0.00 C ATOM 1074 CG2 ILE A 67 -4.810 -50.788 38.963 1.00 0.00 C ATOM 1075 CD1 ILE A 67 -3.502 -48.667 37.179 1.00 0.00 C ATOM 0 H ILE A 67 -1.936 -50.297 40.447 1.00 0.00 H new ATOM 0 HA ILE A 67 -3.082 -52.797 39.437 1.00 0.00 H new ATOM 0 HB ILE A 67 -3.585 -51.409 37.348 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -2.654 -49.098 39.088 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -1.754 -49.755 37.735 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -5.422 -50.130 38.346 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -5.292 -51.762 39.044 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -4.699 -50.354 39.957 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -2.957 -47.728 37.085 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -3.585 -49.137 36.199 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -4.499 -48.470 37.573 1.00 0.00 H new ATOM 1087 N GLU A 68 -0.135 -51.970 38.828 1.00 0.00 N ATOM 1088 CA GLU A 68 1.095 -52.250 38.059 1.00 0.00 C ATOM 1089 C GLU A 68 1.238 -53.731 37.667 1.00 0.00 C ATOM 1090 O GLU A 68 1.885 -54.065 36.674 1.00 0.00 O ATOM 1091 CB GLU A 68 2.342 -51.745 38.802 1.00 0.00 C ATOM 1092 CG GLU A 68 2.399 -52.074 40.293 1.00 0.00 C ATOM 1093 CD GLU A 68 2.621 -53.542 40.585 1.00 0.00 C ATOM 1094 OE1 GLU A 68 3.750 -54.022 40.384 1.00 0.00 O ATOM 1095 OE2 GLU A 68 1.671 -54.222 41.034 1.00 0.00 O ATOM 0 H GLU A 68 0.023 -51.543 39.741 1.00 0.00 H new ATOM 0 HA GLU A 68 1.006 -51.696 37.125 1.00 0.00 H new ATOM 0 HB2 GLU A 68 3.225 -52.166 38.321 1.00 0.00 H new ATOM 0 HB3 GLU A 68 2.400 -50.663 38.684 1.00 0.00 H new ATOM 0 HG2 GLU A 68 3.201 -51.496 40.753 1.00 0.00 H new ATOM 0 HG3 GLU A 68 1.468 -51.756 40.762 1.00 0.00 H new ATOM 1102 N ASN A 69 0.630 -54.596 38.442 1.00 0.00 N ATOM 1103 CA ASN A 69 0.672 -56.030 38.193 1.00 0.00 C ATOM 1104 C ASN A 69 -0.044 -56.423 36.896 1.00 0.00 C ATOM 1105 O ASN A 69 0.431 -57.289 36.163 1.00 0.00 O ATOM 1106 CB ASN A 69 0.107 -56.798 39.398 1.00 0.00 C ATOM 1107 CG ASN A 69 -1.152 -56.168 39.960 1.00 0.00 C ATOM 1108 OD1 ASN A 69 -2.265 -56.512 39.574 1.00 0.00 O ATOM 1109 ND2 ASN A 69 -0.976 -55.221 40.867 1.00 0.00 N ATOM 0 H ASN A 69 0.090 -54.333 39.266 1.00 0.00 H new ATOM 0 HA ASN A 69 1.718 -56.307 38.061 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -0.108 -57.824 39.100 1.00 0.00 H new ATOM 0 HB3 ASN A 69 0.864 -56.845 40.180 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -1.783 -54.747 41.273 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -0.033 -54.965 41.161 1.00 0.00 H new ATOM 1116 N GLU A 70 -1.172 -55.788 36.604 1.00 0.00 N ATOM 1117 CA GLU A 70 -1.936 -56.134 35.398 1.00 0.00 C ATOM 1118 C GLU A 70 -1.833 -55.047 34.323 1.00 0.00 C ATOM 1119 O GLU A 70 -2.275 -55.237 33.188 1.00 0.00 O ATOM 1120 CB GLU A 70 -3.405 -56.376 35.746 1.00 0.00 C ATOM 1121 CG GLU A 70 -3.632 -57.512 36.729 1.00 0.00 C ATOM 1122 CD GLU A 70 -3.105 -58.839 36.231 1.00 0.00 C ATOM 1123 OE1 GLU A 70 -3.519 -59.291 35.147 1.00 0.00 O ATOM 1124 OE2 GLU A 70 -2.279 -59.454 36.932 1.00 0.00 O ATOM 0 H GLU A 70 -1.578 -55.043 37.170 1.00 0.00 H new ATOM 0 HA GLU A 70 -1.502 -57.049 34.995 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -3.824 -55.460 36.163 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -3.954 -56.589 34.829 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -3.150 -57.268 37.675 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -4.699 -57.604 36.930 1.00 0.00 H new ATOM 1131 N ALA A 71 -1.248 -53.920 34.675 1.00 0.00 N ATOM 1132 CA ALA A 71 -1.150 -52.793 33.755 1.00 0.00 C ATOM 1133 C ALA A 71 0.294 -52.355 33.542 1.00 0.00 C ATOM 1134 O ALA A 71 1.157 -52.624 34.363 1.00 0.00 O ATOM 1135 CB ALA A 71 -1.976 -51.620 34.280 1.00 0.00 C ATOM 0 H ALA A 71 -0.831 -53.755 35.591 1.00 0.00 H new ATOM 0 HA ALA A 71 -1.542 -53.119 32.792 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -1.898 -50.782 33.588 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -3.020 -51.921 34.369 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -1.600 -51.319 35.258 1.00 0.00 H new ATOM 1141 N ASN A 72 0.544 -51.722 32.412 1.00 0.00 N ATOM 1142 CA ASN A 72 1.848 -51.143 32.105 1.00 0.00 C ATOM 1143 C ASN A 72 1.690 -49.633 31.942 1.00 0.00 C ATOM 1144 O ASN A 72 0.805 -49.173 31.215 1.00 0.00 O ATOM 1145 CB ASN A 72 2.482 -51.784 30.838 1.00 0.00 C ATOM 1146 CG ASN A 72 1.560 -51.809 29.628 1.00 0.00 C ATOM 1147 OD1 ASN A 72 1.487 -50.854 28.864 1.00 0.00 O ATOM 1148 ND2 ASN A 72 0.884 -52.926 29.422 1.00 0.00 N ATOM 0 H ASN A 72 -0.150 -51.592 31.676 1.00 0.00 H new ATOM 0 HA ASN A 72 2.531 -51.351 32.929 1.00 0.00 H new ATOM 0 HB2 ASN A 72 3.388 -51.235 30.580 1.00 0.00 H new ATOM 0 HB3 ASN A 72 2.784 -52.805 31.073 1.00 0.00 H new ATOM 0 HD21 ASN A 72 0.278 -53.012 28.606 1.00 0.00 H new ATOM 0 HD22 ASN A 72 0.968 -53.702 30.079 1.00 0.00 H new ATOM 1155 N ARG A 73 2.510 -48.861 32.648 1.00 0.00 N ATOM 1156 CA ARG A 73 2.389 -47.435 32.621 1.00 0.00 C ATOM 1157 C ARG A 73 2.982 -46.854 31.351 1.00 0.00 C ATOM 1158 O ARG A 73 4.199 -46.842 31.160 1.00 0.00 O ATOM 1159 CB ARG A 73 3.016 -46.809 33.864 1.00 0.00 C ATOM 1160 CG ARG A 73 2.791 -45.326 33.940 1.00 0.00 C ATOM 1161 CD ARG A 73 3.205 -44.729 35.284 1.00 0.00 C ATOM 1162 NE ARG A 73 4.651 -44.752 35.521 1.00 0.00 N ATOM 1163 CZ ARG A 73 5.224 -44.308 36.652 1.00 0.00 C ATOM 1164 NH1 ARG A 73 4.459 -43.888 37.666 1.00 0.00 N ATOM 1165 NH2 ARG A 73 6.549 -44.298 36.774 1.00 0.00 N ATOM 0 H ARG A 73 3.261 -49.213 33.241 1.00 0.00 H new ATOM 0 HA ARG A 73 1.327 -47.191 32.626 1.00 0.00 H new ATOM 0 HB2 ARG A 73 2.600 -47.282 34.754 1.00 0.00 H new ATOM 0 HB3 ARG A 73 4.087 -47.011 33.867 1.00 0.00 H new ATOM 0 HG2 ARG A 73 3.352 -44.837 33.143 1.00 0.00 H new ATOM 0 HG3 ARG A 73 1.736 -45.114 33.764 1.00 0.00 H new ATOM 0 HD2 ARG A 73 2.854 -43.698 35.337 1.00 0.00 H new ATOM 0 HD3 ARG A 73 2.706 -45.277 36.083 1.00 0.00 H new ATOM 0 HE ARG A 73 5.255 -45.125 34.788 1.00 0.00 H new ATOM 0 HH11 ARG A 73 3.443 -43.905 37.579 1.00 0.00 H new ATOM 0 HH12 ARG A 73 4.892 -43.550 38.526 1.00 0.00 H new ATOM 0 HH21 ARG A 73 7.134 -44.628 36.007 1.00 0.00 H new ATOM 0 HH22 ARG A 73 6.979 -43.960 37.635 1.00 0.00 H new ATOM 1179 N ASP A 74 2.107 -46.393 30.477 1.00 0.00 N ATOM 1180 CA ASP A 74 2.509 -45.808 29.208 1.00 0.00 C ATOM 1181 C ASP A 74 3.258 -44.505 29.431 1.00 0.00 C ATOM 1182 O ASP A 74 4.288 -44.247 28.801 1.00 0.00 O ATOM 1183 CB ASP A 74 1.282 -45.562 28.328 1.00 0.00 C ATOM 1184 CG ASP A 74 1.638 -44.968 26.980 1.00 0.00 C ATOM 1185 OD1 ASP A 74 2.068 -45.735 26.083 1.00 0.00 O ATOM 1186 OD2 ASP A 74 1.472 -43.747 26.800 1.00 0.00 O ATOM 0 H ASP A 74 1.098 -46.413 30.625 1.00 0.00 H new ATOM 0 HA ASP A 74 3.174 -46.508 28.703 1.00 0.00 H new ATOM 0 HB2 ASP A 74 0.754 -46.503 28.177 1.00 0.00 H new ATOM 0 HB3 ASP A 74 0.597 -44.891 28.846 1.00 0.00 H new ATOM 1191 N LYS A 75 2.756 -43.703 30.349 1.00 0.00 N ATOM 1192 CA LYS A 75 3.352 -42.417 30.633 1.00 0.00 C ATOM 1193 C LYS A 75 3.194 -42.104 32.123 1.00 0.00 C ATOM 1194 O LYS A 75 2.145 -42.378 32.714 1.00 0.00 O ATOM 1195 CB LYS A 75 2.689 -41.330 29.755 1.00 0.00 C ATOM 1196 CG LYS A 75 3.582 -40.124 29.444 1.00 0.00 C ATOM 1197 CD LYS A 75 3.790 -39.234 30.655 1.00 0.00 C ATOM 1198 CE LYS A 75 4.779 -38.120 30.365 1.00 0.00 C ATOM 1199 NZ LYS A 75 6.132 -38.653 30.049 1.00 0.00 N ATOM 0 H LYS A 75 1.934 -43.922 30.912 1.00 0.00 H new ATOM 0 HA LYS A 75 4.416 -42.437 30.397 1.00 0.00 H new ATOM 0 HB2 LYS A 75 2.374 -41.784 28.815 1.00 0.00 H new ATOM 0 HB3 LYS A 75 1.788 -40.978 30.256 1.00 0.00 H new ATOM 0 HG2 LYS A 75 4.549 -40.474 29.083 1.00 0.00 H new ATOM 0 HG3 LYS A 75 3.134 -39.541 28.640 1.00 0.00 H new ATOM 0 HD2 LYS A 75 2.836 -38.804 30.960 1.00 0.00 H new ATOM 0 HD3 LYS A 75 4.151 -39.834 31.491 1.00 0.00 H new ATOM 0 HE2 LYS A 75 4.419 -37.522 29.528 1.00 0.00 H new ATOM 0 HE3 LYS A 75 4.842 -37.456 31.227 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 6.853 -38.073 30.523 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 6.204 -39.636 30.382 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 6.285 -38.624 29.021 1.00 0.00 H new ATOM 1213 N GLU A 76 4.250 -41.558 32.723 1.00 0.00 N ATOM 1214 CA GLU A 76 4.262 -41.208 34.146 1.00 0.00 C ATOM 1215 C GLU A 76 3.213 -40.131 34.439 1.00 0.00 C ATOM 1216 O GLU A 76 2.784 -39.418 33.533 1.00 0.00 O ATOM 1217 CB GLU A 76 5.651 -40.673 34.567 1.00 0.00 C ATOM 1218 CG GLU A 76 6.833 -41.280 33.821 1.00 0.00 C ATOM 1219 CD GLU A 76 7.116 -40.571 32.511 1.00 0.00 C ATOM 1220 OE1 GLU A 76 7.873 -39.584 32.515 1.00 0.00 O ATOM 1221 OE2 GLU A 76 6.572 -40.990 31.469 1.00 0.00 O ATOM 0 H GLU A 76 5.122 -41.345 32.239 1.00 0.00 H new ATOM 0 HA GLU A 76 4.034 -42.111 34.712 1.00 0.00 H new ATOM 0 HB2 GLU A 76 5.666 -39.593 34.422 1.00 0.00 H new ATOM 0 HB3 GLU A 76 5.784 -40.853 35.634 1.00 0.00 H new ATOM 0 HG2 GLU A 76 7.720 -41.236 34.454 1.00 0.00 H new ATOM 0 HG3 GLU A 76 6.633 -42.333 33.625 1.00 0.00 H new ATOM 1228 N PRO A 77 2.775 -39.997 35.708 1.00 0.00 N ATOM 1229 CA PRO A 77 1.827 -38.954 36.089 1.00 0.00 C ATOM 1230 C PRO A 77 2.419 -37.571 35.849 1.00 0.00 C ATOM 1231 O PRO A 77 3.468 -37.223 36.402 1.00 0.00 O ATOM 1232 CB PRO A 77 1.596 -39.188 37.582 1.00 0.00 C ATOM 1233 CG PRO A 77 2.773 -39.985 38.031 1.00 0.00 C ATOM 1234 CD PRO A 77 3.163 -40.831 36.856 1.00 0.00 C ATOM 0 HA PRO A 77 0.905 -38.996 35.509 1.00 0.00 H new ATOM 0 HB2 PRO A 77 1.527 -38.245 38.124 1.00 0.00 H new ATOM 0 HB3 PRO A 77 0.664 -39.725 37.758 1.00 0.00 H new ATOM 0 HG2 PRO A 77 3.593 -39.335 38.335 1.00 0.00 H new ATOM 0 HG3 PRO A 77 2.521 -40.604 38.892 1.00 0.00 H new ATOM 0 HD2 PRO A 77 4.231 -41.051 36.853 1.00 0.00 H new ATOM 0 HD3 PRO A 77 2.640 -41.788 36.856 1.00 0.00 H new ATOM 1242 N ASN A 78 1.747 -36.789 35.041 1.00 0.00 N ATOM 1243 CA ASN A 78 2.242 -35.474 34.669 1.00 0.00 C ATOM 1244 C ASN A 78 1.180 -34.408 34.854 1.00 0.00 C ATOM 1245 O ASN A 78 0.005 -34.622 34.546 1.00 0.00 O ATOM 1246 CB ASN A 78 2.739 -35.487 33.215 1.00 0.00 C ATOM 1247 CG ASN A 78 3.230 -34.128 32.739 1.00 0.00 C ATOM 1248 OD1 ASN A 78 4.373 -33.746 32.988 1.00 0.00 O ATOM 1249 ND2 ASN A 78 2.382 -33.404 32.032 1.00 0.00 N ATOM 0 H ASN A 78 0.850 -37.036 34.623 1.00 0.00 H new ATOM 0 HA ASN A 78 3.075 -35.230 35.329 1.00 0.00 H new ATOM 0 HB2 ASN A 78 3.547 -36.212 33.120 1.00 0.00 H new ATOM 0 HB3 ASN A 78 1.932 -35.823 32.564 1.00 0.00 H new ATOM 0 HD21 ASN A 78 2.666 -32.493 31.671 1.00 0.00 H new ATOM 0 HD22 ASN A 78 1.443 -33.755 31.847 1.00 0.00 H new ATOM 1256 N PHE A 79 1.602 -33.267 35.368 1.00 0.00 N ATOM 1257 CA PHE A 79 0.716 -32.140 35.577 1.00 0.00 C ATOM 1258 C PHE A 79 0.757 -31.221 34.371 1.00 0.00 C ATOM 1259 O PHE A 79 1.803 -30.655 34.041 1.00 0.00 O ATOM 1260 CB PHE A 79 1.120 -31.369 36.844 1.00 0.00 C ATOM 1261 CG PHE A 79 0.307 -30.116 37.100 1.00 0.00 C ATOM 1262 CD1 PHE A 79 -0.958 -30.189 37.660 1.00 0.00 C ATOM 1263 CD2 PHE A 79 0.820 -28.867 36.784 1.00 0.00 C ATOM 1264 CE1 PHE A 79 -1.694 -29.044 37.899 1.00 0.00 C ATOM 1265 CE2 PHE A 79 0.088 -27.720 37.020 1.00 0.00 C ATOM 1266 CZ PHE A 79 -1.171 -27.808 37.578 1.00 0.00 C ATOM 0 H PHE A 79 2.567 -33.097 35.651 1.00 0.00 H new ATOM 0 HA PHE A 79 -0.300 -32.512 35.707 1.00 0.00 H new ATOM 0 HB2 PHE A 79 1.024 -32.032 37.704 1.00 0.00 H new ATOM 0 HB3 PHE A 79 2.172 -31.095 36.768 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -1.374 -31.153 37.913 1.00 0.00 H new ATOM 0 HD2 PHE A 79 1.805 -28.790 36.348 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -2.679 -29.117 38.337 1.00 0.00 H new ATOM 0 HE2 PHE A 79 0.501 -26.754 36.768 1.00 0.00 H new ATOM 0 HZ PHE A 79 -1.745 -26.912 37.763 1.00 0.00 H new ATOM 1276 N GLU A 80 -0.370 -31.083 33.717 1.00 0.00 N ATOM 1277 CA GLU A 80 -0.482 -30.215 32.569 1.00 0.00 C ATOM 1278 C GLU A 80 -1.790 -29.459 32.644 1.00 0.00 C ATOM 1279 O GLU A 80 -2.822 -30.021 33.047 1.00 0.00 O ATOM 1280 CB GLU A 80 -0.390 -31.020 31.271 1.00 0.00 C ATOM 1281 CG GLU A 80 -1.562 -31.954 31.040 1.00 0.00 C ATOM 1282 CD GLU A 80 -1.353 -32.862 29.852 1.00 0.00 C ATOM 1283 OE1 GLU A 80 -0.757 -33.947 30.023 1.00 0.00 O ATOM 1284 OE2 GLU A 80 -1.778 -32.499 28.743 1.00 0.00 O ATOM 0 H GLU A 80 -1.233 -31.567 33.964 1.00 0.00 H new ATOM 0 HA GLU A 80 0.343 -29.503 32.573 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -0.318 -30.329 30.431 1.00 0.00 H new ATOM 0 HB3 GLU A 80 0.530 -31.604 31.282 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -1.721 -32.559 31.932 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -2.467 -31.366 30.889 1.00 0.00 H new ATOM 1291 N GLY A 81 -1.756 -28.199 32.285 1.00 0.00 N ATOM 1292 CA GLY A 81 -2.932 -27.386 32.375 1.00 0.00 C ATOM 1293 C GLY A 81 -3.299 -27.129 33.819 1.00 0.00 C ATOM 1294 O GLY A 81 -2.810 -26.184 34.442 1.00 0.00 O ATOM 0 H GLY A 81 -0.928 -27.721 31.930 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -2.764 -26.438 31.864 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -3.760 -27.880 31.867 1.00 0.00 H new ATOM 1298 N ARG A 82 -4.150 -27.981 34.347 1.00 0.00 N ATOM 1299 CA ARG A 82 -4.555 -27.917 35.734 1.00 0.00 C ATOM 1300 C ARG A 82 -4.964 -29.297 36.234 1.00 0.00 C ATOM 1301 O ARG A 82 -5.616 -29.437 37.269 1.00 0.00 O ATOM 1302 CB ARG A 82 -5.662 -26.890 35.934 1.00 0.00 C ATOM 1303 CG ARG A 82 -6.902 -27.108 35.102 1.00 0.00 C ATOM 1304 CD ARG A 82 -7.861 -25.973 35.335 1.00 0.00 C ATOM 1305 NE ARG A 82 -9.094 -26.097 34.562 1.00 0.00 N ATOM 1306 CZ ARG A 82 -9.785 -25.055 34.091 1.00 0.00 C ATOM 1307 NH1 ARG A 82 -9.327 -23.818 34.271 1.00 0.00 N ATOM 1308 NH2 ARG A 82 -10.924 -25.249 33.432 1.00 0.00 N ATOM 0 H ARG A 82 -4.583 -28.742 33.823 1.00 0.00 H new ATOM 0 HA ARG A 82 -3.703 -27.589 36.329 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -5.946 -26.887 36.986 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -5.263 -25.901 35.709 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -6.640 -27.167 34.046 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -7.370 -28.056 35.368 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -8.107 -25.925 36.396 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -7.372 -25.033 35.079 1.00 0.00 H new ATOM 0 HE ARG A 82 -9.448 -27.034 34.370 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -8.449 -23.666 34.768 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -9.854 -23.022 33.912 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -11.273 -26.196 33.285 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -11.448 -24.451 33.074 1.00 0.00 H new ATOM 1322 N TYR A 83 -4.553 -30.319 35.487 1.00 0.00 N ATOM 1323 CA TYR A 83 -4.845 -31.703 35.830 1.00 0.00 C ATOM 1324 C TYR A 83 -3.588 -32.540 35.810 1.00 0.00 C ATOM 1325 O TYR A 83 -2.699 -32.333 34.977 1.00 0.00 O ATOM 1326 CB TYR A 83 -5.852 -32.326 34.852 1.00 0.00 C ATOM 1327 CG TYR A 83 -7.271 -31.825 34.982 1.00 0.00 C ATOM 1328 CD1 TYR A 83 -7.664 -30.616 34.420 1.00 0.00 C ATOM 1329 CD2 TYR A 83 -8.221 -32.576 35.654 1.00 0.00 C ATOM 1330 CE1 TYR A 83 -8.963 -30.170 34.531 1.00 0.00 C ATOM 1331 CE2 TYR A 83 -9.520 -32.137 35.769 1.00 0.00 C ATOM 1332 CZ TYR A 83 -9.889 -30.938 35.210 1.00 0.00 C ATOM 1333 OH TYR A 83 -11.187 -30.504 35.326 1.00 0.00 O ATOM 0 H TYR A 83 -4.010 -30.209 34.630 1.00 0.00 H new ATOM 0 HA TYR A 83 -5.272 -31.693 36.833 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -5.509 -32.138 33.834 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -5.851 -33.407 34.994 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -6.940 -30.017 33.888 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -7.938 -33.521 36.094 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -9.255 -29.228 34.091 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -10.248 -32.734 36.298 1.00 0.00 H new ATOM 0 HH TYR A 83 -11.420 -29.958 34.546 1.00 0.00 H new ATOM 1343 N VAL A 84 -3.512 -33.470 36.722 1.00 0.00 N ATOM 1344 CA VAL A 84 -2.436 -34.433 36.736 1.00 0.00 C ATOM 1345 C VAL A 84 -2.978 -35.708 36.114 1.00 0.00 C ATOM 1346 O VAL A 84 -4.032 -36.196 36.524 1.00 0.00 O ATOM 1347 CB VAL A 84 -1.939 -34.717 38.179 1.00 0.00 C ATOM 1348 CG1 VAL A 84 -0.833 -35.752 38.196 1.00 0.00 C ATOM 1349 CG2 VAL A 84 -1.468 -33.440 38.848 1.00 0.00 C ATOM 0 H VAL A 84 -4.190 -33.585 37.476 1.00 0.00 H new ATOM 0 HA VAL A 84 -1.583 -34.045 36.179 1.00 0.00 H new ATOM 0 HB VAL A 84 -2.784 -35.118 38.739 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -0.511 -35.924 39.223 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -1.201 -36.685 37.770 1.00 0.00 H new ATOM 0 HG13 VAL A 84 0.011 -35.393 37.607 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -1.124 -33.664 39.858 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -0.648 -33.009 38.273 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -2.292 -32.728 38.894 1.00 0.00 H new ATOM 1359 N ASN A 85 -2.305 -36.225 35.108 1.00 0.00 N ATOM 1360 CA ASN A 85 -2.816 -37.390 34.410 1.00 0.00 C ATOM 1361 C ASN A 85 -1.758 -38.451 34.203 1.00 0.00 C ATOM 1362 O ASN A 85 -0.565 -38.162 34.153 1.00 0.00 O ATOM 1363 CB ASN A 85 -3.453 -36.992 33.069 1.00 0.00 C ATOM 1364 CG ASN A 85 -2.447 -36.492 32.042 1.00 0.00 C ATOM 1365 OD1 ASN A 85 -1.898 -37.267 31.260 1.00 0.00 O ATOM 1366 ND2 ASN A 85 -2.206 -35.193 32.037 1.00 0.00 N ATOM 0 H ASN A 85 -1.417 -35.866 34.758 1.00 0.00 H new ATOM 0 HA ASN A 85 -3.585 -37.825 35.048 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -3.982 -37.852 32.658 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -4.196 -36.215 33.246 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -1.544 -34.800 31.368 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -2.682 -34.583 32.702 1.00 0.00 H new ATOM 1373 N MET A 86 -2.219 -39.686 34.106 1.00 0.00 N ATOM 1374 CA MET A 86 -1.363 -40.835 33.888 1.00 0.00 C ATOM 1375 C MET A 86 -2.073 -41.844 32.988 1.00 0.00 C ATOM 1376 O MET A 86 -3.254 -42.134 33.185 1.00 0.00 O ATOM 1377 CB MET A 86 -1.016 -41.485 35.230 1.00 0.00 C ATOM 1378 CG MET A 86 -0.104 -42.696 35.125 1.00 0.00 C ATOM 1379 SD MET A 86 0.295 -43.400 36.737 1.00 0.00 S ATOM 1380 CE MET A 86 -1.320 -43.988 37.258 1.00 0.00 C ATOM 0 H MET A 86 -3.209 -39.920 34.177 1.00 0.00 H new ATOM 0 HA MET A 86 -0.443 -40.510 33.402 1.00 0.00 H new ATOM 0 HB2 MET A 86 -0.539 -40.741 35.868 1.00 0.00 H new ATOM 0 HB3 MET A 86 -1.940 -41.783 35.725 1.00 0.00 H new ATOM 0 HG2 MET A 86 -0.584 -43.456 34.509 1.00 0.00 H new ATOM 0 HG3 MET A 86 0.818 -42.410 34.618 1.00 0.00 H new ATOM 0 HE1 MET A 86 -1.582 -43.533 38.213 1.00 0.00 H new ATOM 0 HE2 MET A 86 -2.065 -43.716 36.510 1.00 0.00 H new ATOM 0 HE3 MET A 86 -1.295 -45.072 37.368 1.00 0.00 H new ATOM 1390 N LEU A 87 -1.361 -42.360 32.006 1.00 0.00 N ATOM 1391 CA LEU A 87 -1.915 -43.345 31.090 1.00 0.00 C ATOM 1392 C LEU A 87 -1.415 -44.740 31.406 1.00 0.00 C ATOM 1393 O LEU A 87 -0.209 -44.968 31.547 1.00 0.00 O ATOM 1394 CB LEU A 87 -1.574 -42.987 29.642 1.00 0.00 C ATOM 1395 CG LEU A 87 -2.440 -41.913 28.990 1.00 0.00 C ATOM 1396 CD1 LEU A 87 -1.790 -41.423 27.708 1.00 0.00 C ATOM 1397 CD2 LEU A 87 -3.818 -42.481 28.688 1.00 0.00 C ATOM 0 H LEU A 87 -0.389 -42.113 31.819 1.00 0.00 H new ATOM 0 HA LEU A 87 -2.998 -43.334 31.215 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -0.536 -42.658 29.606 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -1.642 -43.893 29.040 1.00 0.00 H new ATOM 0 HG LEU A 87 -2.540 -41.072 29.676 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -2.417 -40.657 27.252 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -0.810 -41.002 27.935 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -1.675 -42.257 27.016 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -4.434 -41.712 28.222 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -3.721 -43.329 28.010 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -4.287 -42.810 29.615 1.00 0.00 H new ATOM 1409 N VAL A 88 -2.344 -45.668 31.522 1.00 0.00 N ATOM 1410 CA VAL A 88 -2.011 -47.055 31.766 1.00 0.00 C ATOM 1411 C VAL A 88 -2.588 -47.935 30.665 1.00 0.00 C ATOM 1412 O VAL A 88 -3.733 -47.748 30.232 1.00 0.00 O ATOM 1413 CB VAL A 88 -2.501 -47.556 33.152 1.00 0.00 C ATOM 1414 CG1 VAL A 88 -1.797 -46.803 34.271 1.00 0.00 C ATOM 1415 CG2 VAL A 88 -4.013 -47.423 33.283 1.00 0.00 C ATOM 0 H VAL A 88 -3.344 -45.483 31.450 1.00 0.00 H new ATOM 0 HA VAL A 88 -0.923 -47.123 31.765 1.00 0.00 H new ATOM 0 HB VAL A 88 -2.251 -48.614 33.235 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -2.153 -47.167 35.235 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -0.721 -46.964 34.197 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -2.012 -45.738 34.184 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -4.326 -47.782 34.264 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -4.297 -46.377 33.171 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -4.499 -48.016 32.508 1.00 0.00 H new ATOM 1425 N THR A 89 -1.788 -48.850 30.187 1.00 0.00 N ATOM 1426 CA THR A 89 -2.200 -49.742 29.137 1.00 0.00 C ATOM 1427 C THR A 89 -2.246 -51.174 29.689 1.00 0.00 C ATOM 1428 O THR A 89 -1.431 -51.539 30.537 1.00 0.00 O ATOM 1429 CB THR A 89 -1.204 -49.653 27.958 1.00 0.00 C ATOM 1430 OG1 THR A 89 -0.963 -48.275 27.645 1.00 0.00 O ATOM 1431 CG2 THR A 89 -1.724 -50.356 26.718 1.00 0.00 C ATOM 0 H THR A 89 -0.833 -48.998 30.514 1.00 0.00 H new ATOM 0 HA THR A 89 -3.190 -49.462 28.778 1.00 0.00 H new ATOM 0 HB THR A 89 -0.283 -50.148 28.265 1.00 0.00 H new ATOM 0 HG1 THR A 89 -0.331 -48.215 26.899 1.00 0.00 H new ATOM 0 HG21 THR A 89 -0.992 -50.268 25.916 1.00 0.00 H new ATOM 0 HG22 THR A 89 -1.893 -51.410 26.941 1.00 0.00 H new ATOM 0 HG23 THR A 89 -2.662 -49.896 26.406 1.00 0.00 H new ATOM 1439 N PRO A 90 -3.216 -51.984 29.253 1.00 0.00 N ATOM 1440 CA PRO A 90 -3.353 -53.377 29.703 1.00 0.00 C ATOM 1441 C PRO A 90 -2.200 -54.263 29.230 1.00 0.00 C ATOM 1442 O PRO A 90 -1.523 -53.952 28.236 1.00 0.00 O ATOM 1443 CB PRO A 90 -4.670 -53.813 29.050 1.00 0.00 C ATOM 1444 CG PRO A 90 -4.769 -52.955 27.846 1.00 0.00 C ATOM 1445 CD PRO A 90 -4.275 -51.621 28.295 1.00 0.00 C ATOM 0 HA PRO A 90 -3.341 -53.464 30.789 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -4.655 -54.871 28.787 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -5.517 -53.663 29.719 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -4.164 -53.347 27.028 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -5.795 -52.897 27.484 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -3.887 -51.031 27.465 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -5.063 -51.032 28.764 1.00 0.00 H new ATOM 1453 N LYS A 91 -1.958 -55.341 29.970 1.00 0.00 N ATOM 1454 CA LYS A 91 -0.942 -56.318 29.606 1.00 0.00 C ATOM 1455 C LYS A 91 -1.331 -56.966 28.276 1.00 0.00 C ATOM 1456 O LYS A 91 -2.476 -57.373 28.098 1.00 0.00 O ATOM 1457 CB LYS A 91 -0.841 -57.390 30.705 1.00 0.00 C ATOM 1458 CG LYS A 91 0.489 -57.432 31.468 1.00 0.00 C ATOM 1459 CD LYS A 91 0.791 -56.122 32.200 1.00 0.00 C ATOM 1460 CE LYS A 91 1.952 -56.302 33.180 1.00 0.00 C ATOM 1461 NZ LYS A 91 2.435 -55.014 33.754 1.00 0.00 N ATOM 0 H LYS A 91 -2.457 -55.559 30.832 1.00 0.00 H new ATOM 0 HA LYS A 91 0.026 -55.828 29.502 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -1.646 -57.227 31.422 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -1.011 -58.367 30.252 1.00 0.00 H new ATOM 0 HG2 LYS A 91 0.464 -58.249 32.189 1.00 0.00 H new ATOM 0 HG3 LYS A 91 1.297 -57.648 30.769 1.00 0.00 H new ATOM 0 HD2 LYS A 91 1.037 -55.344 31.477 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -0.096 -55.788 32.738 1.00 0.00 H new ATOM 0 HE2 LYS A 91 1.637 -56.959 33.991 1.00 0.00 H new ATOM 0 HE3 LYS A 91 2.777 -56.798 32.670 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 3.074 -55.207 34.552 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 2.946 -54.478 33.024 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 1.623 -54.456 34.088 1.00 0.00 H new ATOM 1475 N LYS A 92 -0.394 -57.046 27.343 1.00 0.00 N ATOM 1476 CA LYS A 92 -0.699 -57.591 26.025 1.00 0.00 C ATOM 1477 C LYS A 92 -0.473 -59.094 25.965 1.00 0.00 C ATOM 1478 O LYS A 92 -1.430 -59.875 25.913 1.00 0.00 O ATOM 1479 CB LYS A 92 0.116 -56.898 24.915 1.00 0.00 C ATOM 1480 CG LYS A 92 -0.050 -55.381 24.844 1.00 0.00 C ATOM 1481 CD LYS A 92 0.982 -54.661 25.697 1.00 0.00 C ATOM 1482 CE LYS A 92 0.865 -53.153 25.551 1.00 0.00 C ATOM 1483 NZ LYS A 92 1.915 -52.442 26.320 1.00 0.00 N ATOM 0 H LYS A 92 0.572 -56.745 27.469 1.00 0.00 H new ATOM 0 HA LYS A 92 -1.757 -57.394 25.853 1.00 0.00 H new ATOM 0 HB2 LYS A 92 1.171 -57.126 25.063 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -0.171 -57.325 23.954 1.00 0.00 H new ATOM 0 HG2 LYS A 92 0.041 -55.053 23.808 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -1.051 -55.109 25.177 1.00 0.00 H new ATOM 0 HD2 LYS A 92 0.850 -54.938 26.743 1.00 0.00 H new ATOM 0 HD3 LYS A 92 1.983 -54.980 25.407 1.00 0.00 H new ATOM 0 HE2 LYS A 92 0.940 -52.883 24.498 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -0.118 -52.830 25.894 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 1.468 -51.807 27.012 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 2.509 -53.135 26.818 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 2.504 -51.885 25.669 1.00 0.00 H new ATOM 1497 N ALA A 93 0.798 -59.490 25.991 1.00 0.00 N ATOM 1498 CA ALA A 93 1.197 -60.891 25.866 1.00 0.00 C ATOM 1499 C ALA A 93 0.678 -61.495 24.552 1.00 0.00 C ATOM 1500 O ALA A 93 1.300 -61.333 23.495 1.00 0.00 O ATOM 1501 CB ALA A 93 0.743 -61.709 27.077 1.00 0.00 C ATOM 0 H ALA A 93 1.582 -58.847 26.100 1.00 0.00 H new ATOM 0 HA ALA A 93 2.286 -60.928 25.840 1.00 0.00 H new ATOM 0 HB1 ALA A 93 1.055 -62.746 26.953 1.00 0.00 H new ATOM 0 HB2 ALA A 93 1.193 -61.300 27.982 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -0.343 -61.664 27.160 1.00 0.00 H new ATOM 1507 N GLU A 94 -0.462 -62.165 24.616 1.00 0.00 N ATOM 1508 CA GLU A 94 -1.082 -62.757 23.438 1.00 0.00 C ATOM 1509 C GLU A 94 -2.589 -62.577 23.477 1.00 0.00 C ATOM 1510 O GLU A 94 -3.308 -63.115 22.628 1.00 0.00 O ATOM 1511 CB GLU A 94 -0.754 -64.250 23.338 1.00 0.00 C ATOM 1512 CG GLU A 94 0.710 -64.557 23.064 1.00 0.00 C ATOM 1513 CD GLU A 94 0.977 -66.040 22.944 1.00 0.00 C ATOM 1514 OE1 GLU A 94 0.521 -66.652 21.951 1.00 0.00 O ATOM 1515 OE2 GLU A 94 1.637 -66.603 23.833 1.00 0.00 O ATOM 0 H GLU A 94 -0.982 -62.314 25.481 1.00 0.00 H new ATOM 0 HA GLU A 94 -0.681 -62.245 22.563 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -1.046 -64.736 24.269 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -1.359 -64.690 22.545 1.00 0.00 H new ATOM 0 HG2 GLU A 94 1.016 -64.060 22.143 1.00 0.00 H new ATOM 0 HG3 GLU A 94 1.321 -64.145 23.867 1.00 0.00 H new ATOM 1522 N GLY A 95 -3.068 -61.809 24.446 1.00 0.00 N ATOM 1523 CA GLY A 95 -4.496 -61.633 24.603 1.00 0.00 C ATOM 1524 C GLY A 95 -5.172 -62.933 24.998 1.00 0.00 C ATOM 1525 O GLY A 95 -5.014 -63.409 26.122 1.00 0.00 O ATOM 0 H GLY A 95 -2.495 -61.307 25.124 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -4.690 -60.875 25.362 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -4.924 -61.267 23.670 1.00 0.00 H new ATOM 1529 N HIS A 96 -5.912 -63.513 24.071 1.00 0.00 N ATOM 1530 CA HIS A 96 -6.584 -64.782 24.303 1.00 0.00 C ATOM 1531 C HIS A 96 -6.458 -65.681 23.093 1.00 0.00 C ATOM 1532 O HIS A 96 -6.402 -65.203 21.960 1.00 0.00 O ATOM 1533 CB HIS A 96 -8.065 -64.576 24.662 1.00 0.00 C ATOM 1534 CG HIS A 96 -8.280 -63.978 26.022 1.00 0.00 C ATOM 1535 ND1 HIS A 96 -8.557 -62.644 26.231 1.00 0.00 N ATOM 1536 CD2 HIS A 96 -8.248 -64.548 27.249 1.00 0.00 C ATOM 1537 CE1 HIS A 96 -8.683 -62.420 27.528 1.00 0.00 C ATOM 1538 NE2 HIS A 96 -8.501 -63.558 28.166 1.00 0.00 N ATOM 0 H HIS A 96 -6.065 -63.122 23.141 1.00 0.00 H new ATOM 0 HA HIS A 96 -6.096 -65.263 25.151 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -8.524 -63.930 23.914 1.00 0.00 H new ATOM 0 HB3 HIS A 96 -8.579 -65.536 24.612 1.00 0.00 H new ATOM 0 HD2 HIS A 96 -8.059 -65.589 27.467 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -8.899 -61.466 27.986 1.00 0.00 H new ATOM 0 HE2 HIS A 96 -8.541 -63.683 29.177 1.00 0.00 H new ATOM 1546 N HIS A 97 -6.385 -66.979 23.333 1.00 0.00 N ATOM 1547 CA HIS A 97 -6.285 -67.957 22.256 1.00 0.00 C ATOM 1548 C HIS A 97 -7.653 -68.562 21.965 1.00 0.00 C ATOM 1549 O HIS A 97 -7.829 -69.303 20.999 1.00 0.00 O ATOM 1550 CB HIS A 97 -5.290 -69.071 22.613 1.00 0.00 C ATOM 1551 CG HIS A 97 -3.877 -68.598 22.820 1.00 0.00 C ATOM 1552 ND1 HIS A 97 -3.314 -68.434 24.070 1.00 0.00 N ATOM 1553 CD2 HIS A 97 -2.910 -68.264 21.930 1.00 0.00 C ATOM 1554 CE1 HIS A 97 -2.064 -68.019 23.938 1.00 0.00 C ATOM 1555 NE2 HIS A 97 -1.797 -67.908 22.655 1.00 0.00 N ATOM 0 H HIS A 97 -6.393 -67.385 24.269 1.00 0.00 H new ATOM 0 HA HIS A 97 -5.922 -67.442 21.367 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -5.631 -69.569 23.521 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -5.298 -69.817 21.818 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -2.998 -68.275 20.854 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -1.380 -67.808 24.746 1.00 0.00 H new ATOM 0 HE2 HIS A 97 -0.906 -67.606 22.261 1.00 0.00 H new ATOM 1563 N HIS A 98 -8.619 -68.243 22.815 1.00 0.00 N ATOM 1564 CA HIS A 98 -9.978 -68.741 22.657 1.00 0.00 C ATOM 1565 C HIS A 98 -10.925 -67.592 22.347 1.00 0.00 C ATOM 1566 O HIS A 98 -10.728 -66.476 22.825 1.00 0.00 O ATOM 1567 CB HIS A 98 -10.447 -69.476 23.921 1.00 0.00 C ATOM 1568 CG HIS A 98 -9.676 -70.728 24.230 1.00 0.00 C ATOM 1569 ND1 HIS A 98 -9.698 -71.842 23.421 1.00 0.00 N ATOM 1570 CD2 HIS A 98 -8.863 -71.042 25.269 1.00 0.00 C ATOM 1571 CE1 HIS A 98 -8.937 -72.785 23.950 1.00 0.00 C ATOM 1572 NE2 HIS A 98 -8.420 -72.327 25.069 1.00 0.00 N ATOM 0 H HIS A 98 -8.485 -67.638 23.625 1.00 0.00 H new ATOM 0 HA HIS A 98 -9.984 -69.447 21.827 1.00 0.00 H new ATOM 0 HB2 HIS A 98 -10.371 -68.798 24.771 1.00 0.00 H new ATOM 0 HB3 HIS A 98 -11.501 -69.731 23.809 1.00 0.00 H new ATOM 0 HD2 HIS A 98 -8.610 -70.400 26.100 1.00 0.00 H new ATOM 0 HE1 HIS A 98 -8.768 -73.767 23.533 1.00 0.00 H new ATOM 0 HE2 HIS A 98 -7.793 -72.842 25.687 1.00 0.00 H new ATOM 1580 N HIS A 99 -11.945 -67.868 21.540 1.00 0.00 N ATOM 1581 CA HIS A 99 -12.920 -66.849 21.147 1.00 0.00 C ATOM 1582 C HIS A 99 -13.739 -66.380 22.348 1.00 0.00 C ATOM 1583 O HIS A 99 -13.972 -65.185 22.524 1.00 0.00 O ATOM 1584 CB HIS A 99 -13.847 -67.388 20.042 1.00 0.00 C ATOM 1585 CG HIS A 99 -14.852 -66.386 19.533 1.00 0.00 C ATOM 1586 ND1 HIS A 99 -16.212 -66.522 19.720 1.00 0.00 N ATOM 1587 CD2 HIS A 99 -14.687 -65.236 18.838 1.00 0.00 C ATOM 1588 CE1 HIS A 99 -16.835 -65.498 19.158 1.00 0.00 C ATOM 1589 NE2 HIS A 99 -15.934 -64.708 18.619 1.00 0.00 N ATOM 0 H HIS A 99 -12.120 -68.791 21.143 1.00 0.00 H new ATOM 0 HA HIS A 99 -12.372 -65.992 20.756 1.00 0.00 H new ATOM 0 HB2 HIS A 99 -13.236 -67.730 19.206 1.00 0.00 H new ATOM 0 HB3 HIS A 99 -14.380 -68.259 20.424 1.00 0.00 H new ATOM 0 HD2 HIS A 99 -13.747 -64.813 18.516 1.00 0.00 H new ATOM 0 HE1 HIS A 99 -17.903 -65.339 19.145 1.00 0.00 H new ATOM 0 HE2 HIS A 99 -16.130 -63.841 18.118 1.00 0.00 H new ATOM 1597 N HIS A 100 -14.177 -67.327 23.164 1.00 0.00 N ATOM 1598 CA HIS A 100 -14.961 -67.002 24.351 1.00 0.00 C ATOM 1599 C HIS A 100 -14.608 -67.916 25.519 1.00 0.00 C ATOM 1600 O HIS A 100 -14.660 -67.507 26.680 1.00 0.00 O ATOM 1601 CB HIS A 100 -16.478 -67.058 24.054 1.00 0.00 C ATOM 1602 CG HIS A 100 -16.978 -68.387 23.534 1.00 0.00 C ATOM 1603 ND1 HIS A 100 -17.098 -68.670 22.187 1.00 0.00 N ATOM 1604 CD2 HIS A 100 -17.400 -69.501 24.183 1.00 0.00 C ATOM 1605 CE1 HIS A 100 -17.570 -69.894 22.033 1.00 0.00 C ATOM 1606 NE2 HIS A 100 -17.760 -70.418 23.226 1.00 0.00 N ATOM 0 H HIS A 100 -14.005 -68.323 23.029 1.00 0.00 H new ATOM 0 HA HIS A 100 -14.709 -65.981 24.636 1.00 0.00 H new ATOM 0 HB2 HIS A 100 -17.021 -66.814 24.967 1.00 0.00 H new ATOM 0 HB3 HIS A 100 -16.719 -66.285 23.324 1.00 0.00 H new ATOM 0 HD1 HIS A 100 -16.859 -68.032 21.428 1.00 0.00 H new ATOM 0 HD2 HIS A 100 -17.445 -69.641 25.253 1.00 0.00 H new ATOM 0 HE1 HIS A 100 -17.767 -70.382 21.090 1.00 0.00 H new ATOM 1614 N HIS A 101 -14.246 -69.148 25.206 1.00 0.00 N ATOM 1615 CA HIS A 101 -13.918 -70.133 26.218 1.00 0.00 C ATOM 1616 C HIS A 101 -13.178 -71.290 25.576 1.00 0.00 C ATOM 1617 O HIS A 101 -12.102 -71.656 26.067 1.00 0.00 O ATOM 1618 CB HIS A 101 -15.194 -70.638 26.915 1.00 0.00 C ATOM 1619 CG HIS A 101 -14.940 -71.613 28.025 1.00 0.00 C ATOM 1620 ND1 HIS A 101 -14.620 -71.228 29.307 1.00 0.00 N ATOM 1621 CD2 HIS A 101 -14.970 -72.963 28.039 1.00 0.00 C ATOM 1622 CE1 HIS A 101 -14.464 -72.299 30.059 1.00 0.00 C ATOM 1623 NE2 HIS A 101 -14.672 -73.363 29.313 1.00 0.00 N ATOM 1624 OXT HIS A 101 -13.675 -71.810 24.562 1.00 0.00 O ATOM 0 H HIS A 101 -14.172 -69.491 24.248 1.00 0.00 H new ATOM 0 HA HIS A 101 -13.280 -69.670 26.970 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -15.739 -69.783 27.315 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -15.839 -71.109 26.173 1.00 0.00 H new ATOM 0 HD2 HIS A 101 -15.189 -73.607 27.200 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -14.209 -72.303 31.108 1.00 0.00 H new ATOM 0 HE2 HIS A 101 -14.620 -74.330 29.633 1.00 0.00 H new TER 1632 HIS A 101