USER MOD reduce.3.24.130724 H: found=0, std=0, add=828, rem=0, adj=18 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 72 ASN : amide:sc= 0.483 K(o=1.4,f=-7.7!) USER MOD Set 1.2: A 91 LYS NZ :NH3+ 154:sc= 0.885 (180deg=-0.879) USER MOD Set 2.1: A 19 GLN : amide:sc= -1.02 K(o=-1,f=-2.8) USER MOD Set 2.2: A 66 MET CE :methyl 146:sc=-0.00943 (180deg=-0.174) USER MOD Set 3.1: A 38 HIS : no HE2:sc= -2.5! C(o=-1.4!,f=-11!) USER MOD Set 3.2: A 89 THR OG1 : rot -82:sc= 1.07 USER MOD Set 4.1: A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.2: A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ -177:sc= 1.19 (180deg=1.09) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ 160:sc= 0.99 (180deg=0.71) USER MOD Single : A 20 ASN : amide:sc= 0 X(o=0,f=-0.014) USER MOD Single : A 23 ASN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : A 24 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ -146:sc= 0.39 (180deg=-0.178) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 HIS : no HD1:sc= -0.139 X(o=-0.14,f=0.026) USER MOD Single : A 35 GLN : amide:sc= 0 K(o=0,f=-0.81) USER MOD Single : A 37 LYS NZ :NH3+ -172:sc=-0.00584 (180deg=-0.0805) USER MOD Single : A 46 LYS NZ :NH3+ -168:sc= -0.0241 (180deg=-0.172) USER MOD Single : A 50 MET CE :methyl -160:sc= -0.136 (180deg=-0.568) USER MOD Single : A 52 THR OG1 : rot 46:sc= 0.29 USER MOD Single : A 62 LYS NZ :NH3+ 168:sc= -0.0337 (180deg=-0.197) USER MOD Single : A 65 THR OG1 : rot -16:sc= 0.189 USER MOD Single : A 69 ASN : amide:sc= -2.62! K(o=-2.6!,f=-2.1) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 ASN : amide:sc= -0.0643 K(o=-0.064,f=-1.5) USER MOD Single : A 85 ASN : amide:sc= -2.47! C(o=-2.5!,f=-4.5!) USER MOD Single : A 86 MET CE :methyl -155:sc= -0.0957 (180deg=-0.688) USER MOD Single : A 92 LYS NZ :NH3+ 161:sc= -0.0172 (180deg=-0.247) USER MOD Single : A 96 HIS : no HD1:sc= 0.842 K(o=0.84,f=-3.1!) USER MOD Single : A 97 HIS : no HD1:sc= -0.307 X(o=-0.31,f=-0.8) USER MOD Single : A 98 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 99 HIS : no HD1:sc= 0 X(o=0,f=-0.04) USER MOD Single : A 100 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 -14.979 -49.170 13.591 1.00 0.00 N ATOM 2 CA LYS A 4 -14.551 -49.561 14.918 1.00 0.00 C ATOM 3 C LYS A 4 -13.435 -48.651 15.390 1.00 0.00 C ATOM 4 O LYS A 4 -12.330 -48.667 14.845 1.00 0.00 O ATOM 5 CB LYS A 4 -14.117 -51.032 14.940 1.00 0.00 C ATOM 6 CG LYS A 4 -15.260 -51.999 14.665 1.00 0.00 C ATOM 7 CD LYS A 4 -14.801 -53.444 14.681 1.00 0.00 C ATOM 8 CE LYS A 4 -15.960 -54.382 14.388 1.00 0.00 C ATOM 9 NZ LYS A 4 -15.539 -55.801 14.371 1.00 0.00 N ATOM 0 HA LYS A 4 -15.392 -49.458 15.604 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -13.334 -51.184 14.197 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -13.682 -51.261 15.913 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -16.041 -51.859 15.413 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -15.702 -51.770 13.695 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -14.014 -53.589 13.941 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -14.371 -53.683 15.654 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -16.736 -54.244 15.141 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -16.400 -54.124 13.425 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -16.361 -56.405 14.167 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -14.817 -55.940 13.636 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -15.143 -56.057 15.298 1.00 0.00 H new ATOM 23 N VAL A 5 -13.737 -47.847 16.387 1.00 0.00 N ATOM 24 CA VAL A 5 -12.791 -46.896 16.932 1.00 0.00 C ATOM 25 C VAL A 5 -12.503 -47.244 18.381 1.00 0.00 C ATOM 26 O VAL A 5 -13.423 -47.581 19.136 1.00 0.00 O ATOM 27 CB VAL A 5 -13.337 -45.444 16.850 1.00 0.00 C ATOM 28 CG1 VAL A 5 -12.319 -44.444 17.385 1.00 0.00 C ATOM 29 CG2 VAL A 5 -13.735 -45.093 15.422 1.00 0.00 C ATOM 0 H VAL A 5 -14.649 -47.834 16.844 1.00 0.00 H new ATOM 0 HA VAL A 5 -11.876 -46.951 16.342 1.00 0.00 H new ATOM 0 HB VAL A 5 -14.227 -45.387 17.476 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -12.728 -43.436 17.315 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -12.096 -44.674 18.427 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -11.404 -44.506 16.796 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -14.114 -44.072 15.391 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -12.865 -45.177 14.771 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -14.511 -45.779 15.082 1.00 0.00 H new ATOM 39 N ILE A 6 -11.239 -47.197 18.765 1.00 0.00 N ATOM 40 CA ILE A 6 -10.850 -47.529 20.122 1.00 0.00 C ATOM 41 C ILE A 6 -11.313 -46.437 21.091 1.00 0.00 C ATOM 42 O ILE A 6 -10.724 -45.354 21.160 1.00 0.00 O ATOM 43 CB ILE A 6 -9.313 -47.708 20.249 1.00 0.00 C ATOM 44 CG1 ILE A 6 -8.821 -48.803 19.293 1.00 0.00 C ATOM 45 CG2 ILE A 6 -8.933 -48.055 21.688 1.00 0.00 C ATOM 46 CD1 ILE A 6 -7.311 -48.926 19.234 1.00 0.00 C ATOM 0 H ILE A 6 -10.466 -46.932 18.155 1.00 0.00 H new ATOM 0 HA ILE A 6 -11.330 -48.474 20.375 1.00 0.00 H new ATOM 0 HB ILE A 6 -8.833 -46.767 19.979 1.00 0.00 H new ATOM 0 HG12 ILE A 6 -9.243 -49.759 19.602 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -9.199 -48.596 18.292 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -7.852 -48.177 21.760 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -9.252 -47.252 22.352 1.00 0.00 H new ATOM 0 HG23 ILE A 6 -9.423 -48.984 21.980 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -7.037 -49.719 18.539 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -6.882 -47.983 18.895 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -6.926 -49.164 20.226 1.00 0.00 H new ATOM 58 N ASP A 7 -12.394 -46.718 21.805 1.00 0.00 N ATOM 59 CA ASP A 7 -12.927 -45.786 22.786 1.00 0.00 C ATOM 60 C ASP A 7 -12.122 -45.871 24.068 1.00 0.00 C ATOM 61 O ASP A 7 -11.845 -46.965 24.566 1.00 0.00 O ATOM 62 CB ASP A 7 -14.402 -46.076 23.068 1.00 0.00 C ATOM 63 CG ASP A 7 -15.010 -45.090 24.049 1.00 0.00 C ATOM 64 OD1 ASP A 7 -15.417 -43.988 23.618 1.00 0.00 O ATOM 65 OD2 ASP A 7 -15.098 -45.418 25.247 1.00 0.00 O ATOM 0 H ASP A 7 -12.920 -47.588 21.722 1.00 0.00 H new ATOM 0 HA ASP A 7 -12.851 -44.777 22.381 1.00 0.00 H new ATOM 0 HB2 ASP A 7 -14.961 -46.044 22.133 1.00 0.00 H new ATOM 0 HB3 ASP A 7 -14.501 -47.086 23.465 1.00 0.00 H new ATOM 70 N ILE A 8 -11.746 -44.728 24.592 1.00 0.00 N ATOM 71 CA ILE A 8 -10.929 -44.667 25.785 1.00 0.00 C ATOM 72 C ILE A 8 -11.678 -44.018 26.935 1.00 0.00 C ATOM 73 O ILE A 8 -12.303 -42.961 26.775 1.00 0.00 O ATOM 74 CB ILE A 8 -9.610 -43.914 25.506 1.00 0.00 C ATOM 75 CG1 ILE A 8 -8.798 -44.697 24.474 1.00 0.00 C ATOM 76 CG2 ILE A 8 -8.806 -43.701 26.790 1.00 0.00 C ATOM 77 CD1 ILE A 8 -7.556 -43.995 24.008 1.00 0.00 C ATOM 0 H ILE A 8 -11.995 -43.817 24.207 1.00 0.00 H new ATOM 0 HA ILE A 8 -10.690 -45.690 26.075 1.00 0.00 H new ATOM 0 HB ILE A 8 -9.843 -42.926 25.110 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -8.519 -45.660 24.902 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -9.431 -44.904 23.611 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -7.884 -43.168 26.558 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -9.395 -43.115 27.495 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -8.565 -44.667 27.233 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -7.038 -44.617 23.278 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -7.826 -43.045 23.548 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -6.900 -43.813 24.859 1.00 0.00 H new ATOM 89 N LYS A 9 -11.627 -44.659 28.091 1.00 0.00 N ATOM 90 CA LYS A 9 -12.314 -44.161 29.258 1.00 0.00 C ATOM 91 C LYS A 9 -11.416 -43.287 30.082 1.00 0.00 C ATOM 92 O LYS A 9 -10.189 -43.406 30.046 1.00 0.00 O ATOM 93 CB LYS A 9 -12.873 -45.287 30.131 1.00 0.00 C ATOM 94 CG LYS A 9 -14.100 -45.968 29.555 1.00 0.00 C ATOM 95 CD LYS A 9 -13.764 -46.685 28.280 1.00 0.00 C ATOM 96 CE LYS A 9 -14.923 -47.515 27.772 1.00 0.00 C ATOM 97 NZ LYS A 9 -16.057 -46.674 27.321 1.00 0.00 N ATOM 0 H LYS A 9 -11.114 -45.528 28.241 1.00 0.00 H new ATOM 0 HA LYS A 9 -13.154 -43.572 28.890 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -12.094 -46.034 30.284 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -13.123 -44.882 31.112 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -14.502 -46.676 30.280 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -14.877 -45.228 29.367 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -13.479 -45.958 27.520 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -12.901 -47.330 28.444 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -14.585 -48.141 26.946 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -15.261 -48.186 28.562 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -16.847 -47.284 27.029 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -16.364 -46.059 28.101 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -15.756 -46.088 26.516 1.00 0.00 H new ATOM 111 N GLU A 10 -12.030 -42.428 30.821 1.00 0.00 N ATOM 112 CA GLU A 10 -11.319 -41.503 31.670 1.00 0.00 C ATOM 113 C GLU A 10 -11.817 -41.617 33.084 1.00 0.00 C ATOM 114 O GLU A 10 -12.978 -41.319 33.366 1.00 0.00 O ATOM 115 CB GLU A 10 -11.507 -40.072 31.182 1.00 0.00 C ATOM 116 CG GLU A 10 -10.983 -39.835 29.791 1.00 0.00 C ATOM 117 CD GLU A 10 -11.110 -38.404 29.367 1.00 0.00 C ATOM 118 OE1 GLU A 10 -10.325 -37.568 29.851 1.00 0.00 O ATOM 119 OE2 GLU A 10 -11.963 -38.109 28.511 1.00 0.00 O ATOM 0 H GLU A 10 -13.045 -42.338 30.862 1.00 0.00 H new ATOM 0 HA GLU A 10 -10.258 -41.752 31.634 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -12.568 -39.825 31.208 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -11.004 -39.393 31.871 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -9.935 -40.133 29.745 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -11.525 -40.468 29.089 1.00 0.00 H new ATOM 126 N ILE A 11 -10.971 -42.063 33.966 1.00 0.00 N ATOM 127 CA ILE A 11 -11.331 -42.131 35.351 1.00 0.00 C ATOM 128 C ILE A 11 -10.722 -40.941 36.074 1.00 0.00 C ATOM 129 O ILE A 11 -9.502 -40.849 36.243 1.00 0.00 O ATOM 130 CB ILE A 11 -10.925 -43.490 36.004 1.00 0.00 C ATOM 131 CG1 ILE A 11 -11.784 -44.625 35.413 1.00 0.00 C ATOM 132 CG2 ILE A 11 -11.077 -43.438 37.525 1.00 0.00 C ATOM 133 CD1 ILE A 11 -11.407 -46.012 35.901 1.00 0.00 C ATOM 0 H ILE A 11 -10.027 -42.385 33.751 1.00 0.00 H new ATOM 0 HA ILE A 11 -12.417 -42.084 35.438 1.00 0.00 H new ATOM 0 HB ILE A 11 -9.875 -43.682 35.783 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -12.830 -44.438 35.657 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -11.701 -44.600 34.326 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -10.787 -44.398 37.953 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -10.437 -42.653 37.928 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -12.115 -43.226 37.780 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -12.060 -46.751 35.437 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -10.372 -46.223 35.633 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -11.518 -46.059 36.984 1.00 0.00 H new ATOM 145 N LYS A 12 -11.584 -40.011 36.457 1.00 0.00 N ATOM 146 CA LYS A 12 -11.152 -38.783 37.088 1.00 0.00 C ATOM 147 C LYS A 12 -10.986 -38.974 38.582 1.00 0.00 C ATOM 148 O LYS A 12 -11.756 -39.695 39.224 1.00 0.00 O ATOM 149 CB LYS A 12 -12.135 -37.655 36.779 1.00 0.00 C ATOM 150 CG LYS A 12 -11.656 -36.277 37.214 1.00 0.00 C ATOM 151 CD LYS A 12 -12.645 -35.199 36.799 1.00 0.00 C ATOM 152 CE LYS A 12 -12.699 -35.041 35.284 1.00 0.00 C ATOM 153 NZ LYS A 12 -13.714 -34.046 34.862 1.00 0.00 N ATOM 0 H LYS A 12 -12.594 -40.089 36.338 1.00 0.00 H new ATOM 0 HA LYS A 12 -10.179 -38.506 36.682 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -12.328 -37.639 35.706 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -13.084 -37.870 37.270 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -11.526 -36.258 38.296 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -10.681 -36.071 36.772 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -13.637 -35.450 37.175 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -12.362 -34.250 37.255 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -11.719 -34.736 34.917 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -12.925 -36.005 34.827 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -13.716 -33.971 33.825 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -14.654 -34.348 35.189 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -13.485 -33.120 35.276 1.00 0.00 H new ATOM 167 N LEU A 13 -9.979 -38.337 39.123 1.00 0.00 N ATOM 168 CA LEU A 13 -9.631 -38.480 40.516 1.00 0.00 C ATOM 169 C LEU A 13 -9.476 -37.117 41.174 1.00 0.00 C ATOM 170 O LEU A 13 -9.439 -36.085 40.494 1.00 0.00 O ATOM 171 CB LEU A 13 -8.322 -39.242 40.602 1.00 0.00 C ATOM 172 CG LEU A 13 -8.344 -40.646 40.011 1.00 0.00 C ATOM 173 CD1 LEU A 13 -6.937 -41.162 39.851 1.00 0.00 C ATOM 174 CD2 LEU A 13 -9.166 -41.588 40.883 1.00 0.00 C ATOM 0 H LEU A 13 -9.373 -37.700 38.607 1.00 0.00 H new ATOM 0 HA LEU A 13 -10.422 -39.019 41.037 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -7.550 -38.664 40.093 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -8.030 -39.312 41.650 1.00 0.00 H new ATOM 0 HG LEU A 13 -8.814 -40.601 39.029 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -6.964 -42.166 39.428 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -6.381 -40.502 39.185 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -6.447 -41.191 40.824 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -9.167 -42.584 40.441 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -8.730 -41.634 41.881 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -10.190 -41.220 40.951 1.00 0.00 H new ATOM 186 N SER A 14 -9.424 -37.107 42.490 1.00 0.00 N ATOM 187 CA SER A 14 -9.201 -35.894 43.243 1.00 0.00 C ATOM 188 C SER A 14 -8.253 -36.198 44.391 1.00 0.00 C ATOM 189 O SER A 14 -8.228 -37.313 44.879 1.00 0.00 O ATOM 190 CB SER A 14 -10.528 -35.341 43.762 1.00 0.00 C ATOM 191 OG SER A 14 -11.417 -35.083 42.682 1.00 0.00 O ATOM 0 H SER A 14 -9.535 -37.941 43.066 1.00 0.00 H new ATOM 0 HA SER A 14 -8.755 -35.135 42.600 1.00 0.00 H new ATOM 0 HB2 SER A 14 -10.981 -36.054 44.451 1.00 0.00 H new ATOM 0 HB3 SER A 14 -10.352 -34.423 44.323 1.00 0.00 H new ATOM 0 HG SER A 14 -12.262 -34.731 43.031 1.00 0.00 H new ATOM 197 N VAL A 15 -7.469 -35.220 44.803 1.00 0.00 N ATOM 198 CA VAL A 15 -6.518 -35.408 45.897 1.00 0.00 C ATOM 199 C VAL A 15 -7.246 -35.767 47.193 1.00 0.00 C ATOM 200 O VAL A 15 -6.851 -36.687 47.918 1.00 0.00 O ATOM 201 CB VAL A 15 -5.636 -34.144 46.093 1.00 0.00 C ATOM 202 CG1 VAL A 15 -4.799 -34.229 47.359 1.00 0.00 C ATOM 203 CG2 VAL A 15 -4.735 -33.961 44.894 1.00 0.00 C ATOM 0 H VAL A 15 -7.467 -34.283 44.400 1.00 0.00 H new ATOM 0 HA VAL A 15 -5.862 -36.238 45.633 1.00 0.00 H new ATOM 0 HB VAL A 15 -6.300 -33.286 46.193 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -4.197 -33.326 47.459 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -5.456 -34.325 48.224 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -4.143 -35.098 47.304 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -4.118 -33.074 45.035 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -4.094 -34.835 44.784 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -5.343 -33.842 43.997 1.00 0.00 H new ATOM 213 N LYS A 16 -8.321 -35.064 47.454 1.00 0.00 N ATOM 214 CA LYS A 16 -9.126 -35.297 48.631 1.00 0.00 C ATOM 215 C LYS A 16 -10.277 -36.259 48.321 1.00 0.00 C ATOM 216 O LYS A 16 -11.452 -35.879 48.310 1.00 0.00 O ATOM 217 CB LYS A 16 -9.632 -33.966 49.165 1.00 0.00 C ATOM 218 CG LYS A 16 -8.541 -33.144 49.831 1.00 0.00 C ATOM 219 CD LYS A 16 -9.014 -31.747 50.168 1.00 0.00 C ATOM 220 CE LYS A 16 -9.118 -30.899 48.910 1.00 0.00 C ATOM 221 NZ LYS A 16 -9.419 -29.483 49.214 1.00 0.00 N ATOM 0 H LYS A 16 -8.664 -34.312 46.856 1.00 0.00 H new ATOM 0 HA LYS A 16 -8.516 -35.769 49.401 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -10.064 -33.392 48.345 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -10.432 -34.148 49.883 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -8.213 -33.646 50.741 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -7.676 -33.085 49.170 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -9.985 -31.795 50.662 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -8.322 -31.282 50.870 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -8.182 -30.959 48.355 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -9.897 -31.304 48.264 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -9.153 -28.890 48.402 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -10.436 -29.377 49.402 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -8.880 -29.186 50.052 1.00 0.00 H new ATOM 235 N ILE A 17 -9.907 -37.497 48.056 1.00 0.00 N ATOM 236 CA ILE A 17 -10.846 -38.570 47.743 1.00 0.00 C ATOM 237 C ILE A 17 -10.750 -39.670 48.812 1.00 0.00 C ATOM 238 O ILE A 17 -9.692 -39.854 49.423 1.00 0.00 O ATOM 239 CB ILE A 17 -10.520 -39.169 46.349 1.00 0.00 C ATOM 240 CG1 ILE A 17 -11.542 -40.231 45.934 1.00 0.00 C ATOM 241 CG2 ILE A 17 -9.114 -39.753 46.338 1.00 0.00 C ATOM 242 CD1 ILE A 17 -11.365 -40.704 44.509 1.00 0.00 C ATOM 0 H ILE A 17 -8.932 -37.796 48.051 1.00 0.00 H new ATOM 0 HA ILE A 17 -11.858 -38.165 47.730 1.00 0.00 H new ATOM 0 HB ILE A 17 -10.574 -38.359 45.622 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -11.462 -41.085 46.606 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -12.547 -39.825 46.053 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -8.901 -40.169 45.353 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -8.392 -38.968 46.564 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -9.041 -40.540 47.088 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -12.120 -41.455 44.279 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -11.474 -39.859 43.829 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -10.373 -41.139 44.391 1.00 0.00 H new ATOM 254 N ALA A 18 -11.852 -40.363 49.065 1.00 0.00 N ATOM 255 CA ALA A 18 -11.864 -41.436 50.055 1.00 0.00 C ATOM 256 C ALA A 18 -11.040 -42.630 49.574 1.00 0.00 C ATOM 257 O ALA A 18 -11.065 -42.978 48.386 1.00 0.00 O ATOM 258 CB ALA A 18 -13.293 -41.862 50.367 1.00 0.00 C ATOM 0 H ALA A 18 -12.747 -40.204 48.602 1.00 0.00 H new ATOM 0 HA ALA A 18 -11.410 -41.057 50.971 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -13.281 -42.662 51.107 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -13.848 -41.011 50.762 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -13.774 -42.217 49.456 1.00 0.00 H new ATOM 264 N GLN A 19 -10.328 -43.271 50.499 1.00 0.00 N ATOM 265 CA GLN A 19 -9.467 -44.403 50.161 1.00 0.00 C ATOM 266 C GLN A 19 -10.274 -45.565 49.609 1.00 0.00 C ATOM 267 O GLN A 19 -9.846 -46.243 48.671 1.00 0.00 O ATOM 268 CB GLN A 19 -8.662 -44.862 51.374 1.00 0.00 C ATOM 269 CG GLN A 19 -7.688 -45.986 51.054 1.00 0.00 C ATOM 270 CD GLN A 19 -6.663 -45.568 50.018 1.00 0.00 C ATOM 271 OE1 GLN A 19 -6.272 -44.406 49.952 1.00 0.00 O ATOM 272 NE2 GLN A 19 -6.234 -46.500 49.199 1.00 0.00 N ATOM 0 H GLN A 19 -10.330 -43.026 51.489 1.00 0.00 H new ATOM 0 HA GLN A 19 -8.776 -44.063 49.389 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -8.109 -44.014 51.777 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -9.348 -45.195 52.153 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -7.177 -46.294 51.966 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -8.240 -46.852 50.689 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -6.583 -47.455 49.285 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -5.552 -46.269 48.476 1.00 0.00 H new ATOM 281 N ASN A 20 -11.443 -45.791 50.186 1.00 0.00 N ATOM 282 CA ASN A 20 -12.316 -46.867 49.737 1.00 0.00 C ATOM 283 C ASN A 20 -12.732 -46.636 48.289 1.00 0.00 C ATOM 284 O ASN A 20 -12.779 -47.568 47.496 1.00 0.00 O ATOM 285 CB ASN A 20 -13.553 -46.978 50.643 1.00 0.00 C ATOM 286 CG ASN A 20 -14.517 -48.071 50.201 1.00 0.00 C ATOM 287 OD1 ASN A 20 -15.453 -47.821 49.439 1.00 0.00 O ATOM 288 ND2 ASN A 20 -14.301 -49.283 50.673 1.00 0.00 N ATOM 0 H ASN A 20 -11.810 -45.245 50.966 1.00 0.00 H new ATOM 0 HA ASN A 20 -11.767 -47.807 49.797 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -13.231 -47.176 51.665 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -14.076 -46.022 50.653 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -14.919 -50.051 50.409 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -13.516 -49.453 51.302 1.00 0.00 H new ATOM 295 N ASP A 21 -13.010 -45.383 47.953 1.00 0.00 N ATOM 296 CA ASP A 21 -13.403 -45.020 46.596 1.00 0.00 C ATOM 297 C ASP A 21 -12.247 -45.248 45.607 1.00 0.00 C ATOM 298 O ASP A 21 -12.463 -45.708 44.492 1.00 0.00 O ATOM 299 CB ASP A 21 -13.906 -43.575 46.548 1.00 0.00 C ATOM 300 CG ASP A 21 -14.497 -43.190 45.202 1.00 0.00 C ATOM 301 OD1 ASP A 21 -15.293 -43.978 44.641 1.00 0.00 O ATOM 302 OD2 ASP A 21 -14.195 -42.091 44.714 1.00 0.00 O ATOM 0 H ASP A 21 -12.971 -44.598 48.603 1.00 0.00 H new ATOM 0 HA ASP A 21 -14.224 -45.669 46.292 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -14.660 -43.434 47.322 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -13.081 -42.902 46.781 1.00 0.00 H new ATOM 307 N ILE A 22 -11.012 -44.949 46.041 1.00 0.00 N ATOM 308 CA ILE A 22 -9.821 -45.181 45.202 1.00 0.00 C ATOM 309 C ILE A 22 -9.679 -46.675 44.922 1.00 0.00 C ATOM 310 O ILE A 22 -9.456 -47.107 43.784 1.00 0.00 O ATOM 311 CB ILE A 22 -8.522 -44.737 45.934 1.00 0.00 C ATOM 312 CG1 ILE A 22 -8.478 -43.233 46.153 1.00 0.00 C ATOM 313 CG2 ILE A 22 -7.289 -45.186 45.165 1.00 0.00 C ATOM 314 CD1 ILE A 22 -7.312 -42.801 47.030 1.00 0.00 C ATOM 0 H ILE A 22 -10.811 -44.550 46.958 1.00 0.00 H new ATOM 0 HA ILE A 22 -9.950 -44.607 44.285 1.00 0.00 H new ATOM 0 HB ILE A 22 -8.527 -45.217 46.912 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -8.407 -42.731 45.188 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -9.412 -42.909 46.612 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -6.392 -44.865 45.695 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -7.290 -46.273 45.079 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -7.300 -44.743 44.169 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -7.330 -41.718 47.152 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -7.395 -43.278 48.007 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -6.374 -43.097 46.560 1.00 0.00 H new ATOM 326 N ASN A 23 -9.847 -47.439 45.980 1.00 0.00 N ATOM 327 CA ASN A 23 -9.714 -48.886 45.968 1.00 0.00 C ATOM 328 C ASN A 23 -10.798 -49.520 45.101 1.00 0.00 C ATOM 329 O ASN A 23 -10.621 -50.598 44.534 1.00 0.00 O ATOM 330 CB ASN A 23 -9.810 -49.386 47.415 1.00 0.00 C ATOM 331 CG ASN A 23 -9.600 -50.871 47.573 1.00 0.00 C ATOM 332 OD1 ASN A 23 -8.875 -51.500 46.808 1.00 0.00 O ATOM 333 ND2 ASN A 23 -10.214 -51.437 48.591 1.00 0.00 N ATOM 0 H ASN A 23 -10.086 -47.064 46.898 1.00 0.00 H new ATOM 0 HA ASN A 23 -8.752 -49.169 45.541 1.00 0.00 H new ATOM 0 HB2 ASN A 23 -9.071 -48.860 48.019 1.00 0.00 H new ATOM 0 HB3 ASN A 23 -10.791 -49.125 47.813 1.00 0.00 H new ATOM 0 HD21 ASN A 23 -10.095 -52.435 48.767 1.00 0.00 H new ATOM 0 HD22 ASN A 23 -10.808 -50.878 49.203 1.00 0.00 H new ATOM 340 N TYR A 24 -11.915 -48.846 45.026 1.00 0.00 N ATOM 341 CA TYR A 24 -13.048 -49.310 44.270 1.00 0.00 C ATOM 342 C TYR A 24 -12.859 -49.043 42.764 1.00 0.00 C ATOM 343 O TYR A 24 -13.184 -49.889 41.925 1.00 0.00 O ATOM 344 CB TYR A 24 -14.311 -48.639 44.816 1.00 0.00 C ATOM 345 CG TYR A 24 -15.602 -49.194 44.300 1.00 0.00 C ATOM 346 CD1 TYR A 24 -16.090 -50.381 44.800 1.00 0.00 C ATOM 347 CD2 TYR A 24 -16.354 -48.515 43.351 1.00 0.00 C ATOM 348 CE1 TYR A 24 -17.287 -50.899 44.376 1.00 0.00 C ATOM 349 CE2 TYR A 24 -17.563 -49.030 42.910 1.00 0.00 C ATOM 350 CZ TYR A 24 -18.022 -50.227 43.432 1.00 0.00 C ATOM 351 OH TYR A 24 -19.232 -50.747 43.015 1.00 0.00 O ATOM 0 H TYR A 24 -12.065 -47.951 45.492 1.00 0.00 H new ATOM 0 HA TYR A 24 -13.146 -50.390 44.380 1.00 0.00 H new ATOM 0 HB2 TYR A 24 -14.307 -48.723 45.903 1.00 0.00 H new ATOM 0 HB3 TYR A 24 -14.270 -47.576 44.578 1.00 0.00 H new ATOM 0 HD1 TYR A 24 -15.517 -50.916 45.543 1.00 0.00 H new ATOM 0 HD2 TYR A 24 -15.994 -47.578 42.953 1.00 0.00 H new ATOM 0 HE1 TYR A 24 -17.649 -51.831 44.783 1.00 0.00 H new ATOM 0 HE2 TYR A 24 -18.141 -48.502 42.166 1.00 0.00 H new ATOM 0 HH TYR A 24 -19.630 -50.153 42.345 1.00 0.00 H new ATOM 361 N LYS A 25 -12.319 -47.869 42.433 1.00 0.00 N ATOM 362 CA LYS A 25 -12.139 -47.467 41.039 1.00 0.00 C ATOM 363 C LYS A 25 -11.134 -48.345 40.290 1.00 0.00 C ATOM 364 O LYS A 25 -11.341 -48.657 39.119 1.00 0.00 O ATOM 365 CB LYS A 25 -11.725 -46.008 40.932 1.00 0.00 C ATOM 366 CG LYS A 25 -12.728 -45.046 41.528 1.00 0.00 C ATOM 367 CD LYS A 25 -12.341 -43.615 41.243 1.00 0.00 C ATOM 368 CE LYS A 25 -13.193 -42.641 42.027 1.00 0.00 C ATOM 369 NZ LYS A 25 -14.645 -42.913 41.899 1.00 0.00 N ATOM 0 H LYS A 25 -11.999 -47.180 43.113 1.00 0.00 H new ATOM 0 HA LYS A 25 -13.111 -47.601 40.564 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -10.765 -45.874 41.432 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -11.575 -45.758 39.882 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -13.718 -45.247 41.118 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -12.791 -45.202 42.605 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -11.291 -43.465 41.494 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -12.446 -43.415 40.177 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -12.911 -42.685 43.079 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -12.987 -41.627 41.684 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -15.169 -42.015 41.919 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -14.829 -43.401 40.999 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -14.957 -43.514 42.689 1.00 0.00 H new ATOM 383 N VAL A 26 -10.045 -48.738 40.960 1.00 0.00 N ATOM 384 CA VAL A 26 -9.013 -49.558 40.309 1.00 0.00 C ATOM 385 C VAL A 26 -9.570 -50.879 39.802 1.00 0.00 C ATOM 386 O VAL A 26 -9.118 -51.393 38.778 1.00 0.00 O ATOM 387 CB VAL A 26 -7.787 -49.831 41.219 1.00 0.00 C ATOM 388 CG1 VAL A 26 -6.843 -48.642 41.235 1.00 0.00 C ATOM 389 CG2 VAL A 26 -8.219 -50.186 42.631 1.00 0.00 C ATOM 0 H VAL A 26 -9.855 -48.508 41.935 1.00 0.00 H new ATOM 0 HA VAL A 26 -8.674 -48.964 39.460 1.00 0.00 H new ATOM 0 HB VAL A 26 -7.253 -50.685 40.803 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -5.993 -48.861 41.881 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -6.489 -48.445 40.223 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -7.369 -47.765 41.613 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -7.338 -50.372 43.245 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -8.790 -49.360 43.055 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -8.840 -51.081 42.607 1.00 0.00 H new ATOM 399 N LYS A 27 -10.554 -51.422 40.503 1.00 0.00 N ATOM 400 CA LYS A 27 -11.187 -52.660 40.076 1.00 0.00 C ATOM 401 C LYS A 27 -11.882 -52.458 38.724 1.00 0.00 C ATOM 402 O LYS A 27 -11.793 -53.305 37.836 1.00 0.00 O ATOM 403 CB LYS A 27 -12.176 -53.161 41.134 1.00 0.00 C ATOM 404 CG LYS A 27 -12.791 -54.510 40.804 1.00 0.00 C ATOM 405 CD LYS A 27 -13.672 -55.012 41.931 1.00 0.00 C ATOM 406 CE LYS A 27 -14.270 -56.369 41.599 1.00 0.00 C ATOM 407 NZ LYS A 27 -15.065 -56.908 42.723 1.00 0.00 N ATOM 0 H LYS A 27 -10.930 -51.027 41.365 1.00 0.00 H new ATOM 0 HA LYS A 27 -10.417 -53.422 39.957 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -11.664 -53.230 42.094 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -12.973 -52.427 41.250 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -13.379 -54.429 39.890 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -11.999 -55.234 40.610 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -13.088 -55.084 42.848 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -14.472 -54.295 42.118 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -14.902 -56.281 40.716 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -13.471 -57.068 41.351 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -15.456 -57.834 42.458 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -14.456 -57.015 43.559 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -15.843 -56.254 42.943 1.00 0.00 H new ATOM 421 N HIS A 28 -12.557 -51.321 38.584 1.00 0.00 N ATOM 422 CA HIS A 28 -13.207 -50.954 37.329 1.00 0.00 C ATOM 423 C HIS A 28 -12.193 -50.655 36.245 1.00 0.00 C ATOM 424 O HIS A 28 -12.391 -51.014 35.088 1.00 0.00 O ATOM 425 CB HIS A 28 -14.127 -49.750 37.518 1.00 0.00 C ATOM 426 CG HIS A 28 -15.433 -50.081 38.148 1.00 0.00 C ATOM 427 ND1 HIS A 28 -15.649 -50.066 39.507 1.00 0.00 N ATOM 428 CD2 HIS A 28 -16.609 -50.436 37.588 1.00 0.00 C ATOM 429 CE1 HIS A 28 -16.902 -50.401 39.754 1.00 0.00 C ATOM 430 NE2 HIS A 28 -17.506 -50.630 38.606 1.00 0.00 N ATOM 0 H HIS A 28 -12.669 -50.634 39.329 1.00 0.00 H new ATOM 0 HA HIS A 28 -13.804 -51.811 37.017 1.00 0.00 H new ATOM 0 HB2 HIS A 28 -13.616 -49.008 38.132 1.00 0.00 H new ATOM 0 HB3 HIS A 28 -14.310 -49.289 36.547 1.00 0.00 H new ATOM 0 HD2 HIS A 28 -16.807 -50.547 36.532 1.00 0.00 H new ATOM 0 HE1 HIS A 28 -17.355 -50.475 40.732 1.00 0.00 H new ATOM 0 HE2 HIS A 28 -18.481 -50.906 38.493 1.00 0.00 H new ATOM 438 N ALA A 29 -11.102 -50.006 36.628 1.00 0.00 N ATOM 439 CA ALA A 29 -10.062 -49.623 35.682 1.00 0.00 C ATOM 440 C ALA A 29 -9.509 -50.837 34.947 1.00 0.00 C ATOM 441 O ALA A 29 -9.361 -50.813 33.733 1.00 0.00 O ATOM 442 CB ALA A 29 -8.942 -48.885 36.398 1.00 0.00 C ATOM 0 H ALA A 29 -10.913 -49.732 37.592 1.00 0.00 H new ATOM 0 HA ALA A 29 -10.509 -48.958 34.943 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -8.172 -48.605 35.679 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -9.341 -47.987 36.870 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -8.508 -49.533 37.160 1.00 0.00 H new ATOM 448 N LEU A 30 -9.255 -51.908 35.687 1.00 0.00 N ATOM 449 CA LEU A 30 -8.692 -53.126 35.114 1.00 0.00 C ATOM 450 C LEU A 30 -9.619 -53.744 34.075 1.00 0.00 C ATOM 451 O LEU A 30 -9.157 -54.305 33.077 1.00 0.00 O ATOM 452 CB LEU A 30 -8.363 -54.145 36.207 1.00 0.00 C ATOM 453 CG LEU A 30 -7.262 -53.732 37.184 1.00 0.00 C ATOM 454 CD1 LEU A 30 -7.043 -54.808 38.232 1.00 0.00 C ATOM 455 CD2 LEU A 30 -5.969 -53.441 36.440 1.00 0.00 C ATOM 0 H LEU A 30 -9.431 -51.959 36.690 1.00 0.00 H new ATOM 0 HA LEU A 30 -7.767 -52.845 34.610 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -9.271 -54.348 36.775 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -8.069 -55.080 35.731 1.00 0.00 H new ATOM 0 HG LEU A 30 -7.580 -52.821 37.691 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -6.255 -54.494 38.917 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -7.966 -54.967 38.789 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -6.750 -55.737 37.744 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -5.197 -53.149 37.152 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -5.649 -54.334 35.904 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -6.133 -52.631 35.729 1.00 0.00 H new ATOM 467 N GLU A 31 -10.922 -53.628 34.304 1.00 0.00 N ATOM 468 CA GLU A 31 -11.918 -54.201 33.409 1.00 0.00 C ATOM 469 C GLU A 31 -11.739 -53.688 31.977 1.00 0.00 C ATOM 470 O GLU A 31 -11.843 -54.456 31.016 1.00 0.00 O ATOM 471 CB GLU A 31 -13.322 -53.856 33.895 1.00 0.00 C ATOM 472 CG GLU A 31 -13.646 -54.383 35.279 1.00 0.00 C ATOM 473 CD GLU A 31 -15.055 -54.044 35.714 1.00 0.00 C ATOM 474 OE1 GLU A 31 -15.979 -54.150 34.880 1.00 0.00 O ATOM 475 OE2 GLU A 31 -15.254 -53.691 36.896 1.00 0.00 O ATOM 0 H GLU A 31 -11.314 -53.138 35.108 1.00 0.00 H new ATOM 0 HA GLU A 31 -11.782 -55.283 33.411 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -13.439 -52.772 33.894 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -14.048 -54.255 33.187 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -13.516 -55.465 35.292 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -12.938 -53.969 35.997 1.00 0.00 H new ATOM 482 N PHE A 32 -11.463 -52.393 31.840 1.00 0.00 N ATOM 483 CA PHE A 32 -11.291 -51.785 30.524 1.00 0.00 C ATOM 484 C PHE A 32 -10.024 -52.304 29.839 1.00 0.00 C ATOM 485 O PHE A 32 -9.998 -52.505 28.623 1.00 0.00 O ATOM 486 CB PHE A 32 -11.258 -50.261 30.625 1.00 0.00 C ATOM 487 CG PHE A 32 -12.486 -49.676 31.262 1.00 0.00 C ATOM 488 CD1 PHE A 32 -13.671 -49.572 30.557 1.00 0.00 C ATOM 489 CD2 PHE A 32 -12.458 -49.250 32.579 1.00 0.00 C ATOM 490 CE1 PHE A 32 -14.807 -49.049 31.153 1.00 0.00 C ATOM 491 CE2 PHE A 32 -13.587 -48.729 33.182 1.00 0.00 C ATOM 492 CZ PHE A 32 -14.763 -48.627 32.468 1.00 0.00 C ATOM 0 H PHE A 32 -11.354 -51.747 32.622 1.00 0.00 H new ATOM 0 HA PHE A 32 -12.149 -52.069 29.914 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -10.382 -49.962 31.201 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -11.141 -49.841 29.626 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -13.711 -49.902 29.530 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -11.540 -49.326 33.143 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -15.726 -48.971 30.591 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -13.549 -48.402 34.211 1.00 0.00 H new ATOM 0 HZ PHE A 32 -15.647 -48.218 32.936 1.00 0.00 H new ATOM 502 N LEU A 33 -8.975 -52.516 30.632 1.00 0.00 N ATOM 503 CA LEU A 33 -7.697 -53.031 30.123 1.00 0.00 C ATOM 504 C LEU A 33 -7.877 -54.419 29.554 1.00 0.00 C ATOM 505 O LEU A 33 -7.354 -54.749 28.496 1.00 0.00 O ATOM 506 CB LEU A 33 -6.648 -53.076 31.239 1.00 0.00 C ATOM 507 CG LEU A 33 -5.933 -51.765 31.556 1.00 0.00 C ATOM 508 CD1 LEU A 33 -6.902 -50.735 32.081 1.00 0.00 C ATOM 509 CD2 LEU A 33 -4.831 -52.008 32.558 1.00 0.00 C ATOM 0 H LEU A 33 -8.982 -52.339 31.636 1.00 0.00 H new ATOM 0 HA LEU A 33 -7.354 -52.358 29.337 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -7.133 -53.428 32.149 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -5.896 -53.818 30.971 1.00 0.00 H new ATOM 0 HG LEU A 33 -5.497 -51.379 30.635 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -6.367 -49.810 32.299 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -7.670 -50.542 31.331 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -7.370 -51.107 32.992 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -4.326 -51.068 32.779 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -5.256 -52.415 33.475 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -4.113 -52.717 32.145 1.00 0.00 H new ATOM 521 N GLU A 34 -8.632 -55.215 30.264 1.00 0.00 N ATOM 522 CA GLU A 34 -8.936 -56.577 29.872 1.00 0.00 C ATOM 523 C GLU A 34 -9.694 -56.609 28.538 1.00 0.00 C ATOM 524 O GLU A 34 -9.703 -57.621 27.835 1.00 0.00 O ATOM 525 CB GLU A 34 -9.765 -57.225 30.965 1.00 0.00 C ATOM 526 CG GLU A 34 -9.039 -57.316 32.298 1.00 0.00 C ATOM 527 CD GLU A 34 -7.847 -58.250 32.259 1.00 0.00 C ATOM 528 OE1 GLU A 34 -8.025 -59.439 31.910 1.00 0.00 O ATOM 529 OE2 GLU A 34 -6.732 -57.803 32.592 1.00 0.00 O ATOM 0 H GLU A 34 -9.063 -54.936 31.146 1.00 0.00 H new ATOM 0 HA GLU A 34 -8.005 -57.128 29.736 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -10.685 -56.656 31.099 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -10.053 -58.227 30.647 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -8.705 -56.321 32.592 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -9.736 -57.657 33.063 1.00 0.00 H new ATOM 536 N GLN A 35 -10.345 -55.494 28.214 1.00 0.00 N ATOM 537 CA GLN A 35 -11.065 -55.346 26.967 1.00 0.00 C ATOM 538 C GLN A 35 -10.136 -54.832 25.859 1.00 0.00 C ATOM 539 O GLN A 35 -10.533 -54.747 24.692 1.00 0.00 O ATOM 540 CB GLN A 35 -12.228 -54.382 27.153 1.00 0.00 C ATOM 541 CG GLN A 35 -13.279 -54.883 28.121 1.00 0.00 C ATOM 542 CD GLN A 35 -14.418 -53.900 28.316 1.00 0.00 C ATOM 543 OE1 GLN A 35 -14.707 -53.072 27.446 1.00 0.00 O ATOM 544 NE2 GLN A 35 -15.072 -53.980 29.456 1.00 0.00 N ATOM 0 H GLN A 35 -10.384 -54.671 28.815 1.00 0.00 H new ATOM 0 HA GLN A 35 -11.447 -56.323 26.672 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -11.844 -53.426 27.509 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -12.695 -54.198 26.186 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -13.680 -55.829 27.756 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -12.811 -55.085 29.085 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -14.804 -54.678 30.150 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -15.847 -53.344 29.645 1.00 0.00 H new ATOM 553 N GLY A 36 -8.904 -54.495 26.230 1.00 0.00 N ATOM 554 CA GLY A 36 -7.951 -53.991 25.268 1.00 0.00 C ATOM 555 C GLY A 36 -8.039 -52.490 25.093 1.00 0.00 C ATOM 556 O GLY A 36 -7.715 -51.968 24.033 1.00 0.00 O ATOM 0 H GLY A 36 -8.552 -54.564 27.185 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -6.943 -54.257 25.587 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -8.120 -54.476 24.306 1.00 0.00 H new ATOM 560 N LYS A 37 -8.482 -51.792 26.128 1.00 0.00 N ATOM 561 CA LYS A 37 -8.616 -50.351 26.047 1.00 0.00 C ATOM 562 C LYS A 37 -7.668 -49.653 27.009 1.00 0.00 C ATOM 563 O LYS A 37 -6.967 -50.294 27.793 1.00 0.00 O ATOM 564 CB LYS A 37 -10.043 -49.906 26.351 1.00 0.00 C ATOM 565 CG LYS A 37 -11.092 -50.471 25.421 1.00 0.00 C ATOM 566 CD LYS A 37 -12.449 -49.876 25.729 1.00 0.00 C ATOM 567 CE LYS A 37 -13.557 -50.568 24.948 1.00 0.00 C ATOM 568 NZ LYS A 37 -13.335 -50.511 23.484 1.00 0.00 N ATOM 0 H LYS A 37 -8.752 -52.198 27.024 1.00 0.00 H new ATOM 0 HA LYS A 37 -8.363 -50.071 25.024 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -10.289 -50.195 27.373 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -10.087 -48.818 26.308 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -10.822 -50.259 24.387 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -11.132 -51.555 25.524 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -12.649 -49.960 26.797 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -12.443 -48.813 25.488 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -13.624 -51.609 25.263 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -14.513 -50.101 25.187 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -14.176 -50.873 22.991 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -13.162 -49.526 23.197 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -12.510 -51.094 23.235 1.00 0.00 H new ATOM 582 N HIS A 38 -7.668 -48.340 26.947 1.00 0.00 N ATOM 583 CA HIS A 38 -6.856 -47.514 27.802 1.00 0.00 C ATOM 584 C HIS A 38 -7.710 -46.741 28.788 1.00 0.00 C ATOM 585 O HIS A 38 -8.850 -46.379 28.488 1.00 0.00 O ATOM 586 CB HIS A 38 -6.045 -46.518 26.962 1.00 0.00 C ATOM 587 CG HIS A 38 -4.696 -46.999 26.572 1.00 0.00 C ATOM 588 ND1 HIS A 38 -4.353 -47.405 25.298 1.00 0.00 N ATOM 589 CD2 HIS A 38 -3.581 -47.091 27.301 1.00 0.00 C ATOM 590 CE1 HIS A 38 -3.067 -47.725 25.282 1.00 0.00 C ATOM 591 NE2 HIS A 38 -2.585 -47.537 26.485 1.00 0.00 N ATOM 0 H HIS A 38 -8.242 -47.811 26.290 1.00 0.00 H new ATOM 0 HA HIS A 38 -6.183 -48.171 28.353 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -6.608 -46.281 26.059 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -5.938 -45.590 27.524 1.00 0.00 H new ATOM 0 HD1 HIS A 38 -4.986 -47.451 24.499 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -3.486 -46.854 28.350 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -2.513 -48.079 24.425 1.00 0.00 H new ATOM 599 N VAL A 39 -7.168 -46.515 29.967 1.00 0.00 N ATOM 600 CA VAL A 39 -7.799 -45.662 30.943 1.00 0.00 C ATOM 601 C VAL A 39 -6.914 -44.466 31.163 1.00 0.00 C ATOM 602 O VAL A 39 -5.719 -44.608 31.436 1.00 0.00 O ATOM 603 CB VAL A 39 -8.044 -46.370 32.314 1.00 0.00 C ATOM 604 CG1 VAL A 39 -8.384 -45.345 33.395 1.00 0.00 C ATOM 605 CG2 VAL A 39 -9.174 -47.373 32.208 1.00 0.00 C ATOM 0 H VAL A 39 -6.281 -46.917 30.271 1.00 0.00 H new ATOM 0 HA VAL A 39 -8.777 -45.381 30.553 1.00 0.00 H new ATOM 0 HB VAL A 39 -7.126 -46.892 32.585 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -8.551 -45.857 34.342 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -7.558 -44.643 33.503 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -9.286 -44.803 33.112 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -9.326 -47.853 33.175 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -10.089 -46.861 31.909 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -8.922 -48.128 31.463 1.00 0.00 H new ATOM 615 N ARG A 40 -7.480 -43.301 31.023 1.00 0.00 N ATOM 616 CA ARG A 40 -6.748 -42.093 31.249 1.00 0.00 C ATOM 617 C ARG A 40 -7.100 -41.535 32.613 1.00 0.00 C ATOM 618 O ARG A 40 -8.231 -41.099 32.848 1.00 0.00 O ATOM 619 CB ARG A 40 -7.027 -41.074 30.123 1.00 0.00 C ATOM 620 CG ARG A 40 -6.386 -39.717 30.347 1.00 0.00 C ATOM 621 CD ARG A 40 -6.459 -38.821 29.110 1.00 0.00 C ATOM 622 NE ARG A 40 -7.820 -38.494 28.661 1.00 0.00 N ATOM 623 CZ ARG A 40 -8.153 -38.300 27.366 1.00 0.00 C ATOM 624 NH1 ARG A 40 -7.258 -38.506 26.404 1.00 0.00 N ATOM 625 NH2 ARG A 40 -9.377 -37.907 27.039 1.00 0.00 N ATOM 0 H ARG A 40 -8.454 -43.165 30.751 1.00 0.00 H new ATOM 0 HA ARG A 40 -5.679 -42.305 31.234 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -6.667 -41.483 29.179 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -8.105 -40.944 30.024 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -6.880 -39.219 31.181 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -5.343 -39.854 30.630 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -5.929 -37.892 29.320 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -5.931 -39.312 28.293 1.00 0.00 H new ATOM 0 HE ARG A 40 -8.553 -38.409 29.365 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -6.315 -38.812 26.642 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -7.515 -38.358 25.428 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -10.074 -37.749 27.767 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -9.622 -37.762 26.059 1.00 0.00 H new ATOM 639 N PHE A 41 -6.135 -41.569 33.517 1.00 0.00 N ATOM 640 CA PHE A 41 -6.342 -41.076 34.858 1.00 0.00 C ATOM 641 C PHE A 41 -6.036 -39.607 34.901 1.00 0.00 C ATOM 642 O PHE A 41 -4.931 -39.183 34.555 1.00 0.00 O ATOM 643 CB PHE A 41 -5.453 -41.812 35.860 1.00 0.00 C ATOM 644 CG PHE A 41 -5.835 -43.246 36.107 1.00 0.00 C ATOM 645 CD1 PHE A 41 -6.856 -43.563 36.991 1.00 0.00 C ATOM 646 CD2 PHE A 41 -5.165 -44.274 35.469 1.00 0.00 C ATOM 647 CE1 PHE A 41 -7.201 -44.878 37.230 1.00 0.00 C ATOM 648 CE2 PHE A 41 -5.503 -45.591 35.709 1.00 0.00 C ATOM 649 CZ PHE A 41 -6.523 -45.892 36.589 1.00 0.00 C ATOM 0 H PHE A 41 -5.199 -41.935 33.340 1.00 0.00 H new ATOM 0 HA PHE A 41 -7.382 -41.250 35.132 1.00 0.00 H new ATOM 0 HB2 PHE A 41 -4.424 -41.781 35.502 1.00 0.00 H new ATOM 0 HB3 PHE A 41 -5.477 -41.276 36.809 1.00 0.00 H new ATOM 0 HD1 PHE A 41 -7.387 -42.771 37.498 1.00 0.00 H new ATOM 0 HD2 PHE A 41 -4.369 -44.044 34.776 1.00 0.00 H new ATOM 0 HE1 PHE A 41 -8.000 -45.112 37.918 1.00 0.00 H new ATOM 0 HE2 PHE A 41 -4.969 -46.385 35.208 1.00 0.00 H new ATOM 0 HZ PHE A 41 -6.790 -46.922 36.775 1.00 0.00 H new ATOM 659 N ARG A 42 -7.011 -38.828 35.296 1.00 0.00 N ATOM 660 CA ARG A 42 -6.857 -37.400 35.365 1.00 0.00 C ATOM 661 C ARG A 42 -7.367 -36.910 36.708 1.00 0.00 C ATOM 662 O ARG A 42 -8.531 -37.101 37.046 1.00 0.00 O ATOM 663 CB ARG A 42 -7.624 -36.748 34.202 1.00 0.00 C ATOM 664 CG ARG A 42 -7.124 -37.219 32.840 1.00 0.00 C ATOM 665 CD ARG A 42 -7.933 -36.656 31.685 1.00 0.00 C ATOM 666 NE ARG A 42 -7.786 -35.207 31.542 1.00 0.00 N ATOM 667 CZ ARG A 42 -8.518 -34.459 30.703 1.00 0.00 C ATOM 668 NH1 ARG A 42 -9.513 -35.008 30.006 1.00 0.00 N ATOM 669 NH2 ARG A 42 -8.258 -33.160 30.569 1.00 0.00 N ATOM 0 H ARG A 42 -7.931 -39.166 35.578 1.00 0.00 H new ATOM 0 HA ARG A 42 -5.806 -37.125 35.275 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -8.685 -36.978 34.296 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -7.526 -35.664 34.267 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -6.080 -36.928 32.722 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -7.157 -38.308 32.803 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -7.622 -37.141 30.760 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -8.986 -36.897 31.833 1.00 0.00 H new ATOM 0 HE ARG A 42 -7.085 -34.738 32.115 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -9.721 -36.001 30.109 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -10.067 -34.435 29.369 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -7.502 -32.733 31.104 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -8.815 -32.592 29.931 1.00 0.00 H new ATOM 683 N VAL A 43 -6.499 -36.287 37.472 1.00 0.00 N ATOM 684 CA VAL A 43 -6.853 -35.838 38.807 1.00 0.00 C ATOM 685 C VAL A 43 -6.908 -34.323 38.889 1.00 0.00 C ATOM 686 O VAL A 43 -6.002 -33.624 38.425 1.00 0.00 O ATOM 687 CB VAL A 43 -5.880 -36.399 39.895 1.00 0.00 C ATOM 688 CG1 VAL A 43 -4.446 -36.092 39.548 1.00 0.00 C ATOM 689 CG2 VAL A 43 -6.211 -35.833 41.267 1.00 0.00 C ATOM 0 H VAL A 43 -5.540 -36.077 37.195 1.00 0.00 H new ATOM 0 HA VAL A 43 -7.848 -36.234 39.010 1.00 0.00 H new ATOM 0 HB VAL A 43 -6.009 -37.481 39.923 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -3.791 -36.493 40.321 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -4.198 -36.548 38.589 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -4.311 -35.012 39.482 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -5.519 -36.240 42.005 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -6.120 -34.747 41.244 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -7.231 -36.106 41.537 1.00 0.00 H new ATOM 699 N PHE A 44 -7.984 -33.829 39.462 1.00 0.00 N ATOM 700 CA PHE A 44 -8.191 -32.410 39.633 1.00 0.00 C ATOM 701 C PHE A 44 -7.803 -32.005 41.042 1.00 0.00 C ATOM 702 O PHE A 44 -8.207 -32.649 42.019 1.00 0.00 O ATOM 703 CB PHE A 44 -9.661 -32.057 39.358 1.00 0.00 C ATOM 704 CG PHE A 44 -9.987 -30.593 39.502 1.00 0.00 C ATOM 705 CD1 PHE A 44 -9.677 -29.696 38.489 1.00 0.00 C ATOM 706 CD2 PHE A 44 -10.607 -30.117 40.647 1.00 0.00 C ATOM 707 CE1 PHE A 44 -9.979 -28.354 38.617 1.00 0.00 C ATOM 708 CE2 PHE A 44 -10.911 -28.774 40.780 1.00 0.00 C ATOM 709 CZ PHE A 44 -10.596 -27.891 39.764 1.00 0.00 C ATOM 0 H PHE A 44 -8.744 -34.405 39.824 1.00 0.00 H new ATOM 0 HA PHE A 44 -7.566 -31.866 38.925 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -9.916 -32.376 38.347 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -10.292 -32.626 40.040 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -9.194 -30.051 37.591 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -10.855 -30.802 41.444 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -9.733 -27.667 37.821 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -11.394 -28.416 41.677 1.00 0.00 H new ATOM 0 HZ PHE A 44 -10.831 -26.842 39.866 1.00 0.00 H new ATOM 719 N LEU A 45 -7.005 -30.963 41.150 1.00 0.00 N ATOM 720 CA LEU A 45 -6.593 -30.465 42.447 1.00 0.00 C ATOM 721 C LEU A 45 -7.608 -29.429 42.896 1.00 0.00 C ATOM 722 O LEU A 45 -7.838 -28.437 42.197 1.00 0.00 O ATOM 723 CB LEU A 45 -5.200 -29.833 42.351 1.00 0.00 C ATOM 724 CG LEU A 45 -4.123 -30.691 41.664 1.00 0.00 C ATOM 725 CD1 LEU A 45 -2.793 -29.977 41.650 1.00 0.00 C ATOM 726 CD2 LEU A 45 -3.988 -32.035 42.337 1.00 0.00 C ATOM 0 H LEU A 45 -6.629 -30.444 40.356 1.00 0.00 H new ATOM 0 HA LEU A 45 -6.545 -31.282 43.167 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -5.286 -28.890 41.811 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -4.860 -29.594 43.359 1.00 0.00 H new ATOM 0 HG LEU A 45 -4.439 -30.854 40.634 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -2.049 -30.604 41.159 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -2.890 -29.037 41.107 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -2.478 -29.774 42.674 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -3.220 -32.620 41.831 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -3.707 -31.893 43.380 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -4.939 -32.564 42.287 1.00 0.00 H new ATOM 738 N LYS A 46 -8.212 -29.642 44.046 1.00 0.00 N ATOM 739 CA LYS A 46 -9.283 -28.777 44.491 1.00 0.00 C ATOM 740 C LYS A 46 -8.839 -27.875 45.635 1.00 0.00 C ATOM 741 O LYS A 46 -8.556 -28.340 46.742 1.00 0.00 O ATOM 742 CB LYS A 46 -10.501 -29.620 44.893 1.00 0.00 C ATOM 743 CG LYS A 46 -11.729 -28.803 45.241 1.00 0.00 C ATOM 744 CD LYS A 46 -12.929 -29.696 45.513 1.00 0.00 C ATOM 745 CE LYS A 46 -14.171 -28.877 45.832 1.00 0.00 C ATOM 746 NZ LYS A 46 -13.995 -28.049 47.053 1.00 0.00 N ATOM 0 H LYS A 46 -7.981 -30.402 44.686 1.00 0.00 H new ATOM 0 HA LYS A 46 -9.563 -28.126 43.663 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -10.747 -30.297 44.075 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -10.235 -30.239 45.750 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -11.523 -28.190 46.118 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -11.959 -28.121 44.422 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -13.120 -30.326 44.644 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -12.707 -30.362 46.347 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -14.406 -28.230 44.986 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -15.021 -29.546 45.967 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -14.916 -27.668 47.350 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -13.600 -28.635 47.816 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -13.345 -27.263 46.849 1.00 0.00 H new ATOM 760 N GLY A 47 -8.804 -26.582 45.364 1.00 0.00 N ATOM 761 CA GLY A 47 -8.396 -25.622 46.360 1.00 0.00 C ATOM 762 C GLY A 47 -7.030 -25.061 46.059 1.00 0.00 C ATOM 763 O GLY A 47 -6.669 -24.884 44.897 1.00 0.00 O ATOM 0 H GLY A 47 -9.054 -26.178 44.461 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -9.122 -24.810 46.404 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -8.388 -26.096 47.342 1.00 0.00 H new ATOM 767 N ARG A 48 -6.252 -24.809 47.094 1.00 0.00 N ATOM 768 CA ARG A 48 -4.911 -24.268 46.919 1.00 0.00 C ATOM 769 C ARG A 48 -3.912 -25.374 46.615 1.00 0.00 C ATOM 770 O ARG A 48 -2.712 -25.135 46.510 1.00 0.00 O ATOM 771 CB ARG A 48 -4.478 -23.474 48.153 1.00 0.00 C ATOM 772 CG ARG A 48 -5.299 -22.217 48.376 1.00 0.00 C ATOM 773 CD ARG A 48 -4.828 -21.435 49.592 1.00 0.00 C ATOM 774 NE ARG A 48 -3.436 -20.992 49.449 1.00 0.00 N ATOM 775 CZ ARG A 48 -2.875 -20.006 50.155 1.00 0.00 C ATOM 776 NH1 ARG A 48 -3.610 -19.274 50.979 1.00 0.00 N ATOM 777 NH2 ARG A 48 -1.583 -19.744 50.018 1.00 0.00 N ATOM 0 H ARG A 48 -6.522 -24.969 48.065 1.00 0.00 H new ATOM 0 HA ARG A 48 -4.933 -23.589 46.067 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -4.557 -24.112 49.033 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -3.428 -23.200 48.051 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -5.238 -21.583 47.492 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -6.347 -22.487 48.503 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -5.472 -20.568 49.739 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -4.922 -22.056 50.483 1.00 0.00 H new ATOM 0 HE ARG A 48 -2.855 -21.471 48.761 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -4.608 -19.462 51.076 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -3.178 -18.522 51.516 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -1.016 -20.295 49.373 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -1.155 -18.991 50.557 1.00 0.00 H new ATOM 791 N GLU A 49 -4.428 -26.582 46.464 1.00 0.00 N ATOM 792 CA GLU A 49 -3.621 -27.746 46.139 1.00 0.00 C ATOM 793 C GLU A 49 -3.022 -27.597 44.747 1.00 0.00 C ATOM 794 O GLU A 49 -1.970 -28.153 44.450 1.00 0.00 O ATOM 795 CB GLU A 49 -4.484 -29.001 46.197 1.00 0.00 C ATOM 796 CG GLU A 49 -5.116 -29.226 47.550 1.00 0.00 C ATOM 797 CD GLU A 49 -5.961 -30.479 47.608 1.00 0.00 C ATOM 798 OE1 GLU A 49 -6.705 -30.752 46.640 1.00 0.00 O ATOM 799 OE2 GLU A 49 -5.902 -31.180 48.641 1.00 0.00 O ATOM 0 H GLU A 49 -5.423 -26.784 46.564 1.00 0.00 H new ATOM 0 HA GLU A 49 -2.812 -27.830 46.864 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -5.269 -28.930 45.444 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -3.873 -29.866 45.940 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -4.332 -29.288 48.305 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -5.735 -28.365 47.803 1.00 0.00 H new ATOM 806 N MET A 50 -3.701 -26.810 43.909 1.00 0.00 N ATOM 807 CA MET A 50 -3.299 -26.573 42.537 1.00 0.00 C ATOM 808 C MET A 50 -1.901 -25.951 42.462 1.00 0.00 C ATOM 809 O MET A 50 -1.209 -26.077 41.449 1.00 0.00 O ATOM 810 CB MET A 50 -4.329 -25.670 41.858 1.00 0.00 C ATOM 811 CG MET A 50 -4.178 -25.591 40.358 1.00 0.00 C ATOM 812 SD MET A 50 -5.494 -24.635 39.565 1.00 0.00 S ATOM 813 CE MET A 50 -6.919 -25.678 39.900 1.00 0.00 C ATOM 0 H MET A 50 -4.554 -26.318 44.175 1.00 0.00 H new ATOM 0 HA MET A 50 -3.255 -27.529 42.016 1.00 0.00 H new ATOM 0 HB2 MET A 50 -5.329 -26.034 42.094 1.00 0.00 H new ATOM 0 HB3 MET A 50 -4.249 -24.666 42.275 1.00 0.00 H new ATOM 0 HG2 MET A 50 -3.215 -25.141 40.118 1.00 0.00 H new ATOM 0 HG3 MET A 50 -4.170 -26.600 39.945 1.00 0.00 H new ATOM 0 HE1 MET A 50 -7.720 -25.435 39.202 1.00 0.00 H new ATOM 0 HE2 MET A 50 -6.639 -26.725 39.782 1.00 0.00 H new ATOM 0 HE3 MET A 50 -7.263 -25.507 40.920 1.00 0.00 H new ATOM 823 N ALA A 51 -1.497 -25.280 43.538 1.00 0.00 N ATOM 824 CA ALA A 51 -0.178 -24.661 43.619 1.00 0.00 C ATOM 825 C ALA A 51 0.935 -25.715 43.592 1.00 0.00 C ATOM 826 O ALA A 51 2.070 -25.425 43.199 1.00 0.00 O ATOM 827 CB ALA A 51 -0.070 -23.807 44.873 1.00 0.00 C ATOM 0 H ALA A 51 -2.070 -25.151 44.372 1.00 0.00 H new ATOM 0 HA ALA A 51 -0.054 -24.021 42.745 1.00 0.00 H new ATOM 0 HB1 ALA A 51 0.919 -23.352 44.919 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -0.828 -23.024 44.847 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -0.224 -24.432 45.753 1.00 0.00 H new ATOM 833 N THR A 52 0.607 -26.924 44.023 1.00 0.00 N ATOM 834 CA THR A 52 1.562 -28.017 44.046 1.00 0.00 C ATOM 835 C THR A 52 1.007 -29.236 43.311 1.00 0.00 C ATOM 836 O THR A 52 0.185 -29.984 43.842 1.00 0.00 O ATOM 837 CB THR A 52 1.952 -28.402 45.492 1.00 0.00 C ATOM 838 OG1 THR A 52 0.765 -28.606 46.280 1.00 0.00 O ATOM 839 CG2 THR A 52 2.806 -27.315 46.136 1.00 0.00 C ATOM 0 H THR A 52 -0.322 -27.172 44.364 1.00 0.00 H new ATOM 0 HA THR A 52 2.461 -27.673 43.534 1.00 0.00 H new ATOM 0 HB THR A 52 2.533 -29.323 45.453 1.00 0.00 H new ATOM 0 HG1 THR A 52 0.127 -29.153 45.775 1.00 0.00 H new ATOM 0 HG21 THR A 52 3.066 -27.611 47.152 1.00 0.00 H new ATOM 0 HG22 THR A 52 3.717 -27.176 45.554 1.00 0.00 H new ATOM 0 HG23 THR A 52 2.246 -26.380 46.163 1.00 0.00 H new ATOM 847 N PRO A 53 1.462 -29.440 42.075 1.00 0.00 N ATOM 848 CA PRO A 53 1.002 -30.537 41.214 1.00 0.00 C ATOM 849 C PRO A 53 1.463 -31.903 41.708 1.00 0.00 C ATOM 850 O PRO A 53 0.945 -32.940 41.284 1.00 0.00 O ATOM 851 CB PRO A 53 1.635 -30.217 39.865 1.00 0.00 C ATOM 852 CG PRO A 53 2.822 -29.379 40.187 1.00 0.00 C ATOM 853 CD PRO A 53 2.479 -28.610 41.418 1.00 0.00 C ATOM 0 HA PRO A 53 -0.086 -30.601 41.187 1.00 0.00 H new ATOM 0 HB2 PRO A 53 1.925 -31.127 39.339 1.00 0.00 H new ATOM 0 HB3 PRO A 53 0.938 -29.683 39.219 1.00 0.00 H new ATOM 0 HG2 PRO A 53 3.702 -30.001 40.351 1.00 0.00 H new ATOM 0 HG3 PRO A 53 3.056 -28.706 39.362 1.00 0.00 H new ATOM 0 HD2 PRO A 53 3.351 -28.466 42.056 1.00 0.00 H new ATOM 0 HD3 PRO A 53 2.093 -27.620 41.177 1.00 0.00 H new ATOM 861 N GLU A 54 2.433 -31.893 42.605 1.00 0.00 N ATOM 862 CA GLU A 54 2.982 -33.115 43.169 1.00 0.00 C ATOM 863 C GLU A 54 1.903 -33.898 43.927 1.00 0.00 C ATOM 864 O GLU A 54 1.978 -35.121 44.046 1.00 0.00 O ATOM 865 CB GLU A 54 4.154 -32.778 44.092 1.00 0.00 C ATOM 866 CG GLU A 54 4.892 -33.985 44.632 1.00 0.00 C ATOM 867 CD GLU A 54 6.056 -33.602 45.505 1.00 0.00 C ATOM 868 OE1 GLU A 54 6.992 -32.952 45.005 1.00 0.00 O ATOM 869 OE2 GLU A 54 6.036 -33.937 46.702 1.00 0.00 O ATOM 0 H GLU A 54 2.862 -31.040 42.963 1.00 0.00 H new ATOM 0 HA GLU A 54 3.343 -33.745 42.356 1.00 0.00 H new ATOM 0 HB2 GLU A 54 4.859 -32.149 43.549 1.00 0.00 H new ATOM 0 HB3 GLU A 54 3.783 -32.189 44.931 1.00 0.00 H new ATOM 0 HG2 GLU A 54 4.201 -34.604 45.204 1.00 0.00 H new ATOM 0 HG3 GLU A 54 5.250 -34.591 43.800 1.00 0.00 H new ATOM 876 N ALA A 55 0.887 -33.182 44.418 1.00 0.00 N ATOM 877 CA ALA A 55 -0.219 -33.815 45.134 1.00 0.00 C ATOM 878 C ALA A 55 -0.940 -34.804 44.219 1.00 0.00 C ATOM 879 O ALA A 55 -1.329 -35.896 44.643 1.00 0.00 O ATOM 880 CB ALA A 55 -1.189 -32.761 45.646 1.00 0.00 C ATOM 0 H ALA A 55 0.810 -32.169 44.332 1.00 0.00 H new ATOM 0 HA ALA A 55 0.182 -34.359 45.989 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -2.007 -33.247 46.177 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -0.667 -32.085 46.324 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -1.588 -32.195 44.805 1.00 0.00 H new ATOM 886 N GLY A 56 -1.099 -34.414 42.955 1.00 0.00 N ATOM 887 CA GLY A 56 -1.719 -35.284 41.975 1.00 0.00 C ATOM 888 C GLY A 56 -0.866 -36.490 41.687 1.00 0.00 C ATOM 889 O GLY A 56 -1.371 -37.600 41.533 1.00 0.00 O ATOM 0 H GLY A 56 -0.807 -33.506 42.594 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -2.695 -35.606 42.339 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -1.890 -34.730 41.052 1.00 0.00 H new ATOM 893 N VAL A 57 0.436 -36.269 41.637 1.00 0.00 N ATOM 894 CA VAL A 57 1.393 -37.326 41.364 1.00 0.00 C ATOM 895 C VAL A 57 1.359 -38.392 42.462 1.00 0.00 C ATOM 896 O VAL A 57 1.305 -39.589 42.173 1.00 0.00 O ATOM 897 CB VAL A 57 2.824 -36.753 41.237 1.00 0.00 C ATOM 898 CG1 VAL A 57 3.845 -37.861 41.057 1.00 0.00 C ATOM 899 CG2 VAL A 57 2.896 -35.768 40.083 1.00 0.00 C ATOM 0 H VAL A 57 0.859 -35.353 41.784 1.00 0.00 H new ATOM 0 HA VAL A 57 1.113 -37.788 40.418 1.00 0.00 H new ATOM 0 HB VAL A 57 3.062 -36.228 42.162 1.00 0.00 H new ATOM 0 HG11 VAL A 57 4.841 -37.427 40.971 1.00 0.00 H new ATOM 0 HG12 VAL A 57 3.813 -38.528 41.918 1.00 0.00 H new ATOM 0 HG13 VAL A 57 3.615 -38.424 40.153 1.00 0.00 H new ATOM 0 HG21 VAL A 57 3.909 -35.372 40.005 1.00 0.00 H new ATOM 0 HG22 VAL A 57 2.632 -36.275 39.155 1.00 0.00 H new ATOM 0 HG23 VAL A 57 2.199 -34.949 40.260 1.00 0.00 H new ATOM 909 N ALA A 58 1.351 -37.944 43.714 1.00 0.00 N ATOM 910 CA ALA A 58 1.347 -38.849 44.859 1.00 0.00 C ATOM 911 C ALA A 58 0.114 -39.745 44.849 1.00 0.00 C ATOM 912 O ALA A 58 0.202 -40.946 45.144 1.00 0.00 O ATOM 913 CB ALA A 58 1.425 -38.058 46.158 1.00 0.00 C ATOM 0 H ALA A 58 1.347 -36.955 43.962 1.00 0.00 H new ATOM 0 HA ALA A 58 2.225 -39.491 44.787 1.00 0.00 H new ATOM 0 HB1 ALA A 58 1.421 -38.746 47.004 1.00 0.00 H new ATOM 0 HB2 ALA A 58 2.343 -37.471 46.172 1.00 0.00 H new ATOM 0 HB3 ALA A 58 0.566 -37.390 46.230 1.00 0.00 H new ATOM 919 N LEU A 59 -1.028 -39.166 44.501 1.00 0.00 N ATOM 920 CA LEU A 59 -2.273 -39.919 44.419 1.00 0.00 C ATOM 921 C LEU A 59 -2.172 -40.994 43.337 1.00 0.00 C ATOM 922 O LEU A 59 -2.540 -42.153 43.551 1.00 0.00 O ATOM 923 CB LEU A 59 -3.432 -38.976 44.085 1.00 0.00 C ATOM 924 CG LEU A 59 -4.810 -39.632 43.947 1.00 0.00 C ATOM 925 CD1 LEU A 59 -5.327 -40.102 45.294 1.00 0.00 C ATOM 926 CD2 LEU A 59 -5.789 -38.680 43.302 1.00 0.00 C ATOM 0 H LEU A 59 -1.118 -38.176 44.271 1.00 0.00 H new ATOM 0 HA LEU A 59 -2.454 -40.395 45.383 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -3.490 -38.214 44.862 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -3.200 -38.463 43.152 1.00 0.00 H new ATOM 0 HG LEU A 59 -4.705 -40.506 43.304 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -6.306 -40.564 45.167 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -4.634 -40.831 45.716 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -5.412 -39.250 45.968 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -6.762 -39.164 43.213 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -5.884 -37.785 43.916 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -5.429 -38.404 42.311 1.00 0.00 H new ATOM 938 N LEU A 60 -1.651 -40.598 42.186 1.00 0.00 N ATOM 939 CA LEU A 60 -1.517 -41.489 41.050 1.00 0.00 C ATOM 940 C LEU A 60 -0.537 -42.628 41.331 1.00 0.00 C ATOM 941 O LEU A 60 -0.785 -43.769 40.946 1.00 0.00 O ATOM 942 CB LEU A 60 -1.106 -40.706 39.810 1.00 0.00 C ATOM 943 CG LEU A 60 -2.155 -39.716 39.283 1.00 0.00 C ATOM 944 CD1 LEU A 60 -1.584 -38.887 38.163 1.00 0.00 C ATOM 945 CD2 LEU A 60 -3.400 -40.440 38.806 1.00 0.00 C ATOM 0 H LEU A 60 -1.311 -39.652 42.016 1.00 0.00 H new ATOM 0 HA LEU A 60 -2.490 -41.945 40.868 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -0.192 -40.157 40.034 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -0.867 -41.414 39.016 1.00 0.00 H new ATOM 0 HG LEU A 60 -2.433 -39.058 40.106 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -2.342 -38.191 37.802 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -0.722 -38.328 38.527 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -1.274 -39.541 37.348 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -4.125 -39.714 38.439 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -3.136 -41.127 38.002 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -3.835 -41.000 39.634 1.00 0.00 H new ATOM 957 N GLU A 61 0.577 -42.315 42.003 1.00 0.00 N ATOM 958 CA GLU A 61 1.573 -43.338 42.349 1.00 0.00 C ATOM 959 C GLU A 61 0.962 -44.386 43.280 1.00 0.00 C ATOM 960 O GLU A 61 1.225 -45.588 43.147 1.00 0.00 O ATOM 961 CB GLU A 61 2.809 -42.711 43.017 1.00 0.00 C ATOM 962 CG GLU A 61 3.597 -41.760 42.128 1.00 0.00 C ATOM 963 CD GLU A 61 4.857 -41.237 42.803 1.00 0.00 C ATOM 964 OE1 GLU A 61 4.779 -40.230 43.542 1.00 0.00 O ATOM 965 OE2 GLU A 61 5.932 -41.847 42.610 1.00 0.00 O ATOM 0 H GLU A 61 0.811 -41.373 42.316 1.00 0.00 H new ATOM 0 HA GLU A 61 1.888 -43.818 41.422 1.00 0.00 H new ATOM 0 HB2 GLU A 61 2.489 -42.172 43.909 1.00 0.00 H new ATOM 0 HB3 GLU A 61 3.472 -43.511 43.348 1.00 0.00 H new ATOM 0 HG2 GLU A 61 3.869 -42.273 41.205 1.00 0.00 H new ATOM 0 HG3 GLU A 61 2.962 -40.919 41.850 1.00 0.00 H new ATOM 972 N LYS A 62 0.132 -43.921 44.209 1.00 0.00 N ATOM 973 CA LYS A 62 -0.534 -44.798 45.163 1.00 0.00 C ATOM 974 C LYS A 62 -1.452 -45.767 44.428 1.00 0.00 C ATOM 975 O LYS A 62 -1.505 -46.955 44.740 1.00 0.00 O ATOM 976 CB LYS A 62 -1.338 -43.959 46.167 1.00 0.00 C ATOM 977 CG LYS A 62 -1.968 -44.762 47.293 1.00 0.00 C ATOM 978 CD LYS A 62 -2.649 -43.851 48.303 1.00 0.00 C ATOM 979 CE LYS A 62 -3.271 -44.646 49.438 1.00 0.00 C ATOM 980 NZ LYS A 62 -2.268 -45.429 50.204 1.00 0.00 N ATOM 0 H LYS A 62 -0.096 -42.933 44.321 1.00 0.00 H new ATOM 0 HA LYS A 62 0.217 -45.373 45.705 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -0.681 -43.204 46.599 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -2.125 -43.428 45.631 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -2.696 -45.462 46.882 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -1.202 -45.356 47.793 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -1.922 -43.146 48.707 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -3.420 -43.264 47.804 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -3.787 -43.964 50.114 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -4.023 -45.323 49.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -2.702 -45.787 51.079 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -1.939 -46.230 49.628 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -1.460 -44.819 50.442 1.00 0.00 H new ATOM 994 N ILE A 63 -2.180 -45.237 43.468 1.00 0.00 N ATOM 995 CA ILE A 63 -3.080 -46.020 42.640 1.00 0.00 C ATOM 996 C ILE A 63 -2.317 -46.990 41.737 1.00 0.00 C ATOM 997 O ILE A 63 -2.689 -48.157 41.604 1.00 0.00 O ATOM 998 CB ILE A 63 -3.969 -45.093 41.794 1.00 0.00 C ATOM 999 CG1 ILE A 63 -4.908 -44.335 42.712 1.00 0.00 C ATOM 1000 CG2 ILE A 63 -4.754 -45.878 40.744 1.00 0.00 C ATOM 1001 CD1 ILE A 63 -5.676 -43.244 42.032 1.00 0.00 C ATOM 0 H ILE A 63 -2.166 -44.244 43.237 1.00 0.00 H new ATOM 0 HA ILE A 63 -3.710 -46.611 43.304 1.00 0.00 H new ATOM 0 HB ILE A 63 -3.334 -44.388 41.258 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -5.612 -45.039 43.156 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -4.331 -43.904 43.530 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -5.372 -45.193 40.164 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -4.059 -46.392 40.079 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -5.392 -46.611 41.239 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -6.324 -42.750 42.756 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -4.981 -42.517 41.612 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -6.282 -43.670 41.233 1.00 0.00 H new ATOM 1013 N TRP A 64 -1.242 -46.503 41.142 1.00 0.00 N ATOM 1014 CA TRP A 64 -0.434 -47.292 40.228 1.00 0.00 C ATOM 1015 C TRP A 64 0.063 -48.586 40.865 1.00 0.00 C ATOM 1016 O TRP A 64 0.039 -49.629 40.232 1.00 0.00 O ATOM 1017 CB TRP A 64 0.748 -46.473 39.680 1.00 0.00 C ATOM 1018 CG TRP A 64 1.760 -47.320 38.959 1.00 0.00 C ATOM 1019 CD1 TRP A 64 3.079 -47.470 39.271 1.00 0.00 C ATOM 1020 CD2 TRP A 64 1.523 -48.164 37.828 1.00 0.00 C ATOM 1021 NE1 TRP A 64 3.670 -48.346 38.395 1.00 0.00 N ATOM 1022 CE2 TRP A 64 2.743 -48.785 37.512 1.00 0.00 C ATOM 1023 CE3 TRP A 64 0.401 -48.454 37.054 1.00 0.00 C ATOM 1024 CZ2 TRP A 64 2.871 -49.675 36.465 1.00 0.00 C ATOM 1025 CZ3 TRP A 64 0.538 -49.341 36.012 1.00 0.00 C ATOM 1026 CH2 TRP A 64 1.764 -49.940 35.731 1.00 0.00 C ATOM 0 H TRP A 64 -0.905 -45.550 41.279 1.00 0.00 H new ATOM 0 HA TRP A 64 -1.082 -47.566 39.396 1.00 0.00 H new ATOM 0 HB2 TRP A 64 0.370 -45.709 39.001 1.00 0.00 H new ATOM 0 HB3 TRP A 64 1.237 -45.953 40.504 1.00 0.00 H new ATOM 0 HD1 TRP A 64 3.584 -46.973 40.086 1.00 0.00 H new ATOM 0 HE1 TRP A 64 4.652 -48.622 38.408 1.00 0.00 H new ATOM 0 HE3 TRP A 64 -0.552 -47.994 37.267 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 3.818 -50.142 36.239 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 -0.320 -49.577 35.401 1.00 0.00 H new ATOM 0 HH2 TRP A 64 1.834 -50.634 34.906 1.00 0.00 H new ATOM 1037 N THR A 65 0.483 -48.528 42.116 1.00 0.00 N ATOM 1038 CA THR A 65 0.993 -49.722 42.781 1.00 0.00 C ATOM 1039 C THR A 65 -0.099 -50.795 42.914 1.00 0.00 C ATOM 1040 O THR A 65 0.188 -51.989 42.933 1.00 0.00 O ATOM 1041 CB THR A 65 1.594 -49.399 44.166 1.00 0.00 C ATOM 1042 OG1 THR A 65 0.650 -48.663 44.952 1.00 0.00 O ATOM 1043 CG2 THR A 65 2.878 -48.591 44.024 1.00 0.00 C ATOM 0 H THR A 65 0.483 -47.683 42.688 1.00 0.00 H new ATOM 0 HA THR A 65 1.792 -50.114 42.152 1.00 0.00 H new ATOM 0 HB THR A 65 1.826 -50.341 44.664 1.00 0.00 H new ATOM 0 HG1 THR A 65 -0.051 -48.303 44.369 1.00 0.00 H new ATOM 0 HG21 THR A 65 3.283 -48.375 45.013 1.00 0.00 H new ATOM 0 HG22 THR A 65 3.607 -49.164 43.450 1.00 0.00 H new ATOM 0 HG23 THR A 65 2.664 -47.655 43.508 1.00 0.00 H new ATOM 1051 N MET A 66 -1.340 -50.354 43.004 1.00 0.00 N ATOM 1052 CA MET A 66 -2.477 -51.257 43.136 1.00 0.00 C ATOM 1053 C MET A 66 -2.697 -52.083 41.863 1.00 0.00 C ATOM 1054 O MET A 66 -2.983 -53.275 41.927 1.00 0.00 O ATOM 1055 CB MET A 66 -3.746 -50.458 43.427 1.00 0.00 C ATOM 1056 CG MET A 66 -3.713 -49.684 44.724 1.00 0.00 C ATOM 1057 SD MET A 66 -5.232 -48.758 45.007 1.00 0.00 S ATOM 1058 CE MET A 66 -4.758 -47.774 46.420 1.00 0.00 C ATOM 0 H MET A 66 -1.592 -49.366 42.988 1.00 0.00 H new ATOM 0 HA MET A 66 -2.258 -51.937 43.959 1.00 0.00 H new ATOM 0 HB2 MET A 66 -3.918 -49.761 42.607 1.00 0.00 H new ATOM 0 HB3 MET A 66 -4.595 -51.142 43.448 1.00 0.00 H new ATOM 0 HG2 MET A 66 -3.551 -50.374 45.552 1.00 0.00 H new ATOM 0 HG3 MET A 66 -2.868 -48.996 44.712 1.00 0.00 H new ATOM 0 HE1 MET A 66 -5.247 -46.801 46.367 1.00 0.00 H new ATOM 0 HE2 MET A 66 -5.060 -48.283 47.335 1.00 0.00 H new ATOM 0 HE3 MET A 66 -3.677 -47.637 46.421 1.00 0.00 H new ATOM 1068 N ILE A 67 -2.555 -51.434 40.710 1.00 0.00 N ATOM 1069 CA ILE A 67 -2.857 -52.070 39.424 1.00 0.00 C ATOM 1070 C ILE A 67 -1.615 -52.429 38.614 1.00 0.00 C ATOM 1071 O ILE A 67 -1.728 -53.010 37.544 1.00 0.00 O ATOM 1072 CB ILE A 67 -3.766 -51.169 38.561 1.00 0.00 C ATOM 1073 CG1 ILE A 67 -3.107 -49.794 38.327 1.00 0.00 C ATOM 1074 CG2 ILE A 67 -5.131 -51.016 39.205 1.00 0.00 C ATOM 1075 CD1 ILE A 67 -3.878 -48.903 37.372 1.00 0.00 C ATOM 0 H ILE A 67 -2.233 -50.469 40.637 1.00 0.00 H new ATOM 0 HA ILE A 67 -3.369 -52.999 39.677 1.00 0.00 H new ATOM 0 HB ILE A 67 -3.902 -51.646 37.590 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -3.004 -49.283 39.284 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -2.101 -49.945 37.937 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -5.758 -50.378 38.582 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -5.598 -51.996 39.305 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -5.020 -50.564 40.191 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -3.354 -47.954 37.257 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -3.959 -49.393 36.402 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -4.876 -48.721 37.770 1.00 0.00 H new ATOM 1087 N GLU A 68 -0.448 -52.110 39.132 1.00 0.00 N ATOM 1088 CA GLU A 68 0.821 -52.326 38.410 1.00 0.00 C ATOM 1089 C GLU A 68 1.011 -53.776 37.926 1.00 0.00 C ATOM 1090 O GLU A 68 1.635 -54.022 36.898 1.00 0.00 O ATOM 1091 CB GLU A 68 2.008 -51.937 39.281 1.00 0.00 C ATOM 1092 CG GLU A 68 2.158 -52.789 40.523 1.00 0.00 C ATOM 1093 CD GLU A 68 3.448 -52.525 41.249 1.00 0.00 C ATOM 1094 OE1 GLU A 68 4.492 -53.055 40.821 1.00 0.00 O ATOM 1095 OE2 GLU A 68 3.431 -51.786 42.250 1.00 0.00 O ATOM 0 H GLU A 68 -0.335 -51.696 40.057 1.00 0.00 H new ATOM 0 HA GLU A 68 0.770 -51.688 37.527 1.00 0.00 H new ATOM 0 HB2 GLU A 68 2.920 -52.010 38.689 1.00 0.00 H new ATOM 0 HB3 GLU A 68 1.903 -50.893 39.578 1.00 0.00 H new ATOM 0 HG2 GLU A 68 1.321 -52.598 41.194 1.00 0.00 H new ATOM 0 HG3 GLU A 68 2.110 -53.842 40.246 1.00 0.00 H new ATOM 1102 N ASN A 69 0.487 -54.723 38.669 1.00 0.00 N ATOM 1103 CA ASN A 69 0.648 -56.129 38.321 1.00 0.00 C ATOM 1104 C ASN A 69 -0.280 -56.550 37.183 1.00 0.00 C ATOM 1105 O ASN A 69 -0.087 -57.596 36.581 1.00 0.00 O ATOM 1106 CB ASN A 69 0.433 -57.016 39.545 1.00 0.00 C ATOM 1107 CG ASN A 69 -0.918 -56.813 40.188 1.00 0.00 C ATOM 1108 OD1 ASN A 69 -1.101 -55.903 40.999 1.00 0.00 O ATOM 1109 ND2 ASN A 69 -1.866 -57.657 39.848 1.00 0.00 N ATOM 0 H ASN A 69 -0.054 -54.554 39.517 1.00 0.00 H new ATOM 0 HA ASN A 69 1.671 -56.258 37.969 1.00 0.00 H new ATOM 0 HB2 ASN A 69 0.537 -58.061 39.253 1.00 0.00 H new ATOM 0 HB3 ASN A 69 1.213 -56.810 40.278 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -2.795 -57.573 40.260 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -1.672 -58.396 39.173 1.00 0.00 H new ATOM 1116 N GLU A 70 -1.273 -55.729 36.885 1.00 0.00 N ATOM 1117 CA GLU A 70 -2.224 -56.039 35.811 1.00 0.00 C ATOM 1118 C GLU A 70 -2.162 -54.995 34.701 1.00 0.00 C ATOM 1119 O GLU A 70 -2.637 -55.216 33.592 1.00 0.00 O ATOM 1120 CB GLU A 70 -3.646 -56.116 36.367 1.00 0.00 C ATOM 1121 CG GLU A 70 -3.850 -57.235 37.369 1.00 0.00 C ATOM 1122 CD GLU A 70 -3.646 -58.604 36.761 1.00 0.00 C ATOM 1123 OE1 GLU A 70 -4.440 -58.988 35.876 1.00 0.00 O ATOM 1124 OE2 GLU A 70 -2.688 -59.298 37.158 1.00 0.00 O ATOM 0 H GLU A 70 -1.448 -54.846 37.364 1.00 0.00 H new ATOM 0 HA GLU A 70 -1.948 -57.006 35.391 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -3.893 -55.166 36.841 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -4.343 -56.250 35.540 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -3.157 -57.104 38.200 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -4.857 -57.170 37.780 1.00 0.00 H new ATOM 1131 N ALA A 71 -1.549 -53.871 35.001 1.00 0.00 N ATOM 1132 CA ALA A 71 -1.470 -52.761 34.071 1.00 0.00 C ATOM 1133 C ALA A 71 -0.032 -52.362 33.833 1.00 0.00 C ATOM 1134 O ALA A 71 0.829 -52.634 34.657 1.00 0.00 O ATOM 1135 CB ALA A 71 -2.246 -51.575 34.622 1.00 0.00 C ATOM 0 H ALA A 71 -1.091 -53.699 35.896 1.00 0.00 H new ATOM 0 HA ALA A 71 -1.904 -53.074 33.121 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -2.185 -50.743 33.921 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -3.290 -51.856 34.761 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -1.820 -51.275 35.580 1.00 0.00 H new ATOM 1141 N ASN A 72 0.230 -51.751 32.700 1.00 0.00 N ATOM 1142 CA ASN A 72 1.558 -51.256 32.402 1.00 0.00 C ATOM 1143 C ASN A 72 1.506 -49.747 32.365 1.00 0.00 C ATOM 1144 O ASN A 72 0.559 -49.167 31.844 1.00 0.00 O ATOM 1145 CB ASN A 72 2.061 -51.776 31.061 1.00 0.00 C ATOM 1146 CG ASN A 72 2.074 -53.290 30.962 1.00 0.00 C ATOM 1147 OD1 ASN A 72 2.223 -53.996 31.965 1.00 0.00 O ATOM 1148 ND2 ASN A 72 1.935 -53.798 29.751 1.00 0.00 N ATOM 0 H ASN A 72 -0.459 -51.584 31.967 1.00 0.00 H new ATOM 0 HA ASN A 72 2.244 -51.605 33.174 1.00 0.00 H new ATOM 0 HB2 ASN A 72 1.433 -51.374 30.266 1.00 0.00 H new ATOM 0 HB3 ASN A 72 3.070 -51.401 30.891 1.00 0.00 H new ATOM 0 HD21 ASN A 72 1.948 -54.809 29.617 1.00 0.00 H new ATOM 0 HD22 ASN A 72 1.814 -53.179 28.949 1.00 0.00 H new ATOM 1155 N ARG A 73 2.499 -49.118 32.909 1.00 0.00 N ATOM 1156 CA ARG A 73 2.537 -47.689 32.972 1.00 0.00 C ATOM 1157 C ARG A 73 3.155 -47.133 31.708 1.00 0.00 C ATOM 1158 O ARG A 73 4.343 -47.323 31.450 1.00 0.00 O ATOM 1159 CB ARG A 73 3.318 -47.259 34.184 1.00 0.00 C ATOM 1160 CG ARG A 73 3.342 -45.784 34.385 1.00 0.00 C ATOM 1161 CD ARG A 73 4.102 -45.414 35.642 1.00 0.00 C ATOM 1162 NE ARG A 73 5.485 -45.889 35.589 1.00 0.00 N ATOM 1163 CZ ARG A 73 6.476 -45.255 34.971 1.00 0.00 C ATOM 1164 NH1 ARG A 73 6.231 -44.133 34.315 1.00 0.00 N ATOM 1165 NH2 ARG A 73 7.705 -45.755 34.995 1.00 0.00 N ATOM 0 H ARG A 73 3.308 -49.580 33.323 1.00 0.00 H new ATOM 0 HA ARG A 73 1.522 -47.300 33.055 1.00 0.00 H new ATOM 0 HB2 ARG A 73 2.890 -47.731 35.068 1.00 0.00 H new ATOM 0 HB3 ARG A 73 4.342 -47.622 34.094 1.00 0.00 H new ATOM 0 HG2 ARG A 73 3.805 -45.304 33.523 1.00 0.00 H new ATOM 0 HG3 ARG A 73 2.321 -45.407 34.450 1.00 0.00 H new ATOM 0 HD2 ARG A 73 4.092 -44.332 35.770 1.00 0.00 H new ATOM 0 HD3 ARG A 73 3.602 -45.842 36.511 1.00 0.00 H new ATOM 0 HE ARG A 73 5.704 -46.768 36.059 1.00 0.00 H new ATOM 0 HH11 ARG A 73 5.283 -43.757 34.284 1.00 0.00 H new ATOM 0 HH12 ARG A 73 6.990 -43.644 33.840 1.00 0.00 H new ATOM 0 HH21 ARG A 73 7.891 -46.628 35.489 1.00 0.00 H new ATOM 0 HH22 ARG A 73 8.464 -45.266 34.520 1.00 0.00 H new ATOM 1179 N ASP A 74 2.345 -46.456 30.918 1.00 0.00 N ATOM 1180 CA ASP A 74 2.796 -45.922 29.642 1.00 0.00 C ATOM 1181 C ASP A 74 3.756 -44.748 29.823 1.00 0.00 C ATOM 1182 O ASP A 74 4.721 -44.606 29.071 1.00 0.00 O ATOM 1183 CB ASP A 74 1.602 -45.530 28.769 1.00 0.00 C ATOM 1184 CG ASP A 74 2.001 -45.225 27.339 1.00 0.00 C ATOM 1185 OD1 ASP A 74 2.635 -46.094 26.689 1.00 0.00 O ATOM 1186 OD2 ASP A 74 1.666 -44.138 26.849 1.00 0.00 O ATOM 0 H ASP A 74 1.368 -46.261 31.136 1.00 0.00 H new ATOM 0 HA ASP A 74 3.350 -46.711 29.132 1.00 0.00 H new ATOM 0 HB2 ASP A 74 0.872 -46.339 28.774 1.00 0.00 H new ATOM 0 HB3 ASP A 74 1.113 -44.657 29.200 1.00 0.00 H new ATOM 1191 N LYS A 75 3.497 -43.919 30.826 1.00 0.00 N ATOM 1192 CA LYS A 75 4.343 -42.754 31.088 1.00 0.00 C ATOM 1193 C LYS A 75 4.123 -42.267 32.524 1.00 0.00 C ATOM 1194 O LYS A 75 3.129 -42.630 33.160 1.00 0.00 O ATOM 1195 CB LYS A 75 4.034 -41.631 30.076 1.00 0.00 C ATOM 1196 CG LYS A 75 5.011 -40.458 30.120 1.00 0.00 C ATOM 1197 CD LYS A 75 4.695 -39.436 29.040 1.00 0.00 C ATOM 1198 CE LYS A 75 5.683 -38.274 29.052 1.00 0.00 C ATOM 1199 NZ LYS A 75 5.405 -37.296 27.961 1.00 0.00 N ATOM 0 H LYS A 75 2.713 -44.027 31.470 1.00 0.00 H new ATOM 0 HA LYS A 75 5.389 -43.037 30.972 1.00 0.00 H new ATOM 0 HB2 LYS A 75 4.036 -42.053 29.071 1.00 0.00 H new ATOM 0 HB3 LYS A 75 3.027 -41.257 30.262 1.00 0.00 H new ATOM 0 HG2 LYS A 75 4.966 -39.981 31.099 1.00 0.00 H new ATOM 0 HG3 LYS A 75 6.029 -40.825 29.990 1.00 0.00 H new ATOM 0 HD2 LYS A 75 4.716 -39.921 28.064 1.00 0.00 H new ATOM 0 HD3 LYS A 75 3.684 -39.055 29.185 1.00 0.00 H new ATOM 0 HE2 LYS A 75 5.635 -37.766 30.015 1.00 0.00 H new ATOM 0 HE3 LYS A 75 6.697 -38.659 28.945 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 6.098 -36.522 28.004 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 5.476 -37.774 27.040 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 4.447 -36.909 28.077 1.00 0.00 H new ATOM 1213 N GLU A 76 5.063 -41.479 33.038 1.00 0.00 N ATOM 1214 CA GLU A 76 4.952 -40.935 34.391 1.00 0.00 C ATOM 1215 C GLU A 76 3.864 -39.876 34.450 1.00 0.00 C ATOM 1216 O GLU A 76 3.562 -39.239 33.442 1.00 0.00 O ATOM 1217 CB GLU A 76 6.281 -40.318 34.870 1.00 0.00 C ATOM 1218 CG GLU A 76 7.394 -41.320 35.125 1.00 0.00 C ATOM 1219 CD GLU A 76 8.214 -41.613 33.896 1.00 0.00 C ATOM 1220 OE1 GLU A 76 7.789 -42.451 33.074 1.00 0.00 O ATOM 1221 OE2 GLU A 76 9.287 -41.006 33.744 1.00 0.00 O ATOM 0 H GLU A 76 5.909 -41.202 32.540 1.00 0.00 H new ATOM 0 HA GLU A 76 4.698 -41.765 35.050 1.00 0.00 H new ATOM 0 HB2 GLU A 76 6.622 -39.600 34.124 1.00 0.00 H new ATOM 0 HB3 GLU A 76 6.096 -39.760 35.788 1.00 0.00 H new ATOM 0 HG2 GLU A 76 8.048 -40.937 35.909 1.00 0.00 H new ATOM 0 HG3 GLU A 76 6.961 -42.249 35.496 1.00 0.00 H new ATOM 1228 N PRO A 77 3.255 -39.681 35.629 1.00 0.00 N ATOM 1229 CA PRO A 77 2.229 -38.656 35.815 1.00 0.00 C ATOM 1230 C PRO A 77 2.782 -37.260 35.547 1.00 0.00 C ATOM 1231 O PRO A 77 3.909 -36.937 35.940 1.00 0.00 O ATOM 1232 CB PRO A 77 1.836 -38.803 37.291 1.00 0.00 C ATOM 1233 CG PRO A 77 2.975 -39.528 37.921 1.00 0.00 C ATOM 1234 CD PRO A 77 3.510 -40.437 36.864 1.00 0.00 C ATOM 0 HA PRO A 77 1.390 -38.779 35.131 1.00 0.00 H new ATOM 0 HB2 PRO A 77 1.681 -37.830 37.757 1.00 0.00 H new ATOM 0 HB3 PRO A 77 0.905 -39.360 37.398 1.00 0.00 H new ATOM 0 HG2 PRO A 77 3.741 -38.832 38.263 1.00 0.00 H new ATOM 0 HG3 PRO A 77 2.645 -40.093 38.793 1.00 0.00 H new ATOM 0 HD2 PRO A 77 4.572 -40.639 37.003 1.00 0.00 H new ATOM 0 HD3 PRO A 77 3.000 -41.400 36.862 1.00 0.00 H new ATOM 1242 N ASN A 78 1.990 -36.442 34.890 1.00 0.00 N ATOM 1243 CA ASN A 78 2.400 -35.092 34.542 1.00 0.00 C ATOM 1244 C ASN A 78 1.244 -34.125 34.721 1.00 0.00 C ATOM 1245 O ASN A 78 0.085 -34.495 34.538 1.00 0.00 O ATOM 1246 CB ASN A 78 2.903 -35.050 33.094 1.00 0.00 C ATOM 1247 CG ASN A 78 3.415 -33.680 32.683 1.00 0.00 C ATOM 1248 OD1 ASN A 78 3.967 -32.934 33.497 1.00 0.00 O ATOM 1249 ND2 ASN A 78 3.229 -33.337 31.425 1.00 0.00 N ATOM 0 H ASN A 78 1.049 -36.688 34.582 1.00 0.00 H new ATOM 0 HA ASN A 78 3.210 -34.793 35.206 1.00 0.00 H new ATOM 0 HB2 ASN A 78 3.701 -35.782 32.971 1.00 0.00 H new ATOM 0 HB3 ASN A 78 2.094 -35.345 32.426 1.00 0.00 H new ATOM 0 HD21 ASN A 78 3.546 -32.426 31.093 1.00 0.00 H new ATOM 0 HD22 ASN A 78 2.768 -33.982 30.783 1.00 0.00 H new ATOM 1256 N PHE A 79 1.561 -32.899 35.074 1.00 0.00 N ATOM 1257 CA PHE A 79 0.556 -31.886 35.290 1.00 0.00 C ATOM 1258 C PHE A 79 0.304 -31.113 34.001 1.00 0.00 C ATOM 1259 O PHE A 79 1.138 -30.323 33.557 1.00 0.00 O ATOM 1260 CB PHE A 79 1.003 -30.958 36.429 1.00 0.00 C ATOM 1261 CG PHE A 79 0.052 -29.836 36.763 1.00 0.00 C ATOM 1262 CD1 PHE A 79 -1.094 -30.077 37.503 1.00 0.00 C ATOM 1263 CD2 PHE A 79 0.331 -28.535 36.381 1.00 0.00 C ATOM 1264 CE1 PHE A 79 -1.948 -29.048 37.849 1.00 0.00 C ATOM 1265 CE2 PHE A 79 -0.522 -27.500 36.717 1.00 0.00 C ATOM 1266 CZ PHE A 79 -1.662 -27.757 37.452 1.00 0.00 C ATOM 0 H PHE A 79 2.519 -32.579 35.218 1.00 0.00 H new ATOM 0 HA PHE A 79 -0.384 -32.355 35.580 1.00 0.00 H new ATOM 0 HB2 PHE A 79 1.157 -31.559 37.325 1.00 0.00 H new ATOM 0 HB3 PHE A 79 1.968 -30.526 36.165 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -1.323 -31.085 37.814 1.00 0.00 H new ATOM 0 HD2 PHE A 79 1.226 -28.326 35.814 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -2.836 -29.253 38.428 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -0.297 -26.491 36.405 1.00 0.00 H new ATOM 0 HZ PHE A 79 -2.329 -26.950 37.716 1.00 0.00 H new ATOM 1276 N GLU A 80 -0.842 -31.361 33.404 1.00 0.00 N ATOM 1277 CA GLU A 80 -1.221 -30.719 32.164 1.00 0.00 C ATOM 1278 C GLU A 80 -2.426 -29.836 32.400 1.00 0.00 C ATOM 1279 O GLU A 80 -3.510 -30.320 32.752 1.00 0.00 O ATOM 1280 CB GLU A 80 -1.518 -31.768 31.080 1.00 0.00 C ATOM 1281 CG GLU A 80 -1.918 -31.172 29.740 1.00 0.00 C ATOM 1282 CD GLU A 80 -2.153 -32.223 28.678 1.00 0.00 C ATOM 1283 OE1 GLU A 80 -3.219 -32.870 28.694 1.00 0.00 O ATOM 1284 OE2 GLU A 80 -1.279 -32.395 27.804 1.00 0.00 O ATOM 0 H GLU A 80 -1.538 -32.014 33.765 1.00 0.00 H new ATOM 0 HA GLU A 80 -0.393 -30.102 31.814 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -0.635 -32.392 30.940 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -2.318 -32.421 31.429 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -2.825 -30.581 29.867 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -1.137 -30.490 29.403 1.00 0.00 H new ATOM 1291 N GLY A 81 -2.241 -28.546 32.215 1.00 0.00 N ATOM 1292 CA GLY A 81 -3.308 -27.615 32.467 1.00 0.00 C ATOM 1293 C GLY A 81 -3.553 -27.465 33.946 1.00 0.00 C ATOM 1294 O GLY A 81 -2.779 -26.817 34.643 1.00 0.00 O ATOM 0 H GLY A 81 -1.369 -28.126 31.894 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -3.059 -26.645 32.035 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -4.219 -27.958 31.976 1.00 0.00 H new ATOM 1298 N ARG A 82 -4.624 -28.066 34.428 1.00 0.00 N ATOM 1299 CA ARG A 82 -4.949 -28.027 35.843 1.00 0.00 C ATOM 1300 C ARG A 82 -5.175 -29.442 36.375 1.00 0.00 C ATOM 1301 O ARG A 82 -5.640 -29.631 37.499 1.00 0.00 O ATOM 1302 CB ARG A 82 -6.179 -27.149 36.081 1.00 0.00 C ATOM 1303 CG ARG A 82 -5.949 -25.693 35.696 1.00 0.00 C ATOM 1304 CD ARG A 82 -7.180 -24.837 35.923 1.00 0.00 C ATOM 1305 NE ARG A 82 -6.965 -23.461 35.464 1.00 0.00 N ATOM 1306 CZ ARG A 82 -6.894 -22.383 36.255 1.00 0.00 C ATOM 1307 NH1 ARG A 82 -7.030 -22.501 37.573 1.00 0.00 N ATOM 1308 NH2 ARG A 82 -6.680 -21.185 35.719 1.00 0.00 N ATOM 0 H ARG A 82 -5.288 -28.590 33.858 1.00 0.00 H new ATOM 0 HA ARG A 82 -4.110 -27.591 36.385 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -7.018 -27.543 35.507 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -6.459 -27.202 37.133 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -5.118 -25.293 36.277 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -5.659 -25.638 34.647 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -8.029 -25.270 35.395 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -7.433 -24.834 36.983 1.00 0.00 H new ATOM 0 HE ARG A 82 -6.861 -23.313 34.460 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -7.190 -23.418 37.989 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -6.974 -21.674 38.168 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -6.571 -21.090 34.709 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -6.625 -20.361 36.318 1.00 0.00 H new ATOM 1322 N TYR A 83 -4.832 -30.431 35.556 1.00 0.00 N ATOM 1323 CA TYR A 83 -4.993 -31.836 35.919 1.00 0.00 C ATOM 1324 C TYR A 83 -3.667 -32.573 35.872 1.00 0.00 C ATOM 1325 O TYR A 83 -2.812 -32.279 35.041 1.00 0.00 O ATOM 1326 CB TYR A 83 -5.968 -32.550 34.965 1.00 0.00 C ATOM 1327 CG TYR A 83 -7.418 -32.136 35.070 1.00 0.00 C ATOM 1328 CD1 TYR A 83 -7.891 -31.007 34.424 1.00 0.00 C ATOM 1329 CD2 TYR A 83 -8.321 -32.904 35.794 1.00 0.00 C ATOM 1330 CE1 TYR A 83 -9.222 -30.648 34.496 1.00 0.00 C ATOM 1331 CE2 TYR A 83 -9.651 -32.552 35.874 1.00 0.00 C ATOM 1332 CZ TYR A 83 -10.097 -31.423 35.224 1.00 0.00 C ATOM 1333 OH TYR A 83 -11.428 -31.074 35.294 1.00 0.00 O ATOM 0 H TYR A 83 -4.437 -30.284 34.627 1.00 0.00 H new ATOM 0 HA TYR A 83 -5.389 -31.851 36.934 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -5.635 -32.379 33.941 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -5.903 -33.623 35.146 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -7.207 -30.396 33.854 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -7.975 -33.792 36.303 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -9.575 -29.765 33.984 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -10.340 -33.158 36.443 1.00 0.00 H new ATOM 0 HH TYR A 83 -11.909 -31.726 35.846 1.00 0.00 H new ATOM 1343 N VAL A 84 -3.500 -33.516 36.768 1.00 0.00 N ATOM 1344 CA VAL A 84 -2.350 -34.399 36.727 1.00 0.00 C ATOM 1345 C VAL A 84 -2.795 -35.683 36.036 1.00 0.00 C ATOM 1346 O VAL A 84 -3.720 -36.358 36.496 1.00 0.00 O ATOM 1347 CB VAL A 84 -1.790 -34.697 38.145 1.00 0.00 C ATOM 1348 CG1 VAL A 84 -0.628 -35.663 38.089 1.00 0.00 C ATOM 1349 CG2 VAL A 84 -1.351 -33.416 38.819 1.00 0.00 C ATOM 0 H VAL A 84 -4.145 -33.695 37.538 1.00 0.00 H new ATOM 0 HA VAL A 84 -1.537 -33.922 36.180 1.00 0.00 H new ATOM 0 HB VAL A 84 -2.591 -35.156 38.724 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -0.261 -35.849 39.098 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -0.957 -36.602 37.643 1.00 0.00 H new ATOM 0 HG13 VAL A 84 0.172 -35.235 37.485 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -0.961 -33.642 39.811 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -0.572 -32.940 38.223 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -2.203 -32.742 38.909 1.00 0.00 H new ATOM 1359 N ASN A 85 -2.167 -35.991 34.926 1.00 0.00 N ATOM 1360 CA ASN A 85 -2.604 -37.088 34.079 1.00 0.00 C ATOM 1361 C ASN A 85 -1.617 -38.247 34.089 1.00 0.00 C ATOM 1362 O ASN A 85 -0.402 -38.042 34.161 1.00 0.00 O ATOM 1363 CB ASN A 85 -2.778 -36.591 32.636 1.00 0.00 C ATOM 1364 CG ASN A 85 -3.801 -35.474 32.499 1.00 0.00 C ATOM 1365 OD1 ASN A 85 -4.773 -35.404 33.241 1.00 0.00 O ATOM 1366 ND2 ASN A 85 -3.578 -34.588 31.546 1.00 0.00 N ATOM 0 H ASN A 85 -1.344 -35.496 34.582 1.00 0.00 H new ATOM 0 HA ASN A 85 -3.553 -37.448 34.476 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -1.816 -36.240 32.262 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -3.079 -37.428 32.006 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -4.226 -33.813 31.409 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -2.757 -34.679 30.947 1.00 0.00 H new ATOM 1373 N MET A 86 -2.150 -39.459 34.025 1.00 0.00 N ATOM 1374 CA MET A 86 -1.345 -40.671 33.926 1.00 0.00 C ATOM 1375 C MET A 86 -2.088 -41.719 33.092 1.00 0.00 C ATOM 1376 O MET A 86 -3.307 -41.879 33.221 1.00 0.00 O ATOM 1377 CB MET A 86 -0.990 -41.208 35.324 1.00 0.00 C ATOM 1378 CG MET A 86 -0.098 -42.454 35.331 1.00 0.00 C ATOM 1379 SD MET A 86 -1.031 -43.995 35.373 1.00 0.00 S ATOM 1380 CE MET A 86 -1.766 -43.917 37.008 1.00 0.00 C ATOM 0 H MET A 86 -3.155 -39.631 34.040 1.00 0.00 H new ATOM 0 HA MET A 86 -0.407 -40.436 33.424 1.00 0.00 H new ATOM 0 HB2 MET A 86 -0.490 -40.418 35.884 1.00 0.00 H new ATOM 0 HB3 MET A 86 -1.914 -41.438 35.854 1.00 0.00 H new ATOM 0 HG2 MET A 86 0.535 -42.444 34.444 1.00 0.00 H new ATOM 0 HG3 MET A 86 0.564 -42.414 36.196 1.00 0.00 H new ATOM 0 HE1 MET A 86 -1.985 -44.926 37.357 1.00 0.00 H new ATOM 0 HE2 MET A 86 -1.071 -43.437 37.697 1.00 0.00 H new ATOM 0 HE3 MET A 86 -2.690 -43.340 36.965 1.00 0.00 H new ATOM 1390 N LEU A 87 -1.362 -42.398 32.219 1.00 0.00 N ATOM 1391 CA LEU A 87 -1.945 -43.400 31.336 1.00 0.00 C ATOM 1392 C LEU A 87 -1.437 -44.801 31.627 1.00 0.00 C ATOM 1393 O LEU A 87 -0.230 -45.022 31.789 1.00 0.00 O ATOM 1394 CB LEU A 87 -1.662 -43.044 29.882 1.00 0.00 C ATOM 1395 CG LEU A 87 -2.599 -42.030 29.239 1.00 0.00 C ATOM 1396 CD1 LEU A 87 -1.981 -41.481 27.963 1.00 0.00 C ATOM 1397 CD2 LEU A 87 -3.932 -42.693 28.929 1.00 0.00 C ATOM 0 H LEU A 87 -0.357 -42.273 32.101 1.00 0.00 H new ATOM 0 HA LEU A 87 -3.020 -43.398 31.519 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -0.644 -42.659 29.816 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -1.694 -43.961 29.293 1.00 0.00 H new ATOM 0 HG LEU A 87 -2.761 -41.204 29.932 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -2.660 -40.757 27.512 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -1.035 -40.994 28.197 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -1.805 -42.298 27.263 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -4.602 -41.966 28.469 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -3.774 -43.525 28.243 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -4.378 -43.063 29.852 1.00 0.00 H new ATOM 1409 N VAL A 88 -2.364 -45.744 31.677 1.00 0.00 N ATOM 1410 CA VAL A 88 -2.033 -47.139 31.877 1.00 0.00 C ATOM 1411 C VAL A 88 -2.452 -47.960 30.661 1.00 0.00 C ATOM 1412 O VAL A 88 -3.575 -47.825 30.156 1.00 0.00 O ATOM 1413 CB VAL A 88 -2.698 -47.731 33.150 1.00 0.00 C ATOM 1414 CG1 VAL A 88 -2.148 -47.073 34.404 1.00 0.00 C ATOM 1415 CG2 VAL A 88 -4.215 -47.590 33.092 1.00 0.00 C ATOM 0 H VAL A 88 -3.363 -45.561 31.580 1.00 0.00 H new ATOM 0 HA VAL A 88 -0.953 -47.191 32.011 1.00 0.00 H new ATOM 0 HB VAL A 88 -2.458 -48.794 33.188 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -2.629 -47.504 35.282 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -1.072 -47.240 34.461 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -2.348 -46.002 34.370 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -4.655 -48.013 33.996 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -4.480 -46.535 33.019 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -4.597 -48.121 32.220 1.00 0.00 H new ATOM 1425 N THR A 89 -1.548 -48.777 30.180 1.00 0.00 N ATOM 1426 CA THR A 89 -1.810 -49.620 29.040 1.00 0.00 C ATOM 1427 C THR A 89 -2.015 -51.052 29.523 1.00 0.00 C ATOM 1428 O THR A 89 -1.303 -51.516 30.416 1.00 0.00 O ATOM 1429 CB THR A 89 -0.633 -49.572 28.037 1.00 0.00 C ATOM 1430 OG1 THR A 89 -0.260 -48.210 27.783 1.00 0.00 O ATOM 1431 CG2 THR A 89 -0.997 -50.228 26.719 1.00 0.00 C ATOM 0 H THR A 89 -0.610 -48.876 30.568 1.00 0.00 H new ATOM 0 HA THR A 89 -2.705 -49.262 28.531 1.00 0.00 H new ATOM 0 HB THR A 89 0.199 -50.117 28.484 1.00 0.00 H new ATOM 0 HG1 THR A 89 -0.858 -47.828 27.107 1.00 0.00 H new ATOM 0 HG21 THR A 89 -0.146 -50.176 26.039 1.00 0.00 H new ATOM 0 HG22 THR A 89 -1.259 -51.272 26.892 1.00 0.00 H new ATOM 0 HG23 THR A 89 -1.847 -49.709 26.277 1.00 0.00 H new ATOM 1439 N PRO A 90 -3.003 -51.758 28.975 1.00 0.00 N ATOM 1440 CA PRO A 90 -3.282 -53.143 29.355 1.00 0.00 C ATOM 1441 C PRO A 90 -2.125 -54.072 28.988 1.00 0.00 C ATOM 1442 O PRO A 90 -1.411 -53.835 28.009 1.00 0.00 O ATOM 1443 CB PRO A 90 -4.547 -53.472 28.553 1.00 0.00 C ATOM 1444 CG PRO A 90 -4.470 -52.566 27.381 1.00 0.00 C ATOM 1445 CD PRO A 90 -3.919 -51.287 27.925 1.00 0.00 C ATOM 0 HA PRO A 90 -3.411 -53.274 30.429 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -4.567 -54.518 28.249 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -5.449 -53.293 29.138 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -3.824 -52.977 26.605 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -5.452 -52.415 26.932 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -3.398 -50.711 27.160 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -4.703 -50.646 28.328 1.00 0.00 H new ATOM 1453 N LYS A 91 -1.931 -55.113 29.781 1.00 0.00 N ATOM 1454 CA LYS A 91 -0.841 -56.051 29.552 1.00 0.00 C ATOM 1455 C LYS A 91 -1.081 -56.899 28.306 1.00 0.00 C ATOM 1456 O LYS A 91 -1.840 -57.870 28.337 1.00 0.00 O ATOM 1457 CB LYS A 91 -0.637 -56.950 30.774 1.00 0.00 C ATOM 1458 CG LYS A 91 0.270 -56.353 31.833 1.00 0.00 C ATOM 1459 CD LYS A 91 0.335 -57.230 33.070 1.00 0.00 C ATOM 1460 CE LYS A 91 1.422 -56.763 34.033 1.00 0.00 C ATOM 1461 NZ LYS A 91 1.391 -55.301 34.271 1.00 0.00 N ATOM 0 H LYS A 91 -2.513 -55.331 30.589 1.00 0.00 H new ATOM 0 HA LYS A 91 0.064 -55.466 29.389 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -1.608 -57.165 31.221 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -0.219 -57.902 30.447 1.00 0.00 H new ATOM 0 HG2 LYS A 91 1.272 -56.224 31.424 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -0.092 -55.362 32.107 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -0.630 -57.218 33.576 1.00 0.00 H new ATOM 0 HD3 LYS A 91 0.528 -58.262 32.776 1.00 0.00 H new ATOM 0 HE2 LYS A 91 1.306 -57.283 34.984 1.00 0.00 H new ATOM 0 HE3 LYS A 91 2.398 -57.041 33.634 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 1.805 -55.092 35.202 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 1.939 -54.817 33.531 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 0.407 -54.966 34.247 1.00 0.00 H new ATOM 1475 N LYS A 92 -0.457 -56.499 27.214 1.00 0.00 N ATOM 1476 CA LYS A 92 -0.536 -57.220 25.956 1.00 0.00 C ATOM 1477 C LYS A 92 0.828 -57.312 25.306 1.00 0.00 C ATOM 1478 O LYS A 92 1.650 -56.397 25.431 1.00 0.00 O ATOM 1479 CB LYS A 92 -1.506 -56.538 24.979 1.00 0.00 C ATOM 1480 CG LYS A 92 -2.974 -56.619 25.360 1.00 0.00 C ATOM 1481 CD LYS A 92 -3.461 -58.059 25.355 1.00 0.00 C ATOM 1482 CE LYS A 92 -4.973 -58.125 25.267 1.00 0.00 C ATOM 1483 NZ LYS A 92 -5.460 -57.721 23.919 1.00 0.00 N ATOM 0 H LYS A 92 0.122 -55.660 27.174 1.00 0.00 H new ATOM 0 HA LYS A 92 -0.905 -58.220 26.182 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -1.228 -55.488 24.890 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -1.378 -56.986 23.994 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -3.121 -56.185 26.349 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -3.567 -56.029 24.662 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -3.021 -58.592 24.512 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -3.124 -58.563 26.261 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -5.307 -59.139 25.487 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -5.411 -57.474 26.023 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -6.429 -58.073 23.780 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -5.454 -56.684 23.844 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -4.838 -58.124 23.190 1.00 0.00 H new ATOM 1497 N ALA A 93 1.069 -58.415 24.631 1.00 0.00 N ATOM 1498 CA ALA A 93 2.281 -58.594 23.871 1.00 0.00 C ATOM 1499 C ALA A 93 1.953 -58.467 22.394 1.00 0.00 C ATOM 1500 O ALA A 93 1.520 -59.435 21.752 1.00 0.00 O ATOM 1501 CB ALA A 93 2.922 -59.940 24.177 1.00 0.00 C ATOM 0 H ALA A 93 0.430 -59.209 24.595 1.00 0.00 H new ATOM 0 HA ALA A 93 3.003 -57.826 24.149 1.00 0.00 H new ATOM 0 HB1 ALA A 93 3.834 -60.050 23.591 1.00 0.00 H new ATOM 0 HB2 ALA A 93 3.164 -59.995 25.238 1.00 0.00 H new ATOM 0 HB3 ALA A 93 2.228 -60.740 23.921 1.00 0.00 H new ATOM 1507 N GLU A 94 2.119 -57.269 21.868 1.00 0.00 N ATOM 1508 CA GLU A 94 1.776 -56.981 20.491 1.00 0.00 C ATOM 1509 C GLU A 94 2.800 -57.534 19.514 1.00 0.00 C ATOM 1510 O GLU A 94 3.825 -56.903 19.229 1.00 0.00 O ATOM 1511 CB GLU A 94 1.578 -55.478 20.288 1.00 0.00 C ATOM 1512 CG GLU A 94 0.364 -54.927 21.017 1.00 0.00 C ATOM 1513 CD GLU A 94 -0.928 -55.492 20.475 1.00 0.00 C ATOM 1514 OE1 GLU A 94 -1.429 -54.971 19.461 1.00 0.00 O ATOM 1515 OE2 GLU A 94 -1.452 -56.470 21.055 1.00 0.00 O ATOM 0 H GLU A 94 2.494 -56.472 22.382 1.00 0.00 H new ATOM 0 HA GLU A 94 0.834 -57.487 20.280 1.00 0.00 H new ATOM 0 HB2 GLU A 94 2.469 -54.952 20.631 1.00 0.00 H new ATOM 0 HB3 GLU A 94 1.477 -55.273 19.222 1.00 0.00 H new ATOM 0 HG2 GLU A 94 0.443 -55.159 22.079 1.00 0.00 H new ATOM 0 HG3 GLU A 94 0.350 -53.841 20.928 1.00 0.00 H new ATOM 1522 N GLY A 95 2.522 -58.730 19.033 1.00 0.00 N ATOM 1523 CA GLY A 95 3.357 -59.365 18.043 1.00 0.00 C ATOM 1524 C GLY A 95 2.525 -59.851 16.882 1.00 0.00 C ATOM 1525 O GLY A 95 2.641 -60.996 16.451 1.00 0.00 O ATOM 0 H GLY A 95 1.714 -59.283 19.318 1.00 0.00 H new ATOM 0 HA2 GLY A 95 4.110 -58.661 17.689 1.00 0.00 H new ATOM 0 HA3 GLY A 95 3.890 -60.203 18.492 1.00 0.00 H new ATOM 1529 N HIS A 96 1.669 -58.980 16.387 1.00 0.00 N ATOM 1530 CA HIS A 96 0.775 -59.319 15.289 1.00 0.00 C ATOM 1531 C HIS A 96 1.433 -58.943 13.969 1.00 0.00 C ATOM 1532 O HIS A 96 2.470 -58.284 13.966 1.00 0.00 O ATOM 1533 CB HIS A 96 -0.568 -58.578 15.434 1.00 0.00 C ATOM 1534 CG HIS A 96 -1.143 -58.597 16.825 1.00 0.00 C ATOM 1535 ND1 HIS A 96 -1.687 -59.722 17.412 1.00 0.00 N ATOM 1536 CD2 HIS A 96 -1.236 -57.613 17.752 1.00 0.00 C ATOM 1537 CE1 HIS A 96 -2.091 -59.421 18.642 1.00 0.00 C ATOM 1538 NE2 HIS A 96 -1.826 -58.151 18.866 1.00 0.00 N ATOM 0 H HIS A 96 1.571 -58.024 16.728 1.00 0.00 H new ATOM 0 HA HIS A 96 0.580 -60.391 15.310 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -0.432 -57.542 15.124 1.00 0.00 H new ATOM 0 HB3 HIS A 96 -1.290 -59.023 14.750 1.00 0.00 H new ATOM 0 HD2 HIS A 96 -0.906 -56.592 17.634 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -2.557 -60.102 19.339 1.00 0.00 H new ATOM 0 HE2 HIS A 96 -2.027 -57.648 19.730 1.00 0.00 H new ATOM 1546 N HIS A 97 0.848 -59.371 12.853 1.00 0.00 N ATOM 1547 CA HIS A 97 1.400 -59.046 11.541 1.00 0.00 C ATOM 1548 C HIS A 97 1.189 -57.551 11.231 1.00 0.00 C ATOM 1549 O HIS A 97 1.919 -56.703 11.745 1.00 0.00 O ATOM 1550 CB HIS A 97 0.773 -59.936 10.451 1.00 0.00 C ATOM 1551 CG HIS A 97 1.529 -59.970 9.148 1.00 0.00 C ATOM 1552 ND1 HIS A 97 2.643 -59.192 8.888 1.00 0.00 N ATOM 1553 CD2 HIS A 97 1.329 -60.712 8.030 1.00 0.00 C ATOM 1554 CE1 HIS A 97 3.087 -59.461 7.669 1.00 0.00 C ATOM 1555 NE2 HIS A 97 2.309 -60.375 7.134 1.00 0.00 N ATOM 0 H HIS A 97 0.000 -59.938 12.830 1.00 0.00 H new ATOM 0 HA HIS A 97 2.472 -59.243 11.553 1.00 0.00 H new ATOM 0 HB2 HIS A 97 0.693 -60.953 10.835 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -0.241 -59.588 10.257 1.00 0.00 H new ATOM 0 HD2 HIS A 97 0.542 -61.435 7.875 1.00 0.00 H new ATOM 0 HE1 HIS A 97 3.944 -59.006 7.195 1.00 0.00 H new ATOM 0 HE2 HIS A 97 2.418 -60.771 6.200 1.00 0.00 H new ATOM 1563 N HIS A 98 0.172 -57.236 10.408 1.00 0.00 N ATOM 1564 CA HIS A 98 -0.158 -55.837 10.044 1.00 0.00 C ATOM 1565 C HIS A 98 1.064 -55.063 9.526 1.00 0.00 C ATOM 1566 O HIS A 98 1.088 -53.833 9.562 1.00 0.00 O ATOM 1567 CB HIS A 98 -0.789 -55.094 11.236 1.00 0.00 C ATOM 1568 CG HIS A 98 -2.139 -55.620 11.635 1.00 0.00 C ATOM 1569 ND1 HIS A 98 -3.321 -55.151 11.100 1.00 0.00 N ATOM 1570 CD2 HIS A 98 -2.491 -56.576 12.524 1.00 0.00 C ATOM 1571 CE1 HIS A 98 -4.337 -55.796 11.645 1.00 0.00 C ATOM 1572 NE2 HIS A 98 -3.863 -56.664 12.510 1.00 0.00 N ATOM 0 H HIS A 98 -0.440 -57.930 9.979 1.00 0.00 H new ATOM 0 HA HIS A 98 -0.882 -55.888 9.231 1.00 0.00 H new ATOM 0 HB2 HIS A 98 -0.116 -55.161 12.091 1.00 0.00 H new ATOM 0 HB3 HIS A 98 -0.881 -54.037 10.985 1.00 0.00 H new ATOM 0 HD2 HIS A 98 -1.819 -57.162 13.133 1.00 0.00 H new ATOM 0 HE1 HIS A 98 -5.381 -55.637 11.418 1.00 0.00 H new ATOM 0 HE2 HIS A 98 -4.422 -57.300 13.079 1.00 0.00 H new ATOM 1580 N HIS A 99 2.064 -55.795 9.029 1.00 0.00 N ATOM 1581 CA HIS A 99 3.282 -55.187 8.510 1.00 0.00 C ATOM 1582 C HIS A 99 2.955 -54.272 7.344 1.00 0.00 C ATOM 1583 O HIS A 99 3.509 -53.176 7.216 1.00 0.00 O ATOM 1584 CB HIS A 99 4.278 -56.267 8.071 1.00 0.00 C ATOM 1585 CG HIS A 99 5.565 -55.724 7.530 1.00 0.00 C ATOM 1586 ND1 HIS A 99 5.787 -55.519 6.183 1.00 0.00 N ATOM 1587 CD2 HIS A 99 6.697 -55.334 8.155 1.00 0.00 C ATOM 1588 CE1 HIS A 99 7.000 -55.026 6.009 1.00 0.00 C ATOM 1589 NE2 HIS A 99 7.569 -54.906 7.187 1.00 0.00 N ATOM 0 H HIS A 99 2.049 -56.814 8.977 1.00 0.00 H new ATOM 0 HA HIS A 99 3.739 -54.597 9.304 1.00 0.00 H new ATOM 0 HB2 HIS A 99 4.497 -56.913 8.922 1.00 0.00 H new ATOM 0 HB3 HIS A 99 3.810 -56.891 7.310 1.00 0.00 H new ATOM 0 HD2 HIS A 99 6.881 -55.355 9.219 1.00 0.00 H new ATOM 0 HE1 HIS A 99 7.447 -54.766 5.061 1.00 0.00 H new ATOM 0 HE2 HIS A 99 8.510 -54.551 7.355 1.00 0.00 H new ATOM 1597 N HIS A 100 2.054 -54.726 6.504 1.00 0.00 N ATOM 1598 CA HIS A 100 1.628 -53.956 5.367 1.00 0.00 C ATOM 1599 C HIS A 100 0.372 -53.186 5.725 1.00 0.00 C ATOM 1600 O HIS A 100 -0.750 -53.688 5.603 1.00 0.00 O ATOM 1601 CB HIS A 100 1.396 -54.861 4.154 1.00 0.00 C ATOM 1602 CG HIS A 100 2.624 -55.604 3.726 1.00 0.00 C ATOM 1603 ND1 HIS A 100 2.817 -56.947 3.973 1.00 0.00 N ATOM 1604 CD2 HIS A 100 3.732 -55.183 3.073 1.00 0.00 C ATOM 1605 CE1 HIS A 100 3.988 -57.318 3.494 1.00 0.00 C ATOM 1606 NE2 HIS A 100 4.562 -56.270 2.944 1.00 0.00 N ATOM 0 H HIS A 100 1.600 -55.635 6.592 1.00 0.00 H new ATOM 0 HA HIS A 100 2.411 -53.247 5.098 1.00 0.00 H new ATOM 0 HB2 HIS A 100 0.609 -55.578 4.389 1.00 0.00 H new ATOM 0 HB3 HIS A 100 1.037 -54.256 3.321 1.00 0.00 H new ATOM 0 HD2 HIS A 100 3.927 -54.181 2.720 1.00 0.00 H new ATOM 0 HE1 HIS A 100 4.405 -58.313 3.545 1.00 0.00 H new ATOM 0 HE2 HIS A 100 5.477 -56.265 2.494 1.00 0.00 H new ATOM 1614 N HIS A 101 0.573 -51.986 6.201 1.00 0.00 N ATOM 1615 CA HIS A 101 -0.507 -51.131 6.628 1.00 0.00 C ATOM 1616 C HIS A 101 -0.668 -49.977 5.655 1.00 0.00 C ATOM 1617 O HIS A 101 -1.791 -49.767 5.162 1.00 0.00 O ATOM 1618 CB HIS A 101 -0.234 -50.612 8.043 1.00 0.00 C ATOM 1619 CG HIS A 101 -1.359 -49.821 8.635 1.00 0.00 C ATOM 1620 ND1 HIS A 101 -1.333 -48.448 8.748 1.00 0.00 N ATOM 1621 CD2 HIS A 101 -2.543 -50.217 9.166 1.00 0.00 C ATOM 1622 CE1 HIS A 101 -2.449 -48.035 9.326 1.00 0.00 C ATOM 1623 NE2 HIS A 101 -3.197 -49.088 9.587 1.00 0.00 N ATOM 1624 OXT HIS A 101 0.347 -49.309 5.355 1.00 0.00 O ATOM 0 H HIS A 101 1.498 -51.569 6.305 1.00 0.00 H new ATOM 0 HA HIS A 101 -1.435 -51.703 6.643 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -0.019 -51.460 8.694 1.00 0.00 H new ATOM 0 HB3 HIS A 101 0.661 -49.990 8.023 1.00 0.00 H new ATOM 0 HD2 HIS A 101 -2.903 -51.232 9.243 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -2.704 -47.009 9.547 1.00 0.00 H new ATOM 0 HE2 HIS A 101 -4.115 -49.067 10.031 1.00 0.00 H new TER 1632 HIS A 101