USER MOD reduce.3.24.130724 H: found=0, std=0, add=1050, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 1054 hydrogens (16 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 MET CE :methyl -155:sc= -0.138 (180deg=-0.72) USER MOD Single : A 1 MET N :NH3+ 172:sc= 0 (180deg=-0.0828) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 ASN : amide:sc= -8.9! C(o=-8.9!,f=-7.1!) USER MOD Single : A 15 ASN : amide:sc= -0.53 X(o=-0.53,f=-0.53) USER MOD Single : A 16 ASN : amide:sc= -2.86! C(o=-2.9!,f=-2.9!) USER MOD Single : A 21 THR OG1 : rot 4:sc= 0.61! USER MOD Single : A 28 HIS : no HD1:sc= -0.602 K(o=-0.6,f=-1.2!) USER MOD Single : A 29 MET CE :methyl -150:sc= -0.0117 (180deg=-0.22) USER MOD Single : A 31 ASN : amide:sc= -0.252 X(o=-0.25,f=-0.061) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 MET CE :methyl 160:sc= -0.0278 (180deg=-0.311) USER MOD Single : A 45 THR OG1 : rot 180:sc= -0.914 USER MOD Single : A 48 GLN : amide:sc= -0.484 X(o=-0.48,f=-0.84) USER MOD Single : A 55 GLN : amide:sc= 0 X(o=0,f=-0.09) USER MOD Single : A 61 THR OG1 : rot 180:sc= 0.0169 USER MOD Single : A 63 GLN : amide:sc= -0.239 K(o=-0.24,f=-3.9!) USER MOD Single : A 64 HIS : no HE2:sc= -18.3! C(o=-18!,f=-25!) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 79 HIS : no HE2:sc= -1.38 K(o=-1.4,f=-2.8!) USER MOD Single : A 81 THR OG1 : rot -160:sc= -0.427 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 GLN : amide:sc= -0.192 K(o=-0.19,f=-2.3!) USER MOD Single : A 105 MET CE :methyl -131:sc= -0.47 (180deg=-4.07!) USER MOD Single : A 106 SER OG : rot 180:sc= 0.067 USER MOD Single : A 111 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 119 ASN : amide:sc= -2.6 K(o=-2.6,f=-4.5!) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 8OG O3' : rot 40:sc= -0.706 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -24.223 -7.437 -3.758 1.00 0.00 N ATOM 2 CA MET A 1 -22.986 -8.258 -3.831 1.00 0.00 C ATOM 3 C MET A 1 -21.800 -7.427 -4.311 1.00 0.00 C ATOM 4 O MET A 1 -20.972 -7.901 -5.088 1.00 0.00 O ATOM 5 CB MET A 1 -23.233 -9.427 -4.786 1.00 0.00 C ATOM 6 CG MET A 1 -23.811 -10.657 -4.106 1.00 0.00 C ATOM 7 SD MET A 1 -24.584 -11.797 -5.270 1.00 0.00 S ATOM 8 CE MET A 1 -26.002 -10.836 -5.793 1.00 0.00 C ATOM 0 H1 MET A 1 -25.037 -8.053 -3.561 1.00 0.00 H new ATOM 0 H2 MET A 1 -24.129 -6.734 -2.997 1.00 0.00 H new ATOM 0 H3 MET A 1 -24.370 -6.949 -4.664 1.00 0.00 H new ATOM 0 HA MET A 1 -22.744 -8.630 -2.836 1.00 0.00 H new ATOM 0 HB2 MET A 1 -23.914 -9.104 -5.574 1.00 0.00 H new ATOM 0 HB3 MET A 1 -22.293 -9.696 -5.268 1.00 0.00 H new ATOM 0 HG2 MET A 1 -23.018 -11.176 -3.568 1.00 0.00 H new ATOM 0 HG3 MET A 1 -24.548 -10.345 -3.365 1.00 0.00 H new ATOM 0 HE1 MET A 1 -26.790 -11.507 -6.136 1.00 0.00 H new ATOM 0 HE2 MET A 1 -26.369 -10.244 -4.955 1.00 0.00 H new ATOM 0 HE3 MET A 1 -25.711 -10.172 -6.607 1.00 0.00 H new ATOM 20 N LYS A 2 -21.724 -6.186 -3.842 1.00 0.00 N ATOM 21 CA LYS A 2 -20.638 -5.290 -4.225 1.00 0.00 C ATOM 22 C LYS A 2 -19.340 -5.684 -3.527 1.00 0.00 C ATOM 23 O LYS A 2 -19.314 -5.899 -2.316 1.00 0.00 O ATOM 24 CB LYS A 2 -21.000 -3.842 -3.886 1.00 0.00 C ATOM 25 CG LYS A 2 -21.181 -2.959 -5.112 1.00 0.00 C ATOM 26 CD LYS A 2 -20.518 -1.603 -4.929 1.00 0.00 C ATOM 27 CE LYS A 2 -19.821 -1.146 -6.200 1.00 0.00 C ATOM 28 NZ LYS A 2 -19.964 0.321 -6.417 1.00 0.00 N ATOM 0 H LYS A 2 -22.400 -5.778 -3.197 1.00 0.00 H new ATOM 0 HA LYS A 2 -20.489 -5.374 -5.302 1.00 0.00 H new ATOM 0 HB2 LYS A 2 -21.921 -3.833 -3.302 1.00 0.00 H new ATOM 0 HB3 LYS A 2 -20.218 -3.419 -3.255 1.00 0.00 H new ATOM 0 HG2 LYS A 2 -20.758 -3.456 -5.985 1.00 0.00 H new ATOM 0 HG3 LYS A 2 -22.244 -2.821 -5.308 1.00 0.00 H new ATOM 0 HD2 LYS A 2 -21.268 -0.867 -4.639 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -19.794 -1.658 -4.116 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -18.763 -1.403 -6.146 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -20.236 -1.681 -7.054 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -19.475 0.592 -7.294 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -20.972 0.564 -6.494 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -19.545 0.833 -5.615 1.00 0.00 H new ATOM 42 N LYS A 3 -18.263 -5.777 -4.301 1.00 0.00 N ATOM 43 CA LYS A 3 -16.961 -6.147 -3.759 1.00 0.00 C ATOM 44 C LYS A 3 -15.850 -5.323 -4.400 1.00 0.00 C ATOM 45 O LYS A 3 -15.785 -5.194 -5.622 1.00 0.00 O ATOM 46 CB LYS A 3 -16.699 -7.638 -3.980 1.00 0.00 C ATOM 47 CG LYS A 3 -16.845 -8.073 -5.429 1.00 0.00 C ATOM 48 CD LYS A 3 -16.025 -9.318 -5.723 1.00 0.00 C ATOM 49 CE LYS A 3 -14.601 -8.966 -6.122 1.00 0.00 C ATOM 50 NZ LYS A 3 -13.856 -10.151 -6.627 1.00 0.00 N ATOM 0 H LYS A 3 -18.267 -5.601 -5.306 1.00 0.00 H new ATOM 0 HA LYS A 3 -16.969 -5.941 -2.689 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -15.692 -7.876 -3.638 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -17.390 -8.215 -3.365 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -17.895 -8.268 -5.647 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -16.528 -7.264 -6.087 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -16.009 -9.961 -4.843 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -16.498 -9.886 -6.524 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -14.620 -8.194 -6.892 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -14.077 -8.547 -5.263 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -12.890 -9.868 -6.888 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -13.815 -10.878 -5.884 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -14.342 -10.536 -7.462 1.00 0.00 H new ATOM 64 N LEU A 4 -14.975 -4.768 -3.566 1.00 0.00 N ATOM 65 CA LEU A 4 -13.864 -3.958 -4.052 1.00 0.00 C ATOM 66 C LEU A 4 -12.536 -4.476 -3.508 1.00 0.00 C ATOM 67 O LEU A 4 -12.376 -4.657 -2.301 1.00 0.00 O ATOM 68 CB LEU A 4 -14.058 -2.494 -3.650 1.00 0.00 C ATOM 69 CG LEU A 4 -14.310 -2.258 -2.160 1.00 0.00 C ATOM 70 CD1 LEU A 4 -12.996 -2.030 -1.429 1.00 0.00 C ATOM 71 CD2 LEU A 4 -15.249 -1.076 -1.958 1.00 0.00 C ATOM 0 H LEU A 4 -15.014 -4.865 -2.551 1.00 0.00 H new ATOM 0 HA LEU A 4 -13.843 -4.028 -5.140 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -13.173 -1.932 -3.946 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -14.898 -2.087 -4.214 1.00 0.00 H new ATOM 0 HG LEU A 4 -14.785 -3.147 -1.744 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -13.193 -1.864 -0.370 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -12.358 -2.906 -1.546 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -12.494 -1.157 -1.846 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -15.417 -0.923 -0.892 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -14.803 -0.179 -2.388 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -16.200 -1.279 -2.450 1.00 0.00 H new ATOM 83 N GLN A 5 -11.588 -4.718 -4.407 1.00 0.00 N ATOM 84 CA GLN A 5 -10.276 -5.222 -4.019 1.00 0.00 C ATOM 85 C GLN A 5 -9.230 -4.115 -4.043 1.00 0.00 C ATOM 86 O GLN A 5 -9.344 -3.146 -4.795 1.00 0.00 O ATOM 87 CB GLN A 5 -9.844 -6.358 -4.947 1.00 0.00 C ATOM 88 CG GLN A 5 -10.992 -7.236 -5.405 1.00 0.00 C ATOM 89 CD GLN A 5 -10.569 -8.260 -6.441 1.00 0.00 C ATOM 90 OE1 GLN A 5 -9.913 -9.251 -6.120 1.00 0.00 O ATOM 91 NE2 GLN A 5 -10.942 -8.024 -7.694 1.00 0.00 N ATOM 0 H GLN A 5 -11.704 -4.573 -5.410 1.00 0.00 H new ATOM 0 HA GLN A 5 -10.356 -5.600 -3.000 1.00 0.00 H new ATOM 0 HB2 GLN A 5 -9.350 -5.934 -5.821 1.00 0.00 H new ATOM 0 HB3 GLN A 5 -9.107 -6.976 -4.433 1.00 0.00 H new ATOM 0 HG2 GLN A 5 -11.416 -7.751 -4.543 1.00 0.00 H new ATOM 0 HG3 GLN A 5 -11.780 -6.609 -5.821 1.00 0.00 H new ATOM 0 HE21 GLN A 5 -11.485 -7.190 -7.916 1.00 0.00 H new ATOM 0 HE22 GLN A 5 -10.685 -8.677 -8.434 1.00 0.00 H new ATOM 100 N ILE A 6 -8.210 -4.272 -3.210 1.00 0.00 N ATOM 101 CA ILE A 6 -7.131 -3.308 -3.114 1.00 0.00 C ATOM 102 C ILE A 6 -5.805 -4.019 -2.866 1.00 0.00 C ATOM 103 O ILE A 6 -5.739 -4.970 -2.087 1.00 0.00 O ATOM 104 CB ILE A 6 -7.389 -2.305 -1.979 1.00 0.00 C ATOM 105 CG1 ILE A 6 -8.848 -1.848 -1.987 1.00 0.00 C ATOM 106 CG2 ILE A 6 -6.461 -1.115 -2.116 1.00 0.00 C ATOM 107 CD1 ILE A 6 -9.773 -2.766 -1.219 1.00 0.00 C ATOM 0 H ILE A 6 -8.111 -5.071 -2.584 1.00 0.00 H new ATOM 0 HA ILE A 6 -7.083 -2.767 -4.059 1.00 0.00 H new ATOM 0 HB ILE A 6 -7.191 -2.797 -1.027 1.00 0.00 H new ATOM 0 HG12 ILE A 6 -8.909 -0.846 -1.562 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -9.193 -1.778 -3.019 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -6.652 -0.410 -1.307 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -5.426 -1.453 -2.066 1.00 0.00 H new ATOM 0 HG23 ILE A 6 -6.637 -0.625 -3.074 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -10.791 -2.380 -1.267 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -9.742 -3.764 -1.657 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -9.453 -2.817 -0.178 1.00 0.00 H new ATOM 119 N ALA A 7 -4.749 -3.558 -3.529 1.00 0.00 N ATOM 120 CA ALA A 7 -3.431 -4.158 -3.372 1.00 0.00 C ATOM 121 C ALA A 7 -2.421 -3.102 -2.975 1.00 0.00 C ATOM 122 O ALA A 7 -2.289 -2.102 -3.660 1.00 0.00 O ATOM 123 CB ALA A 7 -3.005 -4.836 -4.665 1.00 0.00 C ATOM 0 H ALA A 7 -4.781 -2.772 -4.179 1.00 0.00 H new ATOM 0 HA ALA A 7 -3.479 -4.910 -2.584 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -2.018 -5.281 -4.535 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -3.723 -5.615 -4.921 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -2.968 -4.099 -5.467 1.00 0.00 H new ATOM 129 N VAL A 8 -1.709 -3.315 -1.880 1.00 0.00 N ATOM 130 CA VAL A 8 -0.722 -2.338 -1.437 1.00 0.00 C ATOM 131 C VAL A 8 0.590 -2.999 -1.040 1.00 0.00 C ATOM 132 O VAL A 8 0.621 -4.147 -0.601 1.00 0.00 O ATOM 133 CB VAL A 8 -1.253 -1.468 -0.268 1.00 0.00 C ATOM 134 CG1 VAL A 8 -2.482 -2.098 0.371 1.00 0.00 C ATOM 135 CG2 VAL A 8 -0.175 -1.220 0.781 1.00 0.00 C ATOM 0 H VAL A 8 -1.792 -4.142 -1.288 1.00 0.00 H new ATOM 0 HA VAL A 8 -0.533 -1.686 -2.290 1.00 0.00 H new ATOM 0 HB VAL A 8 -1.540 -0.504 -0.688 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -2.832 -1.466 1.187 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -3.270 -2.196 -0.375 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -2.225 -3.084 0.760 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -0.583 -0.607 1.585 1.00 0.00 H new ATOM 0 HG22 VAL A 8 0.163 -2.173 1.188 1.00 0.00 H new ATOM 0 HG23 VAL A 8 0.667 -0.702 0.322 1.00 0.00 H new ATOM 145 N GLY A 9 1.670 -2.247 -1.197 1.00 0.00 N ATOM 146 CA GLY A 9 2.985 -2.740 -0.851 1.00 0.00 C ATOM 147 C GLY A 9 3.919 -1.620 -0.443 1.00 0.00 C ATOM 148 O GLY A 9 4.156 -0.692 -1.216 1.00 0.00 O ATOM 0 H GLY A 9 1.656 -1.295 -1.562 1.00 0.00 H new ATOM 0 HA2 GLY A 9 2.900 -3.458 -0.035 1.00 0.00 H new ATOM 0 HA3 GLY A 9 3.408 -3.274 -1.702 1.00 0.00 H new ATOM 152 N ILE A 10 4.457 -1.704 0.768 1.00 0.00 N ATOM 153 CA ILE A 10 5.377 -0.679 1.254 1.00 0.00 C ATOM 154 C ILE A 10 6.707 -0.790 0.520 1.00 0.00 C ATOM 155 O ILE A 10 7.413 -1.787 0.657 1.00 0.00 O ATOM 156 CB ILE A 10 5.628 -0.767 2.785 1.00 0.00 C ATOM 157 CG1 ILE A 10 4.891 -1.954 3.418 1.00 0.00 C ATOM 158 CG2 ILE A 10 5.210 0.532 3.461 1.00 0.00 C ATOM 159 CD1 ILE A 10 5.081 -2.055 4.917 1.00 0.00 C ATOM 0 H ILE A 10 4.276 -2.462 1.426 1.00 0.00 H new ATOM 0 HA ILE A 10 4.908 0.285 1.056 1.00 0.00 H new ATOM 0 HB ILE A 10 6.696 -0.925 2.935 1.00 0.00 H new ATOM 0 HG12 ILE A 10 3.826 -1.868 3.200 1.00 0.00 H new ATOM 0 HG13 ILE A 10 5.238 -2.877 2.953 1.00 0.00 H new ATOM 0 HG21 ILE A 10 5.390 0.459 4.533 1.00 0.00 H new ATOM 0 HG22 ILE A 10 5.790 1.359 3.051 1.00 0.00 H new ATOM 0 HG23 ILE A 10 4.149 0.710 3.283 1.00 0.00 H new ATOM 0 HD11 ILE A 10 4.532 -2.917 5.296 1.00 0.00 H new ATOM 0 HD12 ILE A 10 6.141 -2.172 5.142 1.00 0.00 H new ATOM 0 HD13 ILE A 10 4.707 -1.149 5.393 1.00 0.00 H new ATOM 171 N ILE A 11 7.040 0.230 -0.270 1.00 0.00 N ATOM 172 CA ILE A 11 8.283 0.223 -1.038 1.00 0.00 C ATOM 173 C ILE A 11 9.497 0.398 -0.138 1.00 0.00 C ATOM 174 O ILE A 11 9.614 1.387 0.583 1.00 0.00 O ATOM 175 CB ILE A 11 8.309 1.318 -2.123 1.00 0.00 C ATOM 176 CG1 ILE A 11 6.905 1.561 -2.689 1.00 0.00 C ATOM 177 CG2 ILE A 11 9.273 0.922 -3.233 1.00 0.00 C ATOM 178 CD1 ILE A 11 6.907 2.243 -4.041 1.00 0.00 C ATOM 0 H ILE A 11 6.470 1.067 -0.394 1.00 0.00 H new ATOM 0 HA ILE A 11 8.325 -0.752 -1.524 1.00 0.00 H new ATOM 0 HB ILE A 11 8.652 2.249 -1.671 1.00 0.00 H new ATOM 0 HG12 ILE A 11 6.386 0.606 -2.774 1.00 0.00 H new ATOM 0 HG13 ILE A 11 6.339 2.170 -1.985 1.00 0.00 H new ATOM 0 HG21 ILE A 11 9.287 1.699 -3.997 1.00 0.00 H new ATOM 0 HG22 ILE A 11 10.274 0.801 -2.819 1.00 0.00 H new ATOM 0 HG23 ILE A 11 8.948 -0.018 -3.678 1.00 0.00 H new ATOM 0 HD11 ILE A 11 5.880 2.383 -4.380 1.00 0.00 H new ATOM 0 HD12 ILE A 11 7.397 3.213 -3.958 1.00 0.00 H new ATOM 0 HD13 ILE A 11 7.445 1.625 -4.760 1.00 0.00 H new ATOM 190 N ARG A 12 10.398 -0.577 -0.187 1.00 0.00 N ATOM 191 CA ARG A 12 11.607 -0.547 0.626 1.00 0.00 C ATOM 192 C ARG A 12 12.694 0.298 -0.022 1.00 0.00 C ATOM 193 O ARG A 12 13.147 0.005 -1.132 1.00 0.00 O ATOM 194 CB ARG A 12 12.127 -1.963 0.865 1.00 0.00 C ATOM 195 CG ARG A 12 11.931 -2.441 2.293 1.00 0.00 C ATOM 196 CD ARG A 12 13.259 -2.679 2.994 1.00 0.00 C ATOM 197 NE ARG A 12 13.214 -3.843 3.876 1.00 0.00 N ATOM 198 CZ ARG A 12 12.471 -3.909 4.978 1.00 0.00 C ATOM 199 NH1 ARG A 12 11.709 -2.883 5.336 1.00 0.00 N ATOM 200 NH2 ARG A 12 12.488 -5.006 5.723 1.00 0.00 N ATOM 0 H ARG A 12 10.313 -1.400 -0.783 1.00 0.00 H new ATOM 0 HA ARG A 12 11.347 -0.093 1.582 1.00 0.00 H new ATOM 0 HB2 ARG A 12 11.619 -2.649 0.187 1.00 0.00 H new ATOM 0 HB3 ARG A 12 13.188 -1.999 0.619 1.00 0.00 H new ATOM 0 HG2 ARG A 12 11.354 -1.702 2.848 1.00 0.00 H new ATOM 0 HG3 ARG A 12 11.350 -3.363 2.291 1.00 0.00 H new ATOM 0 HD2 ARG A 12 14.042 -2.820 2.249 1.00 0.00 H new ATOM 0 HD3 ARG A 12 13.526 -1.795 3.574 1.00 0.00 H new ATOM 0 HE ARG A 12 13.785 -4.652 3.633 1.00 0.00 H new ATOM 0 HH11 ARG A 12 11.691 -2.038 4.765 1.00 0.00 H new ATOM 0 HH12 ARG A 12 11.142 -2.940 6.182 1.00 0.00 H new ATOM 0 HH21 ARG A 12 13.070 -5.798 5.451 1.00 0.00 H new ATOM 0 HH22 ARG A 12 11.919 -5.058 6.568 1.00 0.00 H new ATOM 214 N ASN A 13 13.101 1.343 0.691 1.00 0.00 N ATOM 215 CA ASN A 13 14.136 2.260 0.223 1.00 0.00 C ATOM 216 C ASN A 13 15.532 1.688 0.415 1.00 0.00 C ATOM 217 O ASN A 13 15.710 0.524 0.775 1.00 0.00 O ATOM 218 CB ASN A 13 14.038 3.601 0.941 1.00 0.00 C ATOM 219 CG ASN A 13 14.711 4.749 0.203 1.00 0.00 C ATOM 220 OD1 ASN A 13 15.262 5.655 0.826 1.00 0.00 O ATOM 221 ND2 ASN A 13 14.672 4.721 -1.125 1.00 0.00 N ATOM 0 H ASN A 13 12.724 1.579 1.609 1.00 0.00 H new ATOM 0 HA ASN A 13 13.968 2.405 -0.844 1.00 0.00 H new ATOM 0 HB2 ASN A 13 12.986 3.846 1.090 1.00 0.00 H new ATOM 0 HB3 ASN A 13 14.487 3.506 1.930 1.00 0.00 H new ATOM 0 HD21 ASN A 13 15.109 5.469 -1.664 1.00 0.00 H new ATOM 0 HD22 ASN A 13 14.205 3.952 -1.605 1.00 0.00 H new ATOM 228 N GLU A 14 16.511 2.535 0.151 1.00 0.00 N ATOM 229 CA GLU A 14 17.920 2.181 0.256 1.00 0.00 C ATOM 230 C GLU A 14 18.429 2.259 1.701 1.00 0.00 C ATOM 231 O GLU A 14 19.607 2.011 1.959 1.00 0.00 O ATOM 232 CB GLU A 14 18.735 3.123 -0.634 1.00 0.00 C ATOM 233 CG GLU A 14 20.242 2.976 -0.483 1.00 0.00 C ATOM 234 CD GLU A 14 20.832 3.990 0.478 1.00 0.00 C ATOM 235 OE1 GLU A 14 20.073 4.540 1.301 1.00 0.00 O ATOM 236 OE2 GLU A 14 22.056 4.232 0.405 1.00 0.00 O ATOM 0 H GLU A 14 16.351 3.498 -0.145 1.00 0.00 H new ATOM 0 HA GLU A 14 18.037 1.148 -0.072 1.00 0.00 H new ATOM 0 HB2 GLU A 14 18.466 2.944 -1.675 1.00 0.00 H new ATOM 0 HB3 GLU A 14 18.457 4.152 -0.405 1.00 0.00 H new ATOM 0 HG2 GLU A 14 20.472 1.970 -0.131 1.00 0.00 H new ATOM 0 HG3 GLU A 14 20.714 3.088 -1.459 1.00 0.00 H new ATOM 243 N ASN A 15 17.554 2.606 2.639 1.00 0.00 N ATOM 244 CA ASN A 15 17.952 2.714 4.040 1.00 0.00 C ATOM 245 C ASN A 15 16.880 2.147 4.965 1.00 0.00 C ATOM 246 O ASN A 15 16.441 2.812 5.903 1.00 0.00 O ATOM 247 CB ASN A 15 18.233 4.175 4.396 1.00 0.00 C ATOM 248 CG ASN A 15 18.727 4.339 5.821 1.00 0.00 C ATOM 249 OD1 ASN A 15 19.712 3.720 6.224 1.00 0.00 O ATOM 250 ND2 ASN A 15 18.042 5.175 6.592 1.00 0.00 N ATOM 0 H ASN A 15 16.572 2.816 2.458 1.00 0.00 H new ATOM 0 HA ASN A 15 18.861 2.129 4.178 1.00 0.00 H new ATOM 0 HB2 ASN A 15 18.977 4.577 3.708 1.00 0.00 H new ATOM 0 HB3 ASN A 15 17.324 4.760 4.260 1.00 0.00 H new ATOM 0 HD21 ASN A 15 18.326 5.325 7.560 1.00 0.00 H new ATOM 0 HD22 ASN A 15 17.232 5.667 6.216 1.00 0.00 H new ATOM 257 N ASN A 16 16.462 0.914 4.690 1.00 0.00 N ATOM 258 CA ASN A 16 15.437 0.244 5.493 1.00 0.00 C ATOM 259 C ASN A 16 14.257 1.173 5.777 1.00 0.00 C ATOM 260 O ASN A 16 13.550 1.010 6.770 1.00 0.00 O ATOM 261 CB ASN A 16 16.034 -0.270 6.806 1.00 0.00 C ATOM 262 CG ASN A 16 16.461 0.850 7.736 1.00 0.00 C ATOM 263 OD1 ASN A 16 15.632 1.620 8.220 1.00 0.00 O ATOM 264 ND2 ASN A 16 17.761 0.946 7.989 1.00 0.00 N ATOM 0 H ASN A 16 16.818 0.355 3.915 1.00 0.00 H new ATOM 0 HA ASN A 16 15.067 -0.605 4.917 1.00 0.00 H new ATOM 0 HB2 ASN A 16 15.300 -0.897 7.313 1.00 0.00 H new ATOM 0 HB3 ASN A 16 16.895 -0.901 6.586 1.00 0.00 H new ATOM 0 HD21 ASN A 16 18.108 1.680 8.607 1.00 0.00 H new ATOM 0 HD22 ASN A 16 18.413 0.286 7.566 1.00 0.00 H new ATOM 271 N GLU A 17 14.047 2.137 4.888 1.00 0.00 N ATOM 272 CA GLU A 17 12.950 3.085 5.023 1.00 0.00 C ATOM 273 C GLU A 17 11.999 2.929 3.847 1.00 0.00 C ATOM 274 O GLU A 17 12.410 2.517 2.769 1.00 0.00 O ATOM 275 CB GLU A 17 13.483 4.519 5.093 1.00 0.00 C ATOM 276 CG GLU A 17 14.401 4.887 3.939 1.00 0.00 C ATOM 277 CD GLU A 17 15.132 6.195 4.168 1.00 0.00 C ATOM 278 OE1 GLU A 17 14.715 6.959 5.064 1.00 0.00 O ATOM 279 OE2 GLU A 17 16.122 6.455 3.453 1.00 0.00 O ATOM 0 H GLU A 17 14.627 2.282 4.061 1.00 0.00 H new ATOM 0 HA GLU A 17 12.413 2.879 5.949 1.00 0.00 H new ATOM 0 HB2 GLU A 17 12.640 5.210 5.110 1.00 0.00 H new ATOM 0 HB3 GLU A 17 14.022 4.651 6.031 1.00 0.00 H new ATOM 0 HG2 GLU A 17 15.129 4.090 3.791 1.00 0.00 H new ATOM 0 HG3 GLU A 17 13.815 4.958 3.023 1.00 0.00 H new ATOM 286 N ILE A 18 10.727 3.236 4.054 1.00 0.00 N ATOM 287 CA ILE A 18 9.742 3.097 2.989 1.00 0.00 C ATOM 288 C ILE A 18 8.939 4.381 2.793 1.00 0.00 C ATOM 289 O ILE A 18 8.672 5.114 3.745 1.00 0.00 O ATOM 290 CB ILE A 18 8.789 1.923 3.285 1.00 0.00 C ATOM 291 CG1 ILE A 18 9.539 0.592 3.193 1.00 0.00 C ATOM 292 CG2 ILE A 18 7.592 1.932 2.342 1.00 0.00 C ATOM 293 CD1 ILE A 18 9.304 -0.319 4.379 1.00 0.00 C ATOM 0 H ILE A 18 10.354 3.579 4.939 1.00 0.00 H new ATOM 0 HA ILE A 18 10.286 2.895 2.066 1.00 0.00 H new ATOM 0 HB ILE A 18 8.412 2.042 4.301 1.00 0.00 H new ATOM 0 HG12 ILE A 18 9.235 0.075 2.283 1.00 0.00 H new ATOM 0 HG13 ILE A 18 10.607 0.792 3.105 1.00 0.00 H new ATOM 0 HG21 ILE A 18 6.938 1.092 2.576 1.00 0.00 H new ATOM 0 HG22 ILE A 18 7.041 2.865 2.462 1.00 0.00 H new ATOM 0 HG23 ILE A 18 7.939 1.846 1.312 1.00 0.00 H new ATOM 0 HD11 ILE A 18 9.867 -1.243 4.245 1.00 0.00 H new ATOM 0 HD12 ILE A 18 9.635 0.178 5.291 1.00 0.00 H new ATOM 0 HD13 ILE A 18 8.241 -0.549 4.456 1.00 0.00 H new ATOM 305 N PHE A 19 8.559 4.638 1.545 1.00 0.00 N ATOM 306 CA PHE A 19 7.786 5.825 1.203 1.00 0.00 C ATOM 307 C PHE A 19 6.294 5.498 1.120 1.00 0.00 C ATOM 308 O PHE A 19 5.880 4.646 0.334 1.00 0.00 O ATOM 309 CB PHE A 19 8.292 6.412 -0.128 1.00 0.00 C ATOM 310 CG PHE A 19 7.264 6.445 -1.230 1.00 0.00 C ATOM 311 CD1 PHE A 19 7.042 5.331 -2.024 1.00 0.00 C ATOM 312 CD2 PHE A 19 6.526 7.592 -1.469 1.00 0.00 C ATOM 313 CE1 PHE A 19 6.100 5.362 -3.036 1.00 0.00 C ATOM 314 CE2 PHE A 19 5.583 7.629 -2.480 1.00 0.00 C ATOM 315 CZ PHE A 19 5.370 6.512 -3.263 1.00 0.00 C ATOM 0 H PHE A 19 8.776 4.036 0.751 1.00 0.00 H new ATOM 0 HA PHE A 19 7.920 6.569 1.989 1.00 0.00 H new ATOM 0 HB2 PHE A 19 8.648 7.427 0.050 1.00 0.00 H new ATOM 0 HB3 PHE A 19 9.148 5.828 -0.465 1.00 0.00 H new ATOM 0 HD1 PHE A 19 7.611 4.429 -1.851 1.00 0.00 H new ATOM 0 HD2 PHE A 19 6.689 8.468 -0.859 1.00 0.00 H new ATOM 0 HE1 PHE A 19 5.935 4.488 -3.648 1.00 0.00 H new ATOM 0 HE2 PHE A 19 5.014 8.530 -2.657 1.00 0.00 H new ATOM 0 HZ PHE A 19 4.633 6.538 -4.052 1.00 0.00 H new ATOM 325 N ILE A 20 5.494 6.185 1.926 1.00 0.00 N ATOM 326 CA ILE A 20 4.053 5.974 1.933 1.00 0.00 C ATOM 327 C ILE A 20 3.333 7.245 1.492 1.00 0.00 C ATOM 328 O ILE A 20 3.738 8.351 1.847 1.00 0.00 O ATOM 329 CB ILE A 20 3.522 5.550 3.326 1.00 0.00 C ATOM 330 CG1 ILE A 20 4.646 5.502 4.367 1.00 0.00 C ATOM 331 CG2 ILE A 20 2.829 4.198 3.238 1.00 0.00 C ATOM 332 CD1 ILE A 20 4.920 6.841 5.016 1.00 0.00 C ATOM 0 H ILE A 20 5.820 6.893 2.584 1.00 0.00 H new ATOM 0 HA ILE A 20 3.851 5.161 1.235 1.00 0.00 H new ATOM 0 HB ILE A 20 2.801 6.301 3.648 1.00 0.00 H new ATOM 0 HG12 ILE A 20 4.385 4.778 5.139 1.00 0.00 H new ATOM 0 HG13 ILE A 20 5.558 5.144 3.890 1.00 0.00 H new ATOM 0 HG21 ILE A 20 2.461 3.913 4.224 1.00 0.00 H new ATOM 0 HG22 ILE A 20 1.992 4.263 2.543 1.00 0.00 H new ATOM 0 HG23 ILE A 20 3.537 3.449 2.884 1.00 0.00 H new ATOM 0 HD11 ILE A 20 5.726 6.735 5.742 1.00 0.00 H new ATOM 0 HD12 ILE A 20 5.211 7.563 4.253 1.00 0.00 H new ATOM 0 HD13 ILE A 20 4.020 7.191 5.522 1.00 0.00 H new ATOM 344 N THR A 21 2.267 7.085 0.715 1.00 0.00 N ATOM 345 CA THR A 21 1.503 8.228 0.229 1.00 0.00 C ATOM 346 C THR A 21 0.550 8.738 1.304 1.00 0.00 C ATOM 347 O THR A 21 -0.257 7.982 1.841 1.00 0.00 O ATOM 348 CB THR A 21 0.719 7.852 -1.028 1.00 0.00 C ATOM 349 OG1 THR A 21 -0.459 7.141 -0.692 1.00 0.00 O ATOM 350 CG2 THR A 21 1.510 7.000 -1.997 1.00 0.00 C ATOM 0 H THR A 21 1.913 6.178 0.409 1.00 0.00 H new ATOM 0 HA THR A 21 2.206 9.024 -0.018 1.00 0.00 H new ATOM 0 HB THR A 21 0.483 8.799 -1.513 1.00 0.00 H new ATOM 0 HG1 THR A 21 -0.545 7.093 0.283 1.00 0.00 H new ATOM 0 HG21 THR A 21 0.894 6.770 -2.866 1.00 0.00 H new ATOM 0 HG22 THR A 21 2.400 7.543 -2.316 1.00 0.00 H new ATOM 0 HG23 THR A 21 1.807 6.073 -1.507 1.00 0.00 H new ATOM 358 N ARG A 22 0.648 10.027 1.615 1.00 0.00 N ATOM 359 CA ARG A 22 -0.207 10.630 2.627 1.00 0.00 C ATOM 360 C ARG A 22 -1.161 11.630 1.995 1.00 0.00 C ATOM 361 O ARG A 22 -0.997 12.009 0.836 1.00 0.00 O ATOM 362 CB ARG A 22 0.646 11.320 3.694 1.00 0.00 C ATOM 363 CG ARG A 22 -0.122 11.675 4.957 1.00 0.00 C ATOM 364 CD ARG A 22 0.819 12.033 6.097 1.00 0.00 C ATOM 365 NE ARG A 22 0.204 12.956 7.047 1.00 0.00 N ATOM 366 CZ ARG A 22 0.787 13.358 8.173 1.00 0.00 C ATOM 367 NH1 ARG A 22 1.999 12.921 8.493 1.00 0.00 N ATOM 368 NH2 ARG A 22 0.157 14.199 8.982 1.00 0.00 N ATOM 0 H ARG A 22 1.309 10.671 1.181 1.00 0.00 H new ATOM 0 HA ARG A 22 -0.794 9.841 3.097 1.00 0.00 H new ATOM 0 HB2 ARG A 22 1.479 10.668 3.957 1.00 0.00 H new ATOM 0 HB3 ARG A 22 1.074 12.229 3.272 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -0.788 12.514 4.756 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -0.749 10.834 5.252 1.00 0.00 H new ATOM 0 HD2 ARG A 22 1.119 11.124 6.618 1.00 0.00 H new ATOM 0 HD3 ARG A 22 1.726 12.482 5.691 1.00 0.00 H new ATOM 0 HE ARG A 22 -0.727 13.313 6.835 1.00 0.00 H new ATOM 0 HH11 ARG A 22 2.488 12.274 7.874 1.00 0.00 H new ATOM 0 HH12 ARG A 22 2.442 13.232 9.358 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -0.774 14.537 8.741 1.00 0.00 H new ATOM 0 HH22 ARG A 22 0.604 14.507 9.845 1.00 0.00 H new ATOM 382 N ARG A 23 -2.157 12.059 2.762 1.00 0.00 N ATOM 383 CA ARG A 23 -3.132 13.023 2.267 1.00 0.00 C ATOM 384 C ARG A 23 -2.485 14.394 2.094 1.00 0.00 C ATOM 385 O ARG A 23 -2.871 15.365 2.746 1.00 0.00 O ATOM 386 CB ARG A 23 -4.323 13.116 3.223 1.00 0.00 C ATOM 387 CG ARG A 23 -5.292 11.950 3.102 1.00 0.00 C ATOM 388 CD ARG A 23 -6.737 12.420 3.050 1.00 0.00 C ATOM 389 NE ARG A 23 -7.431 11.929 1.862 1.00 0.00 N ATOM 390 CZ ARG A 23 -7.144 12.319 0.622 1.00 0.00 C ATOM 391 NH1 ARG A 23 -6.180 13.204 0.403 1.00 0.00 N ATOM 392 NH2 ARG A 23 -7.823 11.820 -0.403 1.00 0.00 N ATOM 0 H ARG A 23 -2.310 11.756 3.724 1.00 0.00 H new ATOM 0 HA ARG A 23 -3.491 12.683 1.296 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -3.953 13.166 4.247 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -4.860 14.045 3.032 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -5.063 11.379 2.202 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -5.159 11.277 3.949 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -7.261 12.079 3.943 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -6.764 13.510 3.061 1.00 0.00 H new ATOM 0 HE ARG A 23 -8.179 11.248 1.990 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -5.654 13.590 1.187 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -5.965 13.499 -0.550 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -8.564 11.138 -0.240 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -7.604 12.118 -1.354 1.00 0.00 H new ATOM 406 N ALA A 24 -1.491 14.462 1.211 1.00 0.00 N ATOM 407 CA ALA A 24 -0.772 15.701 0.943 1.00 0.00 C ATOM 408 C ALA A 24 -0.391 16.416 2.237 1.00 0.00 C ATOM 409 O ALA A 24 -0.449 15.833 3.320 1.00 0.00 O ATOM 410 CB ALA A 24 -1.606 16.611 0.052 1.00 0.00 C ATOM 0 H ALA A 24 -1.164 13.664 0.665 1.00 0.00 H new ATOM 0 HA ALA A 24 0.152 15.449 0.422 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -1.058 17.533 -0.141 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -1.812 16.107 -0.892 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -2.547 16.845 0.550 1.00 0.00 H new ATOM 416 N ALA A 25 0.000 17.680 2.118 1.00 0.00 N ATOM 417 CA ALA A 25 0.390 18.472 3.279 1.00 0.00 C ATOM 418 C ALA A 25 -0.641 19.555 3.581 1.00 0.00 C ATOM 419 O ALA A 25 -0.813 19.958 4.732 1.00 0.00 O ATOM 420 CB ALA A 25 1.760 19.095 3.055 1.00 0.00 C ATOM 0 H ALA A 25 0.055 18.178 1.230 1.00 0.00 H new ATOM 0 HA ALA A 25 0.440 17.806 4.140 1.00 0.00 H new ATOM 0 HB1 ALA A 25 2.039 19.684 3.929 1.00 0.00 H new ATOM 0 HB2 ALA A 25 2.497 18.307 2.898 1.00 0.00 H new ATOM 0 HB3 ALA A 25 1.727 19.741 2.178 1.00 0.00 H new ATOM 426 N ASP A 26 -1.323 20.023 2.541 1.00 0.00 N ATOM 427 CA ASP A 26 -2.336 21.062 2.697 1.00 0.00 C ATOM 428 C ASP A 26 -3.740 20.482 2.555 1.00 0.00 C ATOM 429 O ASP A 26 -4.035 19.772 1.592 1.00 0.00 O ATOM 430 CB ASP A 26 -2.123 22.171 1.665 1.00 0.00 C ATOM 431 CG ASP A 26 -2.155 21.650 0.242 1.00 0.00 C ATOM 432 OD1 ASP A 26 -1.953 20.432 0.050 1.00 0.00 O ATOM 433 OD2 ASP A 26 -2.383 22.459 -0.681 1.00 0.00 O ATOM 0 H ASP A 26 -1.193 19.700 1.582 1.00 0.00 H new ATOM 0 HA ASP A 26 -2.237 21.482 3.698 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -2.894 22.931 1.788 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -1.165 22.656 1.850 1.00 0.00 H new ATOM 438 N ALA A 27 -4.603 20.791 3.518 1.00 0.00 N ATOM 439 CA ALA A 27 -5.977 20.303 3.500 1.00 0.00 C ATOM 440 C ALA A 27 -6.022 18.779 3.478 1.00 0.00 C ATOM 441 O ALA A 27 -4.990 18.116 3.582 1.00 0.00 O ATOM 442 CB ALA A 27 -6.723 20.872 2.303 1.00 0.00 C ATOM 0 H ALA A 27 -4.375 21.377 4.321 1.00 0.00 H new ATOM 0 HA ALA A 27 -6.466 20.640 4.414 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -7.747 20.499 2.302 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -6.733 21.960 2.364 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -6.224 20.565 1.384 1.00 0.00 H new ATOM 448 N HIS A 28 -7.225 18.231 3.340 1.00 0.00 N ATOM 449 CA HIS A 28 -7.408 16.783 3.303 1.00 0.00 C ATOM 450 C HIS A 28 -6.971 16.145 4.618 1.00 0.00 C ATOM 451 O HIS A 28 -6.041 16.619 5.271 1.00 0.00 O ATOM 452 CB HIS A 28 -6.619 16.177 2.140 1.00 0.00 C ATOM 453 CG HIS A 28 -6.769 16.933 0.856 1.00 0.00 C ATOM 454 ND1 HIS A 28 -7.788 17.834 0.628 1.00 0.00 N ATOM 455 CD2 HIS A 28 -6.022 16.920 -0.273 1.00 0.00 C ATOM 456 CE1 HIS A 28 -7.661 18.341 -0.586 1.00 0.00 C ATOM 457 NE2 HIS A 28 -6.598 17.803 -1.153 1.00 0.00 N ATOM 0 H HIS A 28 -8.088 18.767 3.252 1.00 0.00 H new ATOM 0 HA HIS A 28 -8.469 16.580 3.157 1.00 0.00 H new ATOM 0 HB2 HIS A 28 -5.563 16.139 2.409 1.00 0.00 H new ATOM 0 HB3 HIS A 28 -6.946 15.149 1.987 1.00 0.00 H new ATOM 0 HD2 HIS A 28 -5.138 16.326 -0.449 1.00 0.00 H new ATOM 0 HE1 HIS A 28 -8.316 19.072 -1.037 1.00 0.00 H new ATOM 0 HE2 HIS A 28 -6.259 18.009 -2.093 1.00 0.00 H new ATOM 466 N MET A 29 -7.648 15.067 5.000 1.00 0.00 N ATOM 467 CA MET A 29 -7.328 14.363 6.237 1.00 0.00 C ATOM 468 C MET A 29 -5.888 13.862 6.222 1.00 0.00 C ATOM 469 O MET A 29 -5.598 12.791 5.688 1.00 0.00 O ATOM 470 CB MET A 29 -8.287 13.189 6.444 1.00 0.00 C ATOM 471 CG MET A 29 -9.754 13.581 6.364 1.00 0.00 C ATOM 472 SD MET A 29 -10.765 12.324 5.559 1.00 0.00 S ATOM 473 CE MET A 29 -10.477 12.713 3.834 1.00 0.00 C ATOM 0 H MET A 29 -8.421 14.662 4.472 1.00 0.00 H new ATOM 0 HA MET A 29 -7.440 15.065 7.064 1.00 0.00 H new ATOM 0 HB2 MET A 29 -8.082 12.426 5.693 1.00 0.00 H new ATOM 0 HB3 MET A 29 -8.092 12.739 7.417 1.00 0.00 H new ATOM 0 HG2 MET A 29 -10.134 13.758 7.370 1.00 0.00 H new ATOM 0 HG3 MET A 29 -9.846 14.520 5.818 1.00 0.00 H new ATOM 0 HE1 MET A 29 -11.356 12.443 3.249 1.00 0.00 H new ATOM 0 HE2 MET A 29 -10.285 13.781 3.729 1.00 0.00 H new ATOM 0 HE3 MET A 29 -9.615 12.152 3.474 1.00 0.00 H new ATOM 483 N ALA A 30 -4.989 14.644 6.811 1.00 0.00 N ATOM 484 CA ALA A 30 -3.577 14.284 6.867 1.00 0.00 C ATOM 485 C ALA A 30 -3.336 13.075 7.770 1.00 0.00 C ATOM 486 O ALA A 30 -2.240 12.516 7.788 1.00 0.00 O ATOM 487 CB ALA A 30 -2.752 15.470 7.344 1.00 0.00 C ATOM 0 H ALA A 30 -5.214 15.533 7.257 1.00 0.00 H new ATOM 0 HA ALA A 30 -3.265 14.010 5.859 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -1.699 15.189 7.382 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -2.881 16.304 6.654 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -3.084 15.768 8.339 1.00 0.00 H new ATOM 493 N ASN A 31 -4.360 12.675 8.520 1.00 0.00 N ATOM 494 CA ASN A 31 -4.244 11.534 9.422 1.00 0.00 C ATOM 495 C ASN A 31 -4.638 10.230 8.730 1.00 0.00 C ATOM 496 O ASN A 31 -4.899 9.225 9.393 1.00 0.00 O ATOM 497 CB ASN A 31 -5.114 11.753 10.662 1.00 0.00 C ATOM 498 CG ASN A 31 -4.291 11.960 11.919 1.00 0.00 C ATOM 499 OD1 ASN A 31 -4.619 11.437 12.983 1.00 0.00 O ATOM 500 ND2 ASN A 31 -3.214 12.727 11.801 1.00 0.00 N ATOM 0 H ASN A 31 -5.276 13.123 8.521 1.00 0.00 H new ATOM 0 HA ASN A 31 -3.200 11.451 9.723 1.00 0.00 H new ATOM 0 HB2 ASN A 31 -5.755 12.621 10.504 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -5.770 10.893 10.798 1.00 0.00 H new ATOM 0 HD21 ASN A 31 -2.621 12.902 12.612 1.00 0.00 H new ATOM 0 HD22 ASN A 31 -2.979 13.141 10.899 1.00 0.00 H new ATOM 507 N LYS A 32 -4.678 10.242 7.399 1.00 0.00 N ATOM 508 CA LYS A 32 -5.037 9.049 6.638 1.00 0.00 C ATOM 509 C LYS A 32 -3.865 8.542 5.812 1.00 0.00 C ATOM 510 O LYS A 32 -4.050 7.886 4.786 1.00 0.00 O ATOM 511 CB LYS A 32 -6.241 9.321 5.737 1.00 0.00 C ATOM 512 CG LYS A 32 -7.554 8.816 6.311 1.00 0.00 C ATOM 513 CD LYS A 32 -8.639 8.754 5.249 1.00 0.00 C ATOM 514 CE LYS A 32 -8.574 7.453 4.463 1.00 0.00 C ATOM 515 NZ LYS A 32 -9.547 6.448 4.972 1.00 0.00 N ATOM 0 H LYS A 32 -4.467 11.061 6.828 1.00 0.00 H new ATOM 0 HA LYS A 32 -5.305 8.273 7.355 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -6.319 10.394 5.562 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -6.073 8.852 4.768 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -7.407 7.825 6.741 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -7.874 9.471 7.122 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -9.617 8.847 5.721 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -8.532 9.598 4.568 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -8.776 7.654 3.411 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -7.565 7.044 4.521 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -9.471 5.576 4.410 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -9.339 6.237 5.969 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -10.512 6.828 4.893 1.00 0.00 H new ATOM 529 N LEU A 33 -2.663 8.849 6.269 1.00 0.00 N ATOM 530 CA LEU A 33 -1.442 8.425 5.587 1.00 0.00 C ATOM 531 C LEU A 33 -1.528 6.949 5.199 1.00 0.00 C ATOM 532 O LEU A 33 -1.352 6.069 6.038 1.00 0.00 O ATOM 533 CB LEU A 33 -0.230 8.673 6.495 1.00 0.00 C ATOM 534 CG LEU A 33 1.167 8.436 5.882 1.00 0.00 C ATOM 535 CD1 LEU A 33 1.946 7.429 6.711 1.00 0.00 C ATOM 536 CD2 LEU A 33 1.087 7.973 4.431 1.00 0.00 C ATOM 0 H LEU A 33 -2.501 9.394 7.116 1.00 0.00 H new ATOM 0 HA LEU A 33 -1.326 9.008 4.674 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -0.275 9.704 6.846 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -0.328 8.033 7.372 1.00 0.00 H new ATOM 0 HG LEU A 33 1.690 9.392 5.892 1.00 0.00 H new ATOM 0 HD11 LEU A 33 2.928 7.273 6.265 1.00 0.00 H new ATOM 0 HD12 LEU A 33 2.064 7.807 7.726 1.00 0.00 H new ATOM 0 HD13 LEU A 33 1.405 6.483 6.737 1.00 0.00 H new ATOM 0 HD21 LEU A 33 2.094 7.819 4.042 1.00 0.00 H new ATOM 0 HD22 LEU A 33 0.531 7.037 4.378 1.00 0.00 H new ATOM 0 HD23 LEU A 33 0.580 8.731 3.835 1.00 0.00 H new ATOM 548 N GLU A 34 -1.812 6.688 3.925 1.00 0.00 N ATOM 549 CA GLU A 34 -1.937 5.318 3.439 1.00 0.00 C ATOM 550 C GLU A 34 -0.781 4.946 2.515 1.00 0.00 C ATOM 551 O GLU A 34 0.210 5.667 2.418 1.00 0.00 O ATOM 552 CB GLU A 34 -3.271 5.132 2.712 1.00 0.00 C ATOM 553 CG GLU A 34 -4.019 3.874 3.121 1.00 0.00 C ATOM 554 CD GLU A 34 -5.449 3.856 2.617 1.00 0.00 C ATOM 555 OE1 GLU A 34 -5.644 3.718 1.390 1.00 0.00 O ATOM 556 OE2 GLU A 34 -6.373 3.980 3.447 1.00 0.00 O ATOM 0 H GLU A 34 -1.959 7.404 3.214 1.00 0.00 H new ATOM 0 HA GLU A 34 -1.904 4.655 4.303 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -3.903 5.999 2.904 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -3.088 5.102 1.638 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -3.491 3.001 2.737 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -4.020 3.793 4.208 1.00 0.00 H new ATOM 563 N PHE A 35 -0.915 3.803 1.848 1.00 0.00 N ATOM 564 CA PHE A 35 0.118 3.320 0.939 1.00 0.00 C ATOM 565 C PHE A 35 -0.413 3.172 -0.489 1.00 0.00 C ATOM 566 O PHE A 35 -1.622 3.113 -0.714 1.00 0.00 O ATOM 567 CB PHE A 35 0.682 1.975 1.423 1.00 0.00 C ATOM 568 CG PHE A 35 0.284 1.602 2.827 1.00 0.00 C ATOM 569 CD1 PHE A 35 -1.029 1.274 3.128 1.00 0.00 C ATOM 570 CD2 PHE A 35 1.225 1.578 3.845 1.00 0.00 C ATOM 571 CE1 PHE A 35 -1.396 0.931 4.415 1.00 0.00 C ATOM 572 CE2 PHE A 35 0.863 1.237 5.134 1.00 0.00 C ATOM 573 CZ PHE A 35 -0.449 0.912 5.419 1.00 0.00 C ATOM 0 H PHE A 35 -1.730 3.194 1.921 1.00 0.00 H new ATOM 0 HA PHE A 35 0.916 4.063 0.933 1.00 0.00 H new ATOM 0 HB2 PHE A 35 0.350 1.190 0.744 1.00 0.00 H new ATOM 0 HB3 PHE A 35 1.770 2.009 1.364 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -1.774 1.287 2.347 1.00 0.00 H new ATOM 0 HD2 PHE A 35 2.253 1.829 3.628 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -2.423 0.678 4.635 1.00 0.00 H new ATOM 0 HE2 PHE A 35 1.605 1.225 5.918 1.00 0.00 H new ATOM 0 HZ PHE A 35 -0.733 0.643 6.426 1.00 0.00 H new ATOM 583 N PRO A 36 0.504 3.088 -1.470 1.00 0.00 N ATOM 584 CA PRO A 36 0.162 2.920 -2.890 1.00 0.00 C ATOM 585 C PRO A 36 -0.526 1.584 -3.158 1.00 0.00 C ATOM 586 O PRO A 36 -0.543 0.705 -2.297 1.00 0.00 O ATOM 587 CB PRO A 36 1.516 2.975 -3.604 1.00 0.00 C ATOM 588 CG PRO A 36 2.512 2.604 -2.561 1.00 0.00 C ATOM 589 CD PRO A 36 1.964 3.129 -1.265 1.00 0.00 C ATOM 0 HA PRO A 36 -0.538 3.683 -3.231 1.00 0.00 H new ATOM 0 HB2 PRO A 36 1.548 2.283 -4.445 1.00 0.00 H new ATOM 0 HB3 PRO A 36 1.713 3.970 -4.003 1.00 0.00 H new ATOM 0 HG2 PRO A 36 2.649 1.523 -2.518 1.00 0.00 H new ATOM 0 HG3 PRO A 36 3.487 3.041 -2.779 1.00 0.00 H new ATOM 0 HD2 PRO A 36 2.269 2.511 -0.420 1.00 0.00 H new ATOM 0 HD3 PRO A 36 2.313 4.141 -1.062 1.00 0.00 H new ATOM 597 N GLY A 37 -1.095 1.432 -4.353 1.00 0.00 N ATOM 598 CA GLY A 37 -1.772 0.194 -4.688 1.00 0.00 C ATOM 599 C GLY A 37 -3.283 0.281 -4.611 1.00 0.00 C ATOM 600 O GLY A 37 -3.940 -0.453 -3.873 1.00 0.00 O ATOM 0 H GLY A 37 -1.098 2.139 -5.088 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -1.486 -0.104 -5.697 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -1.428 -0.591 -4.014 1.00 0.00 H new ATOM 604 N GLY A 38 -3.812 1.186 -5.402 1.00 0.00 N ATOM 605 CA GLY A 38 -5.243 1.406 -5.484 1.00 0.00 C ATOM 606 C GLY A 38 -5.738 1.355 -6.921 1.00 0.00 C ATOM 607 O GLY A 38 -5.189 2.041 -7.785 1.00 0.00 O ATOM 0 H GLY A 38 -3.263 1.794 -6.010 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -5.762 0.651 -4.893 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -5.488 2.375 -5.049 1.00 0.00 H new ATOM 611 N LYS A 39 -6.767 0.531 -7.175 1.00 0.00 N ATOM 612 CA LYS A 39 -7.356 0.362 -8.513 1.00 0.00 C ATOM 613 C LYS A 39 -7.070 -1.030 -9.063 1.00 0.00 C ATOM 614 O LYS A 39 -7.643 -1.433 -10.076 1.00 0.00 O ATOM 615 CB LYS A 39 -6.860 1.420 -9.507 1.00 0.00 C ATOM 616 CG LYS A 39 -7.621 1.413 -10.823 1.00 0.00 C ATOM 617 CD LYS A 39 -8.296 2.751 -11.088 1.00 0.00 C ATOM 618 CE LYS A 39 -9.749 2.740 -10.646 1.00 0.00 C ATOM 619 NZ LYS A 39 -9.927 3.357 -9.303 1.00 0.00 N ATOM 0 H LYS A 39 -7.215 -0.038 -6.457 1.00 0.00 H new ATOM 0 HA LYS A 39 -8.432 0.491 -8.395 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -6.947 2.406 -9.051 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -5.802 1.253 -9.707 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -6.936 1.183 -11.639 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -8.372 0.623 -10.805 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -7.760 3.540 -10.561 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -8.240 2.983 -12.151 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -10.354 3.278 -11.376 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -10.114 1.713 -10.625 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -10.933 3.329 -9.039 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -9.370 2.828 -8.602 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -9.603 4.345 -9.329 1.00 0.00 H new ATOM 633 N ILE A 40 -6.189 -1.767 -8.387 1.00 0.00 N ATOM 634 CA ILE A 40 -5.837 -3.125 -8.803 1.00 0.00 C ATOM 635 C ILE A 40 -7.079 -3.908 -9.197 1.00 0.00 C ATOM 636 O ILE A 40 -7.330 -4.140 -10.379 1.00 0.00 O ATOM 637 CB ILE A 40 -5.070 -3.888 -7.694 1.00 0.00 C ATOM 638 CG1 ILE A 40 -5.315 -5.400 -7.788 1.00 0.00 C ATOM 639 CG2 ILE A 40 -5.454 -3.368 -6.322 1.00 0.00 C ATOM 640 CD1 ILE A 40 -4.201 -6.233 -7.205 1.00 0.00 C ATOM 0 H ILE A 40 -5.705 -1.446 -7.548 1.00 0.00 H new ATOM 0 HA ILE A 40 -5.180 -3.032 -9.668 1.00 0.00 H new ATOM 0 HB ILE A 40 -4.005 -3.712 -7.844 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -6.245 -5.641 -7.273 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -5.451 -5.673 -8.835 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -4.904 -3.917 -5.558 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -5.210 -2.308 -6.253 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -6.524 -3.505 -6.168 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -4.445 -7.290 -7.308 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -3.273 -6.022 -7.736 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -4.079 -5.990 -6.150 1.00 0.00 H new ATOM 652 N GLU A 41 -7.838 -4.300 -8.184 1.00 0.00 N ATOM 653 CA GLU A 41 -9.079 -5.062 -8.347 1.00 0.00 C ATOM 654 C GLU A 41 -9.310 -5.480 -9.796 1.00 0.00 C ATOM 655 O GLU A 41 -8.989 -6.603 -10.184 1.00 0.00 O ATOM 656 CB GLU A 41 -10.272 -4.244 -7.837 1.00 0.00 C ATOM 657 CG GLU A 41 -10.133 -2.738 -8.045 1.00 0.00 C ATOM 658 CD GLU A 41 -11.262 -2.150 -8.869 1.00 0.00 C ATOM 659 OE1 GLU A 41 -11.173 -2.192 -10.114 1.00 0.00 O ATOM 660 OE2 GLU A 41 -12.236 -1.648 -8.269 1.00 0.00 O ATOM 0 H GLU A 41 -7.611 -4.098 -7.210 1.00 0.00 H new ATOM 0 HA GLU A 41 -8.983 -5.973 -7.756 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -11.175 -4.587 -8.341 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -10.406 -4.442 -6.773 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -10.103 -2.243 -7.074 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -9.183 -2.530 -8.538 1.00 0.00 H new ATOM 667 N MET A 42 -9.851 -4.560 -10.592 1.00 0.00 N ATOM 668 CA MET A 42 -10.115 -4.814 -12.011 1.00 0.00 C ATOM 669 C MET A 42 -10.567 -6.265 -12.246 1.00 0.00 C ATOM 670 O MET A 42 -11.319 -6.818 -11.444 1.00 0.00 O ATOM 671 CB MET A 42 -8.864 -4.487 -12.835 1.00 0.00 C ATOM 672 CG MET A 42 -9.173 -3.991 -14.240 1.00 0.00 C ATOM 673 SD MET A 42 -7.896 -4.445 -15.430 1.00 0.00 S ATOM 674 CE MET A 42 -8.826 -5.504 -16.535 1.00 0.00 C ATOM 0 H MET A 42 -10.117 -3.627 -10.278 1.00 0.00 H new ATOM 0 HA MET A 42 -10.931 -4.167 -12.334 1.00 0.00 H new ATOM 0 HB2 MET A 42 -8.282 -3.729 -12.311 1.00 0.00 H new ATOM 0 HB3 MET A 42 -8.240 -5.378 -12.902 1.00 0.00 H new ATOM 0 HG2 MET A 42 -10.129 -4.401 -14.564 1.00 0.00 H new ATOM 0 HG3 MET A 42 -9.280 -2.906 -14.223 1.00 0.00 H new ATOM 0 HE1 MET A 42 -8.307 -5.578 -17.491 1.00 0.00 H new ATOM 0 HE2 MET A 42 -8.919 -6.497 -16.095 1.00 0.00 H new ATOM 0 HE3 MET A 42 -9.819 -5.082 -16.693 1.00 0.00 H new ATOM 684 N GLY A 43 -10.112 -6.877 -13.342 1.00 0.00 N ATOM 685 CA GLY A 43 -10.494 -8.247 -13.635 1.00 0.00 C ATOM 686 C GLY A 43 -9.305 -9.182 -13.762 1.00 0.00 C ATOM 687 O GLY A 43 -9.450 -10.319 -14.210 1.00 0.00 O ATOM 0 H GLY A 43 -9.489 -6.448 -14.027 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -11.152 -8.611 -12.846 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -11.066 -8.268 -14.563 1.00 0.00 H new ATOM 691 N GLU A 44 -8.130 -8.706 -13.371 1.00 0.00 N ATOM 692 CA GLU A 44 -6.915 -9.512 -13.448 1.00 0.00 C ATOM 693 C GLU A 44 -6.945 -10.633 -12.412 1.00 0.00 C ATOM 694 O GLU A 44 -7.978 -10.884 -11.790 1.00 0.00 O ATOM 695 CB GLU A 44 -5.682 -8.631 -13.238 1.00 0.00 C ATOM 696 CG GLU A 44 -4.917 -8.342 -14.519 1.00 0.00 C ATOM 697 CD GLU A 44 -5.280 -7.000 -15.124 1.00 0.00 C ATOM 698 OE1 GLU A 44 -5.421 -6.023 -14.360 1.00 0.00 O ATOM 699 OE2 GLU A 44 -5.420 -6.928 -16.363 1.00 0.00 O ATOM 0 H GLU A 44 -7.991 -7.767 -12.997 1.00 0.00 H new ATOM 0 HA GLU A 44 -6.863 -9.961 -14.440 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -5.992 -7.687 -12.789 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -5.014 -9.118 -12.528 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -3.847 -8.366 -14.312 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -5.119 -9.130 -15.244 1.00 0.00 H new ATOM 706 N THR A 45 -5.810 -11.301 -12.222 1.00 0.00 N ATOM 707 CA THR A 45 -5.720 -12.384 -11.256 1.00 0.00 C ATOM 708 C THR A 45 -4.938 -11.923 -10.033 1.00 0.00 C ATOM 709 O THR A 45 -4.121 -11.012 -10.128 1.00 0.00 O ATOM 710 CB THR A 45 -5.039 -13.605 -11.888 1.00 0.00 C ATOM 711 OG1 THR A 45 -4.826 -13.400 -13.274 1.00 0.00 O ATOM 712 CG2 THR A 45 -5.833 -14.884 -11.733 1.00 0.00 C ATOM 0 H THR A 45 -4.943 -11.109 -12.725 1.00 0.00 H new ATOM 0 HA THR A 45 -6.727 -12.667 -10.949 1.00 0.00 H new ATOM 0 HB THR A 45 -4.096 -13.715 -11.353 1.00 0.00 H new ATOM 0 HG1 THR A 45 -4.389 -14.189 -13.658 1.00 0.00 H new ATOM 0 HG21 THR A 45 -5.293 -15.706 -12.203 1.00 0.00 H new ATOM 0 HG22 THR A 45 -5.973 -15.099 -10.674 1.00 0.00 H new ATOM 0 HG23 THR A 45 -6.806 -14.769 -12.211 1.00 0.00 H new ATOM 720 N PRO A 46 -5.162 -12.548 -8.867 1.00 0.00 N ATOM 721 CA PRO A 46 -4.458 -12.193 -7.635 1.00 0.00 C ATOM 722 C PRO A 46 -2.964 -11.978 -7.865 1.00 0.00 C ATOM 723 O PRO A 46 -2.303 -11.269 -7.105 1.00 0.00 O ATOM 724 CB PRO A 46 -4.698 -13.404 -6.715 1.00 0.00 C ATOM 725 CG PRO A 46 -5.422 -14.417 -7.545 1.00 0.00 C ATOM 726 CD PRO A 46 -6.099 -13.649 -8.641 1.00 0.00 C ATOM 0 HA PRO A 46 -4.819 -11.253 -7.217 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -3.755 -13.805 -6.345 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -5.288 -13.121 -5.843 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -4.729 -15.152 -7.955 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -6.150 -14.964 -6.945 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -6.240 -14.255 -9.536 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -7.084 -13.291 -8.340 1.00 0.00 H new ATOM 734 N GLU A 47 -2.435 -12.599 -8.918 1.00 0.00 N ATOM 735 CA GLU A 47 -1.021 -12.483 -9.246 1.00 0.00 C ATOM 736 C GLU A 47 -0.740 -11.300 -10.176 1.00 0.00 C ATOM 737 O GLU A 47 0.032 -10.407 -9.829 1.00 0.00 O ATOM 738 CB GLU A 47 -0.524 -13.777 -9.892 1.00 0.00 C ATOM 739 CG GLU A 47 -0.037 -14.809 -8.890 1.00 0.00 C ATOM 740 CD GLU A 47 -1.071 -15.125 -7.827 1.00 0.00 C ATOM 741 OE1 GLU A 47 -1.086 -14.431 -6.789 1.00 0.00 O ATOM 742 OE2 GLU A 47 -1.865 -16.067 -8.033 1.00 0.00 O ATOM 0 H GLU A 47 -2.968 -13.188 -9.558 1.00 0.00 H new ATOM 0 HA GLU A 47 -0.485 -12.306 -8.314 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -1.330 -14.210 -10.484 1.00 0.00 H new ATOM 0 HB3 GLU A 47 0.287 -13.541 -10.581 1.00 0.00 H new ATOM 0 HG2 GLU A 47 0.227 -15.725 -9.418 1.00 0.00 H new ATOM 0 HG3 GLU A 47 0.871 -14.444 -8.411 1.00 0.00 H new ATOM 749 N GLN A 48 -1.348 -11.301 -11.364 1.00 0.00 N ATOM 750 CA GLN A 48 -1.124 -10.227 -12.332 1.00 0.00 C ATOM 751 C GLN A 48 -1.962 -8.987 -12.026 1.00 0.00 C ATOM 752 O GLN A 48 -1.829 -7.964 -12.697 1.00 0.00 O ATOM 753 CB GLN A 48 -1.423 -10.720 -13.750 1.00 0.00 C ATOM 754 CG GLN A 48 -2.878 -11.100 -13.970 1.00 0.00 C ATOM 755 CD GLN A 48 -3.156 -11.541 -15.393 1.00 0.00 C ATOM 756 OE1 GLN A 48 -2.244 -11.929 -16.125 1.00 0.00 O ATOM 757 NE2 GLN A 48 -4.420 -11.483 -15.794 1.00 0.00 N ATOM 0 H GLN A 48 -1.993 -12.026 -11.676 1.00 0.00 H new ATOM 0 HA GLN A 48 -0.075 -9.941 -12.257 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -1.148 -9.941 -14.461 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -0.794 -11.584 -13.965 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -3.147 -11.904 -13.285 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -3.513 -10.248 -13.727 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -5.144 -11.155 -15.154 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -4.668 -11.766 -16.742 1.00 0.00 H new ATOM 766 N ALA A 49 -2.825 -9.079 -11.023 1.00 0.00 N ATOM 767 CA ALA A 49 -3.675 -7.956 -10.655 1.00 0.00 C ATOM 768 C ALA A 49 -2.849 -6.794 -10.114 1.00 0.00 C ATOM 769 O ALA A 49 -2.905 -5.684 -10.644 1.00 0.00 O ATOM 770 CB ALA A 49 -4.719 -8.400 -9.642 1.00 0.00 C ATOM 0 H ALA A 49 -2.954 -9.915 -10.453 1.00 0.00 H new ATOM 0 HA ALA A 49 -4.187 -7.605 -11.551 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -5.349 -7.552 -9.374 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -5.335 -9.187 -10.076 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -4.222 -8.779 -8.749 1.00 0.00 H new ATOM 776 N VAL A 50 -2.075 -7.052 -9.062 1.00 0.00 N ATOM 777 CA VAL A 50 -1.235 -6.012 -8.471 1.00 0.00 C ATOM 778 C VAL A 50 0.029 -5.792 -9.294 1.00 0.00 C ATOM 779 O VAL A 50 0.460 -4.657 -9.490 1.00 0.00 O ATOM 780 CB VAL A 50 -0.834 -6.325 -7.006 1.00 0.00 C ATOM 781 CG1 VAL A 50 -0.674 -7.819 -6.778 1.00 0.00 C ATOM 782 CG2 VAL A 50 0.445 -5.585 -6.632 1.00 0.00 C ATOM 0 H VAL A 50 -2.012 -7.962 -8.605 1.00 0.00 H new ATOM 0 HA VAL A 50 -1.840 -5.105 -8.471 1.00 0.00 H new ATOM 0 HB VAL A 50 -1.640 -5.977 -6.360 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -0.393 -8.001 -5.741 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -1.617 -8.323 -6.992 1.00 0.00 H new ATOM 0 HG13 VAL A 50 0.102 -8.207 -7.438 1.00 0.00 H new ATOM 0 HG21 VAL A 50 0.711 -5.817 -5.601 1.00 0.00 H new ATOM 0 HG22 VAL A 50 1.253 -5.897 -7.294 1.00 0.00 H new ATOM 0 HG23 VAL A 50 0.287 -4.511 -6.734 1.00 0.00 H new ATOM 792 N VAL A 51 0.628 -6.881 -9.764 1.00 0.00 N ATOM 793 CA VAL A 51 1.852 -6.794 -10.551 1.00 0.00 C ATOM 794 C VAL A 51 1.696 -5.789 -11.685 1.00 0.00 C ATOM 795 O VAL A 51 2.639 -5.080 -12.034 1.00 0.00 O ATOM 796 CB VAL A 51 2.252 -8.167 -11.131 1.00 0.00 C ATOM 797 CG1 VAL A 51 3.522 -8.055 -11.963 1.00 0.00 C ATOM 798 CG2 VAL A 51 2.433 -9.184 -10.013 1.00 0.00 C ATOM 0 H VAL A 51 0.287 -7.831 -9.614 1.00 0.00 H new ATOM 0 HA VAL A 51 2.642 -6.459 -9.879 1.00 0.00 H new ATOM 0 HB VAL A 51 1.449 -8.509 -11.784 1.00 0.00 H new ATOM 0 HG11 VAL A 51 3.784 -9.035 -12.361 1.00 0.00 H new ATOM 0 HG12 VAL A 51 3.357 -7.361 -12.787 1.00 0.00 H new ATOM 0 HG13 VAL A 51 4.336 -7.688 -11.337 1.00 0.00 H new ATOM 0 HG21 VAL A 51 2.715 -10.147 -10.439 1.00 0.00 H new ATOM 0 HG22 VAL A 51 3.216 -8.844 -9.335 1.00 0.00 H new ATOM 0 HG23 VAL A 51 1.498 -9.290 -9.463 1.00 0.00 H new ATOM 808 N ARG A 52 0.497 -5.727 -12.251 1.00 0.00 N ATOM 809 CA ARG A 52 0.222 -4.800 -13.338 1.00 0.00 C ATOM 810 C ARG A 52 0.003 -3.386 -12.810 1.00 0.00 C ATOM 811 O ARG A 52 0.636 -2.436 -13.270 1.00 0.00 O ATOM 812 CB ARG A 52 -0.998 -5.258 -14.139 1.00 0.00 C ATOM 813 CG ARG A 52 -1.137 -4.564 -15.484 1.00 0.00 C ATOM 814 CD ARG A 52 -1.736 -5.491 -16.529 1.00 0.00 C ATOM 815 NE ARG A 52 -0.893 -6.660 -16.772 1.00 0.00 N ATOM 816 CZ ARG A 52 -1.316 -7.766 -17.380 1.00 0.00 C ATOM 817 NH1 ARG A 52 -2.569 -7.858 -17.808 1.00 0.00 N ATOM 818 NH2 ARG A 52 -0.484 -8.783 -17.560 1.00 0.00 N ATOM 0 H ARG A 52 -0.297 -6.306 -11.976 1.00 0.00 H new ATOM 0 HA ARG A 52 1.091 -4.789 -13.996 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -0.934 -6.334 -14.300 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -1.898 -5.076 -13.551 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -1.767 -3.681 -15.376 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -0.159 -4.219 -15.820 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -2.723 -5.818 -16.201 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -1.875 -4.944 -17.462 1.00 0.00 H new ATOM 0 HE ARG A 52 0.077 -6.626 -16.457 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -3.213 -7.079 -17.672 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -2.888 -8.708 -18.273 1.00 0.00 H new ATOM 0 HH21 ARG A 52 0.480 -8.718 -17.233 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -0.808 -9.631 -18.026 1.00 0.00 H new ATOM 832 N GLU A 53 -0.893 -3.255 -11.838 1.00 0.00 N ATOM 833 CA GLU A 53 -1.193 -1.959 -11.244 1.00 0.00 C ATOM 834 C GLU A 53 0.044 -1.374 -10.569 1.00 0.00 C ATOM 835 O GLU A 53 0.149 -0.161 -10.388 1.00 0.00 O ATOM 836 CB GLU A 53 -2.332 -2.089 -10.230 1.00 0.00 C ATOM 837 CG GLU A 53 -3.540 -1.223 -10.553 1.00 0.00 C ATOM 838 CD GLU A 53 -3.195 0.251 -10.641 1.00 0.00 C ATOM 839 OE1 GLU A 53 -3.074 0.897 -9.578 1.00 0.00 O ATOM 840 OE2 GLU A 53 -3.049 0.760 -11.772 1.00 0.00 O ATOM 0 H GLU A 53 -1.424 -4.032 -11.445 1.00 0.00 H new ATOM 0 HA GLU A 53 -1.504 -1.283 -12.041 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -2.646 -3.132 -10.181 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -1.959 -1.822 -9.241 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -3.973 -1.548 -11.499 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -4.302 -1.369 -9.787 1.00 0.00 H new ATOM 847 N LEU A 54 0.980 -2.244 -10.197 1.00 0.00 N ATOM 848 CA LEU A 54 2.207 -1.810 -9.542 1.00 0.00 C ATOM 849 C LEU A 54 2.956 -0.809 -10.408 1.00 0.00 C ATOM 850 O LEU A 54 3.414 0.226 -9.924 1.00 0.00 O ATOM 851 CB LEU A 54 3.099 -3.014 -9.246 1.00 0.00 C ATOM 852 CG LEU A 54 3.598 -3.109 -7.806 1.00 0.00 C ATOM 853 CD1 LEU A 54 2.440 -2.985 -6.824 1.00 0.00 C ATOM 854 CD2 LEU A 54 4.343 -4.414 -7.601 1.00 0.00 C ATOM 0 H LEU A 54 0.911 -3.252 -10.339 1.00 0.00 H new ATOM 0 HA LEU A 54 1.941 -1.323 -8.604 1.00 0.00 H new ATOM 0 HB2 LEU A 54 2.547 -3.923 -9.484 1.00 0.00 H new ATOM 0 HB3 LEU A 54 3.961 -2.981 -9.912 1.00 0.00 H new ATOM 0 HG LEU A 54 4.284 -2.283 -7.618 1.00 0.00 H new ATOM 0 HD11 LEU A 54 2.819 -3.055 -5.804 1.00 0.00 H new ATOM 0 HD12 LEU A 54 1.947 -2.023 -6.962 1.00 0.00 H new ATOM 0 HD13 LEU A 54 1.725 -3.788 -7.002 1.00 0.00 H new ATOM 0 HD21 LEU A 54 4.696 -4.474 -6.571 1.00 0.00 H new ATOM 0 HD22 LEU A 54 3.675 -5.250 -7.805 1.00 0.00 H new ATOM 0 HD23 LEU A 54 5.195 -4.457 -8.279 1.00 0.00 H new ATOM 866 N GLN A 55 3.057 -1.109 -11.698 1.00 0.00 N ATOM 867 CA GLN A 55 3.728 -0.216 -12.628 1.00 0.00 C ATOM 868 C GLN A 55 2.980 1.109 -12.684 1.00 0.00 C ATOM 869 O GLN A 55 3.564 2.160 -12.948 1.00 0.00 O ATOM 870 CB GLN A 55 3.795 -0.843 -14.022 1.00 0.00 C ATOM 871 CG GLN A 55 4.473 0.041 -15.056 1.00 0.00 C ATOM 872 CD GLN A 55 4.108 -0.338 -16.478 1.00 0.00 C ATOM 873 OE1 GLN A 55 3.984 -1.519 -16.805 1.00 0.00 O ATOM 874 NE2 GLN A 55 3.935 0.663 -17.333 1.00 0.00 N ATOM 0 H GLN A 55 2.684 -1.960 -12.120 1.00 0.00 H new ATOM 0 HA GLN A 55 4.747 -0.043 -12.283 1.00 0.00 H new ATOM 0 HB2 GLN A 55 4.330 -1.790 -13.960 1.00 0.00 H new ATOM 0 HB3 GLN A 55 2.783 -1.070 -14.358 1.00 0.00 H new ATOM 0 HG2 GLN A 55 4.195 1.080 -14.878 1.00 0.00 H new ATOM 0 HG3 GLN A 55 5.554 -0.025 -14.932 1.00 0.00 H new ATOM 0 HE21 GLN A 55 4.048 1.627 -17.019 1.00 0.00 H new ATOM 0 HE22 GLN A 55 3.689 0.468 -18.304 1.00 0.00 H new ATOM 883 N GLU A 56 1.678 1.043 -12.418 1.00 0.00 N ATOM 884 CA GLU A 56 0.833 2.225 -12.419 1.00 0.00 C ATOM 885 C GLU A 56 1.029 3.036 -11.148 1.00 0.00 C ATOM 886 O GLU A 56 0.804 4.241 -11.139 1.00 0.00 O ATOM 887 CB GLU A 56 -0.637 1.826 -12.538 1.00 0.00 C ATOM 888 CG GLU A 56 -1.491 2.848 -13.270 1.00 0.00 C ATOM 889 CD GLU A 56 -2.616 3.395 -12.409 1.00 0.00 C ATOM 890 OE1 GLU A 56 -2.486 3.360 -11.167 1.00 0.00 O ATOM 891 OE2 GLU A 56 -3.627 3.858 -12.979 1.00 0.00 O ATOM 0 H GLU A 56 1.187 0.176 -12.198 1.00 0.00 H new ATOM 0 HA GLU A 56 1.117 2.836 -13.276 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -0.704 0.871 -13.058 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -1.045 1.674 -11.539 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -0.860 3.672 -13.602 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -1.913 2.389 -14.164 1.00 0.00 H new ATOM 898 N GLU A 57 1.425 2.366 -10.066 1.00 0.00 N ATOM 899 CA GLU A 57 1.622 3.049 -8.792 1.00 0.00 C ATOM 900 C GLU A 57 3.099 3.163 -8.415 1.00 0.00 C ATOM 901 O GLU A 57 3.430 3.624 -7.323 1.00 0.00 O ATOM 902 CB GLU A 57 0.840 2.352 -7.682 1.00 0.00 C ATOM 903 CG GLU A 57 -0.307 3.194 -7.154 1.00 0.00 C ATOM 904 CD GLU A 57 -1.663 2.622 -7.517 1.00 0.00 C ATOM 905 OE1 GLU A 57 -1.869 1.407 -7.315 1.00 0.00 O ATOM 906 OE2 GLU A 57 -2.520 3.389 -8.004 1.00 0.00 O ATOM 0 H GLU A 57 1.613 1.364 -10.047 1.00 0.00 H new ATOM 0 HA GLU A 57 1.242 4.063 -8.912 1.00 0.00 H new ATOM 0 HB2 GLU A 57 0.448 1.407 -8.058 1.00 0.00 H new ATOM 0 HB3 GLU A 57 1.517 2.113 -6.862 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -0.227 3.271 -6.070 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -0.224 4.205 -7.552 1.00 0.00 H new ATOM 913 N VAL A 58 3.981 2.759 -9.320 1.00 0.00 N ATOM 914 CA VAL A 58 5.414 2.839 -9.071 1.00 0.00 C ATOM 915 C VAL A 58 6.116 3.435 -10.277 1.00 0.00 C ATOM 916 O VAL A 58 6.968 4.312 -10.145 1.00 0.00 O ATOM 917 CB VAL A 58 6.019 1.454 -8.767 1.00 0.00 C ATOM 918 CG1 VAL A 58 7.475 1.584 -8.350 1.00 0.00 C ATOM 919 CG2 VAL A 58 5.220 0.741 -7.690 1.00 0.00 C ATOM 0 H VAL A 58 3.730 2.374 -10.231 1.00 0.00 H new ATOM 0 HA VAL A 58 5.560 3.476 -8.198 1.00 0.00 H new ATOM 0 HB VAL A 58 5.973 0.858 -9.678 1.00 0.00 H new ATOM 0 HG11 VAL A 58 7.883 0.595 -8.140 1.00 0.00 H new ATOM 0 HG12 VAL A 58 8.044 2.048 -9.156 1.00 0.00 H new ATOM 0 HG13 VAL A 58 7.543 2.202 -7.455 1.00 0.00 H new ATOM 0 HG21 VAL A 58 5.665 -0.234 -7.492 1.00 0.00 H new ATOM 0 HG22 VAL A 58 5.228 1.336 -6.777 1.00 0.00 H new ATOM 0 HG23 VAL A 58 4.192 0.609 -8.027 1.00 0.00 H new ATOM 929 N GLY A 59 5.729 2.964 -11.459 1.00 0.00 N ATOM 930 CA GLY A 59 6.300 3.462 -12.693 1.00 0.00 C ATOM 931 C GLY A 59 7.764 3.120 -12.877 1.00 0.00 C ATOM 932 O GLY A 59 8.204 2.813 -13.986 1.00 0.00 O ATOM 0 H GLY A 59 5.022 2.239 -11.582 1.00 0.00 H new ATOM 0 HA2 GLY A 59 5.735 3.057 -13.532 1.00 0.00 H new ATOM 0 HA3 GLY A 59 6.184 4.545 -12.724 1.00 0.00 H new ATOM 936 N ILE A 60 8.513 3.183 -11.798 1.00 0.00 N ATOM 937 CA ILE A 60 9.934 2.890 -11.830 1.00 0.00 C ATOM 938 C ILE A 60 10.180 1.389 -11.877 1.00 0.00 C ATOM 939 O ILE A 60 9.243 0.596 -11.959 1.00 0.00 O ATOM 940 CB ILE A 60 10.693 3.472 -10.611 1.00 0.00 C ATOM 941 CG1 ILE A 60 9.768 3.767 -9.429 1.00 0.00 C ATOM 942 CG2 ILE A 60 11.459 4.724 -11.007 1.00 0.00 C ATOM 943 CD1 ILE A 60 10.464 3.656 -8.090 1.00 0.00 C ATOM 0 H ILE A 60 8.159 3.437 -10.876 1.00 0.00 H new ATOM 0 HA ILE A 60 10.315 3.365 -12.734 1.00 0.00 H new ATOM 0 HB ILE A 60 11.398 2.708 -10.284 1.00 0.00 H new ATOM 0 HG12 ILE A 60 9.359 4.771 -9.537 1.00 0.00 H new ATOM 0 HG13 ILE A 60 8.926 3.075 -9.453 1.00 0.00 H new ATOM 0 HG21 ILE A 60 11.986 5.118 -10.138 1.00 0.00 H new ATOM 0 HG22 ILE A 60 12.179 4.478 -11.787 1.00 0.00 H new ATOM 0 HG23 ILE A 60 10.762 5.474 -11.380 1.00 0.00 H new ATOM 0 HD11 ILE A 60 9.755 3.877 -7.292 1.00 0.00 H new ATOM 0 HD12 ILE A 60 10.850 2.644 -7.963 1.00 0.00 H new ATOM 0 HD13 ILE A 60 11.289 4.367 -8.049 1.00 0.00 H new ATOM 955 N THR A 61 11.453 1.011 -11.831 1.00 0.00 N ATOM 956 CA THR A 61 11.844 -0.377 -11.868 1.00 0.00 C ATOM 957 C THR A 61 12.466 -0.782 -10.537 1.00 0.00 C ATOM 958 O THR A 61 13.674 -0.648 -10.345 1.00 0.00 O ATOM 959 CB THR A 61 12.859 -0.555 -12.982 1.00 0.00 C ATOM 960 OG1 THR A 61 13.618 0.630 -13.155 1.00 0.00 O ATOM 961 CG2 THR A 61 12.230 -0.891 -14.315 1.00 0.00 C ATOM 0 H THR A 61 12.235 1.663 -11.767 1.00 0.00 H new ATOM 0 HA THR A 61 10.971 -1.004 -12.047 1.00 0.00 H new ATOM 0 HB THR A 61 13.487 -1.391 -12.674 1.00 0.00 H new ATOM 0 HG1 THR A 61 14.269 0.499 -13.876 1.00 0.00 H new ATOM 0 HG21 THR A 61 13.011 -1.005 -15.067 1.00 0.00 H new ATOM 0 HG22 THR A 61 11.670 -1.822 -14.229 1.00 0.00 H new ATOM 0 HG23 THR A 61 11.555 -0.088 -14.611 1.00 0.00 H new ATOM 969 N PRO A 62 11.645 -1.235 -9.580 1.00 0.00 N ATOM 970 CA PRO A 62 12.092 -1.602 -8.256 1.00 0.00 C ATOM 971 C PRO A 62 12.008 -3.090 -7.962 1.00 0.00 C ATOM 972 O PRO A 62 11.043 -3.747 -8.354 1.00 0.00 O ATOM 973 CB PRO A 62 11.024 -0.884 -7.446 1.00 0.00 C ATOM 974 CG PRO A 62 9.764 -1.150 -8.212 1.00 0.00 C ATOM 975 CD PRO A 62 10.182 -1.366 -9.653 1.00 0.00 C ATOM 0 HA PRO A 62 13.137 -1.354 -8.070 1.00 0.00 H new ATOM 0 HB2 PRO A 62 10.964 -1.271 -6.429 1.00 0.00 H new ATOM 0 HB3 PRO A 62 11.229 0.184 -7.369 1.00 0.00 H new ATOM 0 HG2 PRO A 62 9.249 -2.027 -7.821 1.00 0.00 H new ATOM 0 HG3 PRO A 62 9.073 -0.311 -8.129 1.00 0.00 H new ATOM 0 HD2 PRO A 62 9.880 -2.346 -10.021 1.00 0.00 H new ATOM 0 HD3 PRO A 62 9.740 -0.625 -10.320 1.00 0.00 H new ATOM 983 N GLN A 63 12.967 -3.610 -7.199 1.00 0.00 N ATOM 984 CA GLN A 63 12.895 -5.003 -6.801 1.00 0.00 C ATOM 985 C GLN A 63 11.827 -5.056 -5.729 1.00 0.00 C ATOM 986 O GLN A 63 12.107 -5.008 -4.531 1.00 0.00 O ATOM 987 CB GLN A 63 14.236 -5.506 -6.266 1.00 0.00 C ATOM 988 CG GLN A 63 15.421 -5.057 -7.100 1.00 0.00 C ATOM 989 CD GLN A 63 16.751 -5.404 -6.460 1.00 0.00 C ATOM 990 OE1 GLN A 63 17.021 -5.028 -5.320 1.00 0.00 O ATOM 991 NE2 GLN A 63 17.590 -6.127 -7.193 1.00 0.00 N ATOM 0 H GLN A 63 13.780 -3.100 -6.854 1.00 0.00 H new ATOM 0 HA GLN A 63 12.656 -5.647 -7.647 1.00 0.00 H new ATOM 0 HB2 GLN A 63 14.366 -5.154 -5.243 1.00 0.00 H new ATOM 0 HB3 GLN A 63 14.219 -6.595 -6.228 1.00 0.00 H new ATOM 0 HG2 GLN A 63 15.364 -5.521 -8.085 1.00 0.00 H new ATOM 0 HG3 GLN A 63 15.366 -3.979 -7.252 1.00 0.00 H new ATOM 0 HE21 GLN A 63 17.325 -6.417 -8.134 1.00 0.00 H new ATOM 0 HE22 GLN A 63 18.499 -6.392 -6.815 1.00 0.00 H new ATOM 1000 N HIS A 64 10.592 -5.062 -6.197 1.00 0.00 N ATOM 1001 CA HIS A 64 9.431 -5.016 -5.331 1.00 0.00 C ATOM 1002 C HIS A 64 8.539 -6.235 -5.522 1.00 0.00 C ATOM 1003 O HIS A 64 8.174 -6.584 -6.644 1.00 0.00 O ATOM 1004 CB HIS A 64 8.682 -3.720 -5.660 1.00 0.00 C ATOM 1005 CG HIS A 64 7.228 -3.692 -5.280 1.00 0.00 C ATOM 1006 ND1 HIS A 64 6.673 -4.500 -4.312 1.00 0.00 N ATOM 1007 CD2 HIS A 64 6.210 -2.939 -5.763 1.00 0.00 C ATOM 1008 CE1 HIS A 64 5.379 -4.250 -4.219 1.00 0.00 C ATOM 1009 NE2 HIS A 64 5.073 -3.305 -5.087 1.00 0.00 N ATOM 0 H HIS A 64 10.367 -5.099 -7.191 1.00 0.00 H new ATOM 0 HA HIS A 64 9.736 -5.031 -4.285 1.00 0.00 H new ATOM 0 HB2 HIS A 64 9.186 -2.894 -5.158 1.00 0.00 H new ATOM 0 HB3 HIS A 64 8.762 -3.538 -6.732 1.00 0.00 H new ATOM 0 HD1 HIS A 64 7.182 -5.185 -3.754 1.00 0.00 H new ATOM 0 HD2 HIS A 64 6.280 -2.189 -6.537 1.00 0.00 H new ATOM 0 HE1 HIS A 64 4.689 -4.737 -3.546 1.00 0.00 H new ATOM 1018 N PHE A 65 8.200 -6.882 -4.412 1.00 0.00 N ATOM 1019 CA PHE A 65 7.364 -8.065 -4.446 1.00 0.00 C ATOM 1020 C PHE A 65 7.089 -8.570 -3.023 1.00 0.00 C ATOM 1021 O PHE A 65 6.844 -7.778 -2.115 1.00 0.00 O ATOM 1022 CB PHE A 65 8.072 -9.132 -5.277 1.00 0.00 C ATOM 1023 CG PHE A 65 7.145 -10.037 -6.043 1.00 0.00 C ATOM 1024 CD1 PHE A 65 5.857 -10.288 -5.590 1.00 0.00 C ATOM 1025 CD2 PHE A 65 7.563 -10.632 -7.223 1.00 0.00 C ATOM 1026 CE1 PHE A 65 5.007 -11.115 -6.299 1.00 0.00 C ATOM 1027 CE2 PHE A 65 6.716 -11.460 -7.936 1.00 0.00 C ATOM 1028 CZ PHE A 65 5.437 -11.701 -7.474 1.00 0.00 C ATOM 0 H PHE A 65 8.495 -6.602 -3.477 1.00 0.00 H new ATOM 0 HA PHE A 65 6.402 -7.829 -4.900 1.00 0.00 H new ATOM 0 HB2 PHE A 65 8.745 -8.641 -5.980 1.00 0.00 H new ATOM 0 HB3 PHE A 65 8.690 -9.740 -4.616 1.00 0.00 H new ATOM 0 HD1 PHE A 65 5.515 -9.832 -4.673 1.00 0.00 H new ATOM 0 HD2 PHE A 65 8.562 -10.447 -7.590 1.00 0.00 H new ATOM 0 HE1 PHE A 65 4.008 -11.303 -5.935 1.00 0.00 H new ATOM 0 HE2 PHE A 65 7.054 -11.918 -8.854 1.00 0.00 H new ATOM 0 HZ PHE A 65 4.774 -12.347 -8.030 1.00 0.00 H new ATOM 1038 N SER A 66 7.142 -9.887 -2.838 1.00 0.00 N ATOM 1039 CA SER A 66 6.921 -10.514 -1.538 1.00 0.00 C ATOM 1040 C SER A 66 5.578 -10.122 -0.935 1.00 0.00 C ATOM 1041 O SER A 66 4.953 -9.148 -1.352 1.00 0.00 O ATOM 1042 CB SER A 66 8.054 -10.149 -0.578 1.00 0.00 C ATOM 1043 OG SER A 66 8.955 -11.231 -0.419 1.00 0.00 O ATOM 0 H SER A 66 7.340 -10.550 -3.587 1.00 0.00 H new ATOM 0 HA SER A 66 6.909 -11.593 -1.693 1.00 0.00 H new ATOM 0 HB2 SER A 66 8.589 -9.278 -0.956 1.00 0.00 H new ATOM 0 HB3 SER A 66 7.639 -9.872 0.391 1.00 0.00 H new ATOM 0 HG SER A 66 9.671 -10.972 0.198 1.00 0.00 H new ATOM 1049 N LEU A 67 5.144 -10.896 0.055 1.00 0.00 N ATOM 1050 CA LEU A 67 3.878 -10.645 0.730 1.00 0.00 C ATOM 1051 C LEU A 67 4.086 -10.507 2.235 1.00 0.00 C ATOM 1052 O LEU A 67 4.383 -11.484 2.922 1.00 0.00 O ATOM 1053 CB LEU A 67 2.888 -11.774 0.437 1.00 0.00 C ATOM 1054 CG LEU A 67 1.570 -11.703 1.211 1.00 0.00 C ATOM 1055 CD1 LEU A 67 0.402 -12.101 0.322 1.00 0.00 C ATOM 1056 CD2 LEU A 67 1.628 -12.589 2.447 1.00 0.00 C ATOM 0 H LEU A 67 5.654 -11.706 0.408 1.00 0.00 H new ATOM 0 HA LEU A 67 3.469 -9.709 0.351 1.00 0.00 H new ATOM 0 HB2 LEU A 67 2.665 -11.772 -0.630 1.00 0.00 H new ATOM 0 HB3 LEU A 67 3.371 -12.726 0.660 1.00 0.00 H new ATOM 0 HG LEU A 67 1.418 -10.673 1.533 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -0.525 -12.044 0.892 1.00 0.00 H new ATOM 0 HD12 LEU A 67 0.346 -11.424 -0.530 1.00 0.00 H new ATOM 0 HD13 LEU A 67 0.547 -13.121 -0.034 1.00 0.00 H new ATOM 0 HD21 LEU A 67 0.682 -12.526 2.985 1.00 0.00 H new ATOM 0 HD22 LEU A 67 1.806 -13.622 2.147 1.00 0.00 H new ATOM 0 HD23 LEU A 67 2.437 -12.255 3.096 1.00 0.00 H new ATOM 1068 N PHE A 68 3.923 -9.289 2.741 1.00 0.00 N ATOM 1069 CA PHE A 68 4.088 -9.025 4.166 1.00 0.00 C ATOM 1070 C PHE A 68 2.862 -9.511 4.937 1.00 0.00 C ATOM 1071 O PHE A 68 2.982 -10.129 5.995 1.00 0.00 O ATOM 1072 CB PHE A 68 4.335 -7.521 4.392 1.00 0.00 C ATOM 1073 CG PHE A 68 3.526 -6.893 5.500 1.00 0.00 C ATOM 1074 CD1 PHE A 68 2.169 -6.665 5.343 1.00 0.00 C ATOM 1075 CD2 PHE A 68 4.130 -6.521 6.690 1.00 0.00 C ATOM 1076 CE1 PHE A 68 1.428 -6.079 6.351 1.00 0.00 C ATOM 1077 CE2 PHE A 68 3.393 -5.936 7.703 1.00 0.00 C ATOM 1078 CZ PHE A 68 2.040 -5.715 7.533 1.00 0.00 C ATOM 0 H PHE A 68 3.677 -8.469 2.186 1.00 0.00 H new ATOM 0 HA PHE A 68 4.954 -9.572 4.539 1.00 0.00 H new ATOM 0 HB2 PHE A 68 5.393 -7.372 4.608 1.00 0.00 H new ATOM 0 HB3 PHE A 68 4.121 -6.991 3.464 1.00 0.00 H new ATOM 0 HD1 PHE A 68 1.684 -6.949 4.421 1.00 0.00 H new ATOM 0 HD2 PHE A 68 5.188 -6.690 6.828 1.00 0.00 H new ATOM 0 HE1 PHE A 68 0.371 -5.906 6.214 1.00 0.00 H new ATOM 0 HE2 PHE A 68 3.875 -5.652 8.627 1.00 0.00 H new ATOM 0 HZ PHE A 68 1.463 -5.258 8.323 1.00 0.00 H new ATOM 1088 N GLU A 69 1.686 -9.227 4.390 1.00 0.00 N ATOM 1089 CA GLU A 69 0.431 -9.630 5.010 1.00 0.00 C ATOM 1090 C GLU A 69 -0.738 -9.357 4.071 1.00 0.00 C ATOM 1091 O GLU A 69 -0.608 -8.602 3.107 1.00 0.00 O ATOM 1092 CB GLU A 69 0.225 -8.887 6.331 1.00 0.00 C ATOM 1093 CG GLU A 69 -0.488 -9.714 7.388 1.00 0.00 C ATOM 1094 CD GLU A 69 -0.116 -9.302 8.799 1.00 0.00 C ATOM 1095 OE1 GLU A 69 1.095 -9.214 9.093 1.00 0.00 O ATOM 1096 OE2 GLU A 69 -1.037 -9.069 9.611 1.00 0.00 O ATOM 0 H GLU A 69 1.576 -8.717 3.514 1.00 0.00 H new ATOM 0 HA GLU A 69 0.477 -10.700 5.212 1.00 0.00 H new ATOM 0 HB2 GLU A 69 1.195 -8.575 6.718 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -0.349 -7.980 6.143 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -1.565 -9.614 7.256 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -0.245 -10.767 7.245 1.00 0.00 H new ATOM 1103 N LYS A 70 -1.880 -9.969 4.355 1.00 0.00 N ATOM 1104 CA LYS A 70 -3.066 -9.779 3.533 1.00 0.00 C ATOM 1105 C LYS A 70 -4.326 -9.758 4.393 1.00 0.00 C ATOM 1106 O LYS A 70 -4.687 -10.764 5.004 1.00 0.00 O ATOM 1107 CB LYS A 70 -3.168 -10.885 2.480 1.00 0.00 C ATOM 1108 CG LYS A 70 -3.320 -12.277 3.073 1.00 0.00 C ATOM 1109 CD LYS A 70 -3.053 -13.358 2.036 1.00 0.00 C ATOM 1110 CE LYS A 70 -4.290 -14.205 1.778 1.00 0.00 C ATOM 1111 NZ LYS A 70 -4.426 -14.565 0.339 1.00 0.00 N ATOM 0 H LYS A 70 -2.009 -10.599 5.146 1.00 0.00 H new ATOM 0 HA LYS A 70 -2.977 -8.817 3.028 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -4.020 -10.680 1.831 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -2.277 -10.862 1.853 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -2.630 -12.395 3.909 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -4.327 -12.395 3.472 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -2.727 -12.896 1.104 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -2.239 -13.997 2.377 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -4.239 -15.115 2.377 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -5.177 -13.660 2.101 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -5.281 -15.142 0.205 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -4.501 -13.698 -0.230 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -3.592 -15.107 0.036 1.00 0.00 H new ATOM 1125 N LEU A 71 -4.989 -8.608 4.437 1.00 0.00 N ATOM 1126 CA LEU A 71 -6.207 -8.460 5.224 1.00 0.00 C ATOM 1127 C LEU A 71 -7.440 -8.500 4.327 1.00 0.00 C ATOM 1128 O LEU A 71 -7.578 -7.693 3.407 1.00 0.00 O ATOM 1129 CB LEU A 71 -6.169 -7.148 6.012 1.00 0.00 C ATOM 1130 CG LEU A 71 -7.469 -6.779 6.729 1.00 0.00 C ATOM 1131 CD1 LEU A 71 -7.627 -7.600 7.999 1.00 0.00 C ATOM 1132 CD2 LEU A 71 -7.497 -5.291 7.046 1.00 0.00 C ATOM 0 H LEU A 71 -4.704 -7.766 3.938 1.00 0.00 H new ATOM 0 HA LEU A 71 -6.266 -9.293 5.925 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -5.370 -7.210 6.751 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -5.908 -6.340 5.328 1.00 0.00 H new ATOM 0 HG LEU A 71 -8.306 -7.005 6.068 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -8.557 -7.325 8.497 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -7.650 -8.660 7.746 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -6.787 -7.404 8.666 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -8.428 -5.045 7.556 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -6.654 -5.040 7.690 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -7.429 -4.720 6.120 1.00 0.00 H new ATOM 1144 N GLU A 72 -8.333 -9.445 4.600 1.00 0.00 N ATOM 1145 CA GLU A 72 -9.552 -9.593 3.821 1.00 0.00 C ATOM 1146 C GLU A 72 -10.783 -9.538 4.726 1.00 0.00 C ATOM 1147 O GLU A 72 -11.038 -10.459 5.501 1.00 0.00 O ATOM 1148 CB GLU A 72 -9.517 -10.914 3.042 1.00 0.00 C ATOM 1149 CG GLU A 72 -10.883 -11.404 2.593 1.00 0.00 C ATOM 1150 CD GLU A 72 -10.803 -12.364 1.422 1.00 0.00 C ATOM 1151 OE1 GLU A 72 -9.851 -12.249 0.623 1.00 0.00 O ATOM 1152 OE2 GLU A 72 -11.693 -13.233 1.305 1.00 0.00 O ATOM 0 H GLU A 72 -8.233 -10.121 5.358 1.00 0.00 H new ATOM 0 HA GLU A 72 -9.616 -8.767 3.113 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -8.881 -10.790 2.166 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -9.055 -11.679 3.666 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -11.381 -11.897 3.428 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -11.498 -10.548 2.315 1.00 0.00 H new ATOM 1159 N TYR A 73 -11.541 -8.453 4.615 1.00 0.00 N ATOM 1160 CA TYR A 73 -12.747 -8.275 5.415 1.00 0.00 C ATOM 1161 C TYR A 73 -13.851 -7.630 4.586 1.00 0.00 C ATOM 1162 O TYR A 73 -13.577 -6.889 3.642 1.00 0.00 O ATOM 1163 CB TYR A 73 -12.448 -7.421 6.650 1.00 0.00 C ATOM 1164 CG TYR A 73 -12.086 -5.989 6.327 1.00 0.00 C ATOM 1165 CD1 TYR A 73 -10.958 -5.690 5.573 1.00 0.00 C ATOM 1166 CD2 TYR A 73 -12.872 -4.936 6.777 1.00 0.00 C ATOM 1167 CE1 TYR A 73 -10.624 -4.382 5.276 1.00 0.00 C ATOM 1168 CE2 TYR A 73 -12.544 -3.625 6.485 1.00 0.00 C ATOM 1169 CZ TYR A 73 -11.420 -3.354 5.735 1.00 0.00 C ATOM 1170 OH TYR A 73 -11.091 -2.050 5.442 1.00 0.00 O ATOM 0 H TYR A 73 -11.341 -7.682 3.978 1.00 0.00 H new ATOM 0 HA TYR A 73 -13.088 -9.257 5.742 1.00 0.00 H new ATOM 0 HB2 TYR A 73 -13.320 -7.427 7.304 1.00 0.00 H new ATOM 0 HB3 TYR A 73 -11.629 -7.877 7.206 1.00 0.00 H new ATOM 0 HD1 TYR A 73 -10.332 -6.493 5.213 1.00 0.00 H new ATOM 0 HD2 TYR A 73 -13.754 -5.145 7.365 1.00 0.00 H new ATOM 0 HE1 TYR A 73 -9.744 -4.166 4.688 1.00 0.00 H new ATOM 0 HE2 TYR A 73 -13.165 -2.817 6.843 1.00 0.00 H new ATOM 0 HH TYR A 73 -11.755 -1.448 5.839 1.00 0.00 H new ATOM 1180 N GLU A 74 -15.100 -7.914 4.940 1.00 0.00 N ATOM 1181 CA GLU A 74 -16.239 -7.354 4.219 1.00 0.00 C ATOM 1182 C GLU A 74 -17.136 -6.541 5.145 1.00 0.00 C ATOM 1183 O GLU A 74 -17.702 -7.067 6.104 1.00 0.00 O ATOM 1184 CB GLU A 74 -17.053 -8.461 3.545 1.00 0.00 C ATOM 1185 CG GLU A 74 -17.327 -9.655 4.443 1.00 0.00 C ATOM 1186 CD GLU A 74 -17.570 -10.930 3.661 1.00 0.00 C ATOM 1187 OE1 GLU A 74 -17.958 -10.836 2.478 1.00 0.00 O ATOM 1188 OE2 GLU A 74 -17.371 -12.025 4.230 1.00 0.00 O ATOM 0 H GLU A 74 -15.349 -8.525 5.718 1.00 0.00 H new ATOM 0 HA GLU A 74 -15.844 -6.688 3.452 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -18.003 -8.046 3.208 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -16.520 -8.801 2.657 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -16.481 -9.801 5.115 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -18.196 -9.444 5.066 1.00 0.00 H new ATOM 1195 N PHE A 75 -17.267 -5.258 4.839 1.00 0.00 N ATOM 1196 CA PHE A 75 -18.096 -4.356 5.615 1.00 0.00 C ATOM 1197 C PHE A 75 -19.576 -4.692 5.416 1.00 0.00 C ATOM 1198 O PHE A 75 -19.932 -5.403 4.480 1.00 0.00 O ATOM 1199 CB PHE A 75 -17.813 -2.911 5.202 1.00 0.00 C ATOM 1200 CG PHE A 75 -16.858 -2.185 6.114 1.00 0.00 C ATOM 1201 CD1 PHE A 75 -16.890 -2.379 7.487 1.00 0.00 C ATOM 1202 CD2 PHE A 75 -15.927 -1.302 5.588 1.00 0.00 C ATOM 1203 CE1 PHE A 75 -16.010 -1.708 8.316 1.00 0.00 C ATOM 1204 CE2 PHE A 75 -15.046 -0.628 6.413 1.00 0.00 C ATOM 1205 CZ PHE A 75 -15.088 -0.831 7.779 1.00 0.00 C ATOM 0 H PHE A 75 -16.801 -4.817 4.046 1.00 0.00 H new ATOM 0 HA PHE A 75 -17.858 -4.473 6.672 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -17.407 -2.907 4.191 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -18.755 -2.363 5.169 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -17.610 -3.062 7.913 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -15.890 -1.139 4.521 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -16.044 -1.870 9.383 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -14.326 0.057 5.990 1.00 0.00 H new ATOM 0 HZ PHE A 75 -14.401 -0.305 8.426 1.00 0.00 H new ATOM 1215 N PRO A 76 -20.455 -4.190 6.302 1.00 0.00 N ATOM 1216 CA PRO A 76 -21.897 -4.440 6.227 1.00 0.00 C ATOM 1217 C PRO A 76 -22.472 -4.110 4.855 1.00 0.00 C ATOM 1218 O PRO A 76 -23.007 -3.023 4.638 1.00 0.00 O ATOM 1219 CB PRO A 76 -22.494 -3.513 7.298 1.00 0.00 C ATOM 1220 CG PRO A 76 -21.391 -2.581 7.675 1.00 0.00 C ATOM 1221 CD PRO A 76 -20.116 -3.333 7.437 1.00 0.00 C ATOM 0 HA PRO A 76 -22.129 -5.493 6.389 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -23.354 -2.967 6.910 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -22.840 -4.082 8.161 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -21.426 -1.672 7.075 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -21.476 -2.277 8.718 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -19.288 -2.663 7.205 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -19.820 -3.915 8.310 1.00 0.00 H new ATOM 1229 N ASP A 77 -22.344 -5.069 3.939 1.00 0.00 N ATOM 1230 CA ASP A 77 -22.835 -4.938 2.560 1.00 0.00 C ATOM 1231 C ASP A 77 -21.714 -4.532 1.606 1.00 0.00 C ATOM 1232 O ASP A 77 -21.969 -4.133 0.470 1.00 0.00 O ATOM 1233 CB ASP A 77 -23.990 -3.932 2.465 1.00 0.00 C ATOM 1234 CG ASP A 77 -24.898 -4.205 1.281 1.00 0.00 C ATOM 1235 OD1 ASP A 77 -25.610 -5.231 1.305 1.00 0.00 O ATOM 1236 OD2 ASP A 77 -24.897 -3.393 0.333 1.00 0.00 O ATOM 0 H ASP A 77 -21.895 -5.965 4.130 1.00 0.00 H new ATOM 0 HA ASP A 77 -23.207 -5.919 2.263 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -24.575 -3.967 3.384 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -23.584 -2.924 2.383 1.00 0.00 H new ATOM 1241 N ARG A 78 -20.472 -4.643 2.070 1.00 0.00 N ATOM 1242 CA ARG A 78 -19.316 -4.294 1.252 1.00 0.00 C ATOM 1243 C ARG A 78 -18.208 -5.332 1.414 1.00 0.00 C ATOM 1244 O ARG A 78 -18.039 -5.909 2.487 1.00 0.00 O ATOM 1245 CB ARG A 78 -18.796 -2.907 1.634 1.00 0.00 C ATOM 1246 CG ARG A 78 -17.753 -2.358 0.671 1.00 0.00 C ATOM 1247 CD ARG A 78 -16.457 -2.005 1.388 1.00 0.00 C ATOM 1248 NE ARG A 78 -15.884 -0.750 0.905 1.00 0.00 N ATOM 1249 CZ ARG A 78 -14.794 -0.185 1.420 1.00 0.00 C ATOM 1250 NH1 ARG A 78 -14.159 -0.757 2.435 1.00 0.00 N ATOM 1251 NH2 ARG A 78 -14.336 0.955 0.920 1.00 0.00 N ATOM 0 H ARG A 78 -20.241 -4.972 3.008 1.00 0.00 H new ATOM 0 HA ARG A 78 -19.627 -4.280 0.207 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -19.636 -2.214 1.680 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -18.366 -2.953 2.634 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -17.550 -3.096 -0.106 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -18.147 -1.472 0.174 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -16.645 -1.928 2.459 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -15.735 -2.810 1.248 1.00 0.00 H new ATOM 0 HE ARG A 78 -16.347 -0.279 0.127 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -14.506 -1.634 2.824 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -13.324 -0.320 2.826 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -14.819 1.400 0.140 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -13.501 1.386 1.316 1.00 0.00 H new ATOM 1265 N HIS A 79 -17.453 -5.559 0.345 1.00 0.00 N ATOM 1266 CA HIS A 79 -16.359 -6.523 0.372 1.00 0.00 C ATOM 1267 C HIS A 79 -15.038 -5.843 0.028 1.00 0.00 C ATOM 1268 O HIS A 79 -14.708 -5.665 -1.146 1.00 0.00 O ATOM 1269 CB HIS A 79 -16.630 -7.665 -0.608 1.00 0.00 C ATOM 1270 CG HIS A 79 -16.092 -8.987 -0.150 1.00 0.00 C ATOM 1271 ND1 HIS A 79 -15.115 -9.108 0.815 1.00 0.00 N ATOM 1272 CD2 HIS A 79 -16.401 -10.249 -0.531 1.00 0.00 C ATOM 1273 CE1 HIS A 79 -14.847 -10.387 1.008 1.00 0.00 C ATOM 1274 NE2 HIS A 79 -15.613 -11.100 0.204 1.00 0.00 N ATOM 0 H HIS A 79 -17.578 -5.089 -0.551 1.00 0.00 H new ATOM 0 HA HIS A 79 -16.289 -6.933 1.380 1.00 0.00 H new ATOM 0 HB2 HIS A 79 -17.705 -7.753 -0.762 1.00 0.00 H new ATOM 0 HB3 HIS A 79 -16.189 -7.417 -1.573 1.00 0.00 H new ATOM 0 HD1 HIS A 79 -14.669 -8.332 1.303 1.00 0.00 H new ATOM 0 HD2 HIS A 79 -17.131 -10.533 -1.274 1.00 0.00 H new ATOM 0 HE1 HIS A 79 -14.124 -10.782 1.706 1.00 0.00 H new ATOM 1283 N ILE A 80 -14.290 -5.456 1.055 1.00 0.00 N ATOM 1284 CA ILE A 80 -13.014 -4.789 0.861 1.00 0.00 C ATOM 1285 C ILE A 80 -11.848 -5.748 1.096 1.00 0.00 C ATOM 1286 O ILE A 80 -11.639 -6.231 2.208 1.00 0.00 O ATOM 1287 CB ILE A 80 -12.880 -3.570 1.801 1.00 0.00 C ATOM 1288 CG1 ILE A 80 -11.450 -3.038 1.788 1.00 0.00 C ATOM 1289 CG2 ILE A 80 -13.297 -3.936 3.218 1.00 0.00 C ATOM 1290 CD1 ILE A 80 -11.361 -1.529 1.844 1.00 0.00 C ATOM 0 H ILE A 80 -14.549 -5.595 2.032 1.00 0.00 H new ATOM 0 HA ILE A 80 -12.981 -4.445 -0.173 1.00 0.00 H new ATOM 0 HB ILE A 80 -13.544 -2.785 1.439 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -10.909 -3.457 2.636 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -10.949 -3.389 0.886 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -13.195 -3.064 3.864 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -14.335 -4.268 3.217 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -12.660 -4.739 3.589 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -10.314 -1.226 1.831 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -11.873 -1.102 0.982 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -11.831 -1.171 2.760 1.00 0.00 H new ATOM 1302 N THR A 81 -11.089 -6.010 0.036 1.00 0.00 N ATOM 1303 CA THR A 81 -9.939 -6.899 0.115 1.00 0.00 C ATOM 1304 C THR A 81 -8.644 -6.094 0.044 1.00 0.00 C ATOM 1305 O THR A 81 -8.387 -5.409 -0.944 1.00 0.00 O ATOM 1306 CB THR A 81 -9.983 -7.922 -1.024 1.00 0.00 C ATOM 1307 OG1 THR A 81 -11.005 -7.598 -1.951 1.00 0.00 O ATOM 1308 CG2 THR A 81 -10.231 -9.336 -0.548 1.00 0.00 C ATOM 0 H THR A 81 -11.252 -5.616 -0.891 1.00 0.00 H new ATOM 0 HA THR A 81 -9.972 -7.429 1.067 1.00 0.00 H new ATOM 0 HB THR A 81 -8.998 -7.878 -1.489 1.00 0.00 H new ATOM 0 HG1 THR A 81 -11.234 -8.393 -2.476 1.00 0.00 H new ATOM 0 HG21 THR A 81 -10.250 -10.010 -1.404 1.00 0.00 H new ATOM 0 HG22 THR A 81 -9.434 -9.636 0.132 1.00 0.00 H new ATOM 0 HG23 THR A 81 -11.188 -9.382 -0.028 1.00 0.00 H new ATOM 1316 N LEU A 82 -7.834 -6.173 1.095 1.00 0.00 N ATOM 1317 CA LEU A 82 -6.575 -5.436 1.134 1.00 0.00 C ATOM 1318 C LEU A 82 -5.380 -6.377 1.245 1.00 0.00 C ATOM 1319 O LEU A 82 -5.206 -7.060 2.254 1.00 0.00 O ATOM 1320 CB LEU A 82 -6.572 -4.459 2.311 1.00 0.00 C ATOM 1321 CG LEU A 82 -7.594 -3.325 2.216 1.00 0.00 C ATOM 1322 CD1 LEU A 82 -7.950 -2.813 3.603 1.00 0.00 C ATOM 1323 CD2 LEU A 82 -7.058 -2.195 1.352 1.00 0.00 C ATOM 0 H LEU A 82 -8.024 -6.735 1.925 1.00 0.00 H new ATOM 0 HA LEU A 82 -6.487 -4.882 0.199 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -6.758 -5.018 3.228 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -5.577 -4.024 2.399 1.00 0.00 H new ATOM 0 HG LEU A 82 -8.499 -3.714 1.749 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -8.678 -2.006 3.517 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -8.376 -3.625 4.192 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -7.052 -2.440 4.095 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -7.799 -1.397 1.296 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -6.139 -1.807 1.790 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -6.852 -2.570 0.349 1.00 0.00 H new ATOM 1335 N TRP A 83 -4.552 -6.396 0.203 1.00 0.00 N ATOM 1336 CA TRP A 83 -3.364 -7.239 0.188 1.00 0.00 C ATOM 1337 C TRP A 83 -2.117 -6.395 0.414 1.00 0.00 C ATOM 1338 O TRP A 83 -1.850 -5.454 -0.333 1.00 0.00 O ATOM 1339 CB TRP A 83 -3.247 -7.983 -1.145 1.00 0.00 C ATOM 1340 CG TRP A 83 -4.359 -8.956 -1.389 1.00 0.00 C ATOM 1341 CD1 TRP A 83 -5.652 -8.842 -0.970 1.00 0.00 C ATOM 1342 CD2 TRP A 83 -4.277 -10.191 -2.108 1.00 0.00 C ATOM 1343 NE1 TRP A 83 -6.380 -9.929 -1.386 1.00 0.00 N ATOM 1344 CE2 TRP A 83 -5.559 -10.773 -2.087 1.00 0.00 C ATOM 1345 CE3 TRP A 83 -3.244 -10.863 -2.771 1.00 0.00 C ATOM 1346 CZ2 TRP A 83 -5.834 -11.992 -2.700 1.00 0.00 C ATOM 1347 CZ3 TRP A 83 -3.519 -12.073 -3.379 1.00 0.00 C ATOM 1348 CH2 TRP A 83 -4.805 -12.627 -3.340 1.00 0.00 C ATOM 0 H TRP A 83 -4.684 -5.837 -0.640 1.00 0.00 H new ATOM 0 HA TRP A 83 -3.454 -7.970 0.992 1.00 0.00 H new ATOM 0 HB2 TRP A 83 -3.227 -7.256 -1.957 1.00 0.00 H new ATOM 0 HB3 TRP A 83 -2.297 -8.516 -1.172 1.00 0.00 H new ATOM 0 HD1 TRP A 83 -6.046 -8.017 -0.395 1.00 0.00 H new ATOM 0 HE1 TRP A 83 -7.371 -10.083 -1.203 1.00 0.00 H new ATOM 0 HE3 TRP A 83 -2.250 -10.443 -2.807 1.00 0.00 H new ATOM 0 HZ2 TRP A 83 -6.825 -12.421 -2.671 1.00 0.00 H new ATOM 0 HZ3 TRP A 83 -2.729 -12.601 -3.893 1.00 0.00 H new ATOM 0 HH2 TRP A 83 -4.988 -13.575 -3.825 1.00 0.00 H new ATOM 1359 N PHE A 84 -1.357 -6.731 1.449 1.00 0.00 N ATOM 1360 CA PHE A 84 -0.139 -5.992 1.766 1.00 0.00 C ATOM 1361 C PHE A 84 1.104 -6.771 1.332 1.00 0.00 C ATOM 1362 O PHE A 84 1.443 -7.796 1.921 1.00 0.00 O ATOM 1363 CB PHE A 84 -0.068 -5.681 3.268 1.00 0.00 C ATOM 1364 CG PHE A 84 -0.912 -4.508 3.702 1.00 0.00 C ATOM 1365 CD1 PHE A 84 -2.037 -4.132 2.982 1.00 0.00 C ATOM 1366 CD2 PHE A 84 -0.578 -3.780 4.838 1.00 0.00 C ATOM 1367 CE1 PHE A 84 -2.809 -3.059 3.383 1.00 0.00 C ATOM 1368 CE2 PHE A 84 -1.348 -2.706 5.241 1.00 0.00 C ATOM 1369 CZ PHE A 84 -2.465 -2.345 4.514 1.00 0.00 C ATOM 0 H PHE A 84 -1.560 -7.506 2.081 1.00 0.00 H new ATOM 0 HA PHE A 84 -0.167 -5.052 1.214 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -0.381 -6.564 3.825 1.00 0.00 H new ATOM 0 HB3 PHE A 84 0.970 -5.486 3.538 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -2.313 -4.685 2.097 1.00 0.00 H new ATOM 0 HD2 PHE A 84 0.294 -4.057 5.412 1.00 0.00 H new ATOM 0 HE1 PHE A 84 -3.682 -2.778 2.812 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -1.076 -2.149 6.125 1.00 0.00 H new ATOM 0 HZ PHE A 84 -3.068 -1.506 4.829 1.00 0.00 H new ATOM 1379 N TRP A 85 1.778 -6.273 0.296 1.00 0.00 N ATOM 1380 CA TRP A 85 2.985 -6.915 -0.223 1.00 0.00 C ATOM 1381 C TRP A 85 4.235 -6.290 0.392 1.00 0.00 C ATOM 1382 O TRP A 85 4.243 -5.104 0.722 1.00 0.00 O ATOM 1383 CB TRP A 85 3.032 -6.799 -1.748 1.00 0.00 C ATOM 1384 CG TRP A 85 1.812 -7.349 -2.423 1.00 0.00 C ATOM 1385 CD1 TRP A 85 0.580 -6.765 -2.491 1.00 0.00 C ATOM 1386 CD2 TRP A 85 1.705 -8.595 -3.122 1.00 0.00 C ATOM 1387 NE1 TRP A 85 -0.286 -7.570 -3.190 1.00 0.00 N ATOM 1388 CE2 TRP A 85 0.380 -8.700 -3.587 1.00 0.00 C ATOM 1389 CE3 TRP A 85 2.600 -9.634 -3.400 1.00 0.00 C ATOM 1390 CZ2 TRP A 85 -0.070 -9.800 -4.314 1.00 0.00 C ATOM 1391 CZ3 TRP A 85 2.151 -10.723 -4.121 1.00 0.00 C ATOM 1392 CH2 TRP A 85 0.827 -10.799 -4.572 1.00 0.00 C ATOM 0 H TRP A 85 1.508 -5.425 -0.202 1.00 0.00 H new ATOM 0 HA TRP A 85 2.958 -7.970 0.050 1.00 0.00 H new ATOM 0 HB2 TRP A 85 3.149 -5.751 -2.022 1.00 0.00 H new ATOM 0 HB3 TRP A 85 3.912 -7.325 -2.118 1.00 0.00 H new ATOM 0 HD1 TRP A 85 0.324 -5.809 -2.058 1.00 0.00 H new ATOM 0 HE1 TRP A 85 -1.266 -7.361 -3.382 1.00 0.00 H new ATOM 0 HE3 TRP A 85 3.623 -9.585 -3.057 1.00 0.00 H new ATOM 0 HZ2 TRP A 85 -1.091 -9.861 -4.661 1.00 0.00 H new ATOM 0 HZ3 TRP A 85 2.833 -11.531 -4.341 1.00 0.00 H new ATOM 0 HH2 TRP A 85 0.508 -11.664 -5.135 1.00 0.00 H new ATOM 1403 N LEU A 86 5.289 -7.091 0.557 1.00 0.00 N ATOM 1404 CA LEU A 86 6.526 -6.591 1.151 1.00 0.00 C ATOM 1405 C LEU A 86 7.585 -6.297 0.090 1.00 0.00 C ATOM 1406 O LEU A 86 8.245 -7.199 -0.424 1.00 0.00 O ATOM 1407 CB LEU A 86 7.067 -7.593 2.172 1.00 0.00 C ATOM 1408 CG LEU A 86 8.375 -7.193 2.863 1.00 0.00 C ATOM 1409 CD1 LEU A 86 9.567 -7.477 1.961 1.00 0.00 C ATOM 1410 CD2 LEU A 86 8.346 -5.725 3.266 1.00 0.00 C ATOM 0 H LEU A 86 5.310 -8.076 0.291 1.00 0.00 H new ATOM 0 HA LEU A 86 6.293 -5.654 1.656 1.00 0.00 H new ATOM 0 HB2 LEU A 86 6.307 -7.752 2.937 1.00 0.00 H new ATOM 0 HB3 LEU A 86 7.219 -8.549 1.671 1.00 0.00 H new ATOM 0 HG LEU A 86 8.479 -7.793 3.767 1.00 0.00 H new ATOM 0 HD11 LEU A 86 10.486 -7.186 2.470 1.00 0.00 H new ATOM 0 HD12 LEU A 86 9.602 -8.541 1.729 1.00 0.00 H new ATOM 0 HD13 LEU A 86 9.468 -6.907 1.037 1.00 0.00 H new ATOM 0 HD21 LEU A 86 9.284 -5.463 3.755 1.00 0.00 H new ATOM 0 HD22 LEU A 86 8.214 -5.107 2.378 1.00 0.00 H new ATOM 0 HD23 LEU A 86 7.518 -5.553 3.954 1.00 0.00 H new ATOM 1422 N VAL A 87 7.746 -5.016 -0.201 1.00 0.00 N ATOM 1423 CA VAL A 87 8.720 -4.534 -1.176 1.00 0.00 C ATOM 1424 C VAL A 87 10.101 -4.494 -0.574 1.00 0.00 C ATOM 1425 O VAL A 87 10.246 -4.244 0.621 1.00 0.00 O ATOM 1426 CB VAL A 87 8.367 -3.131 -1.644 1.00 0.00 C ATOM 1427 CG1 VAL A 87 9.214 -2.722 -2.836 1.00 0.00 C ATOM 1428 CG2 VAL A 87 6.883 -3.058 -1.965 1.00 0.00 C ATOM 0 H VAL A 87 7.201 -4.272 0.235 1.00 0.00 H new ATOM 0 HA VAL A 87 8.701 -5.223 -2.021 1.00 0.00 H new ATOM 0 HB VAL A 87 8.584 -2.426 -0.842 1.00 0.00 H new ATOM 0 HG11 VAL A 87 8.940 -1.715 -3.149 1.00 0.00 H new ATOM 0 HG12 VAL A 87 10.268 -2.741 -2.557 1.00 0.00 H new ATOM 0 HG13 VAL A 87 9.044 -3.416 -3.659 1.00 0.00 H new ATOM 0 HG21 VAL A 87 6.632 -2.052 -2.300 1.00 0.00 H new ATOM 0 HG22 VAL A 87 6.646 -3.773 -2.753 1.00 0.00 H new ATOM 0 HG23 VAL A 87 6.305 -3.297 -1.072 1.00 0.00 H new ATOM 1438 N GLU A 88 11.120 -4.768 -1.378 1.00 0.00 N ATOM 1439 CA GLU A 88 12.473 -4.773 -0.839 1.00 0.00 C ATOM 1440 C GLU A 88 13.384 -3.686 -1.418 1.00 0.00 C ATOM 1441 O GLU A 88 14.375 -3.322 -0.784 1.00 0.00 O ATOM 1442 CB GLU A 88 13.121 -6.147 -1.035 1.00 0.00 C ATOM 1443 CG GLU A 88 12.131 -7.300 -1.033 1.00 0.00 C ATOM 1444 CD GLU A 88 12.803 -8.646 -1.228 1.00 0.00 C ATOM 1445 OE1 GLU A 88 13.281 -8.913 -2.350 1.00 0.00 O ATOM 1446 OE2 GLU A 88 12.850 -9.431 -0.259 1.00 0.00 O ATOM 0 H GLU A 88 11.042 -4.983 -2.372 1.00 0.00 H new ATOM 0 HA GLU A 88 12.365 -4.550 0.223 1.00 0.00 H new ATOM 0 HB2 GLU A 88 13.665 -6.150 -1.979 1.00 0.00 H new ATOM 0 HB3 GLU A 88 13.854 -6.309 -0.244 1.00 0.00 H new ATOM 0 HG2 GLU A 88 11.585 -7.304 -0.089 1.00 0.00 H new ATOM 0 HG3 GLU A 88 11.398 -7.146 -1.825 1.00 0.00 H new ATOM 1453 N ARG A 89 13.086 -3.173 -2.609 1.00 0.00 N ATOM 1454 CA ARG A 89 13.942 -2.150 -3.204 1.00 0.00 C ATOM 1455 C ARG A 89 13.225 -1.400 -4.321 1.00 0.00 C ATOM 1456 O ARG A 89 12.252 -1.896 -4.884 1.00 0.00 O ATOM 1457 CB ARG A 89 15.232 -2.806 -3.725 1.00 0.00 C ATOM 1458 CG ARG A 89 15.989 -1.996 -4.771 1.00 0.00 C ATOM 1459 CD ARG A 89 16.741 -0.833 -4.142 1.00 0.00 C ATOM 1460 NE ARG A 89 18.165 -1.120 -3.991 1.00 0.00 N ATOM 1461 CZ ARG A 89 19.045 -1.052 -4.988 1.00 0.00 C ATOM 1462 NH1 ARG A 89 18.651 -0.705 -6.208 1.00 0.00 N ATOM 1463 NH2 ARG A 89 20.322 -1.329 -4.766 1.00 0.00 N ATOM 0 H ARG A 89 12.278 -3.441 -3.171 1.00 0.00 H new ATOM 0 HA ARG A 89 14.193 -1.417 -2.437 1.00 0.00 H new ATOM 0 HB2 ARG A 89 15.895 -2.990 -2.880 1.00 0.00 H new ATOM 0 HB3 ARG A 89 14.981 -3.778 -4.151 1.00 0.00 H new ATOM 0 HG2 ARG A 89 16.692 -2.644 -5.295 1.00 0.00 H new ATOM 0 HG3 ARG A 89 15.289 -1.617 -5.516 1.00 0.00 H new ATOM 0 HD2 ARG A 89 16.614 0.057 -4.759 1.00 0.00 H new ATOM 0 HD3 ARG A 89 16.311 -0.609 -3.166 1.00 0.00 H new ATOM 0 HE ARG A 89 18.505 -1.388 -3.068 1.00 0.00 H new ATOM 0 HH11 ARG A 89 17.670 -0.489 -6.385 1.00 0.00 H new ATOM 0 HH12 ARG A 89 19.329 -0.655 -6.968 1.00 0.00 H new ATOM 0 HH21 ARG A 89 20.631 -1.594 -3.831 1.00 0.00 H new ATOM 0 HH22 ARG A 89 20.996 -1.277 -5.530 1.00 0.00 H new ATOM 1477 N TRP A 90 13.731 -0.213 -4.649 1.00 0.00 N ATOM 1478 CA TRP A 90 13.152 0.591 -5.715 1.00 0.00 C ATOM 1479 C TRP A 90 14.174 1.579 -6.277 1.00 0.00 C ATOM 1480 O TRP A 90 14.722 2.404 -5.548 1.00 0.00 O ATOM 1481 CB TRP A 90 11.879 1.301 -5.223 1.00 0.00 C ATOM 1482 CG TRP A 90 12.086 2.687 -4.691 1.00 0.00 C ATOM 1483 CD1 TRP A 90 12.418 3.802 -5.407 1.00 0.00 C ATOM 1484 CD2 TRP A 90 11.944 3.109 -3.332 1.00 0.00 C ATOM 1485 NE1 TRP A 90 12.497 4.889 -4.574 1.00 0.00 N ATOM 1486 CE2 TRP A 90 12.209 4.491 -3.296 1.00 0.00 C ATOM 1487 CE3 TRP A 90 11.621 2.453 -2.141 1.00 0.00 C ATOM 1488 CZ2 TRP A 90 12.156 5.228 -2.117 1.00 0.00 C ATOM 1489 CZ3 TRP A 90 11.570 3.186 -0.971 1.00 0.00 C ATOM 1490 CH2 TRP A 90 11.834 4.561 -0.967 1.00 0.00 C ATOM 0 H TRP A 90 14.539 0.210 -4.191 1.00 0.00 H new ATOM 0 HA TRP A 90 12.867 -0.072 -6.532 1.00 0.00 H new ATOM 0 HB2 TRP A 90 11.167 1.348 -6.047 1.00 0.00 H new ATOM 0 HB3 TRP A 90 11.422 0.694 -4.442 1.00 0.00 H new ATOM 0 HD1 TRP A 90 12.593 3.824 -6.473 1.00 0.00 H new ATOM 0 HE1 TRP A 90 12.732 5.839 -4.860 1.00 0.00 H new ATOM 0 HE3 TRP A 90 11.415 1.393 -2.135 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 12.362 6.288 -2.110 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 11.322 2.690 -0.044 1.00 0.00 H new ATOM 0 HH2 TRP A 90 11.782 5.106 -0.036 1.00 0.00 H new ATOM 1501 N GLU A 91 14.433 1.474 -7.583 1.00 0.00 N ATOM 1502 CA GLU A 91 15.397 2.349 -8.242 1.00 0.00 C ATOM 1503 C GLU A 91 14.838 3.758 -8.410 1.00 0.00 C ATOM 1504 O GLU A 91 13.632 3.945 -8.570 1.00 0.00 O ATOM 1505 CB GLU A 91 15.783 1.775 -9.606 1.00 0.00 C ATOM 1506 CG GLU A 91 17.201 2.120 -10.032 1.00 0.00 C ATOM 1507 CD GLU A 91 17.311 2.403 -11.518 1.00 0.00 C ATOM 1508 OE1 GLU A 91 16.594 3.304 -12.005 1.00 0.00 O ATOM 1509 OE2 GLU A 91 18.113 1.726 -12.194 1.00 0.00 O ATOM 0 H GLU A 91 13.989 0.794 -8.200 1.00 0.00 H new ATOM 0 HA GLU A 91 16.284 2.408 -7.612 1.00 0.00 H new ATOM 0 HB2 GLU A 91 15.674 0.691 -9.579 1.00 0.00 H new ATOM 0 HB3 GLU A 91 15.086 2.146 -10.358 1.00 0.00 H new ATOM 0 HG2 GLU A 91 17.542 2.992 -9.474 1.00 0.00 H new ATOM 0 HG3 GLU A 91 17.865 1.295 -9.773 1.00 0.00 H new ATOM 1516 N GLY A 92 15.728 4.746 -8.374 1.00 0.00 N ATOM 1517 CA GLY A 92 15.311 6.128 -8.526 1.00 0.00 C ATOM 1518 C GLY A 92 14.269 6.538 -7.503 1.00 0.00 C ATOM 1519 O GLY A 92 14.453 6.334 -6.303 1.00 0.00 O ATOM 0 H GLY A 92 16.731 4.613 -8.242 1.00 0.00 H new ATOM 0 HA2 GLY A 92 16.181 6.778 -8.434 1.00 0.00 H new ATOM 0 HA3 GLY A 92 14.908 6.274 -9.528 1.00 0.00 H new ATOM 1523 N GLU A 93 13.173 7.118 -7.980 1.00 0.00 N ATOM 1524 CA GLU A 93 12.096 7.559 -7.101 1.00 0.00 C ATOM 1525 C GLU A 93 10.774 6.914 -7.505 1.00 0.00 C ATOM 1526 O GLU A 93 10.534 6.663 -8.686 1.00 0.00 O ATOM 1527 CB GLU A 93 11.968 9.082 -7.141 1.00 0.00 C ATOM 1528 CG GLU A 93 13.050 9.805 -6.356 1.00 0.00 C ATOM 1529 CD GLU A 93 12.597 11.162 -5.853 1.00 0.00 C ATOM 1530 OE1 GLU A 93 12.369 12.060 -6.691 1.00 0.00 O ATOM 1531 OE2 GLU A 93 12.469 11.326 -4.622 1.00 0.00 O ATOM 0 H GLU A 93 13.007 7.294 -8.971 1.00 0.00 H new ATOM 0 HA GLU A 93 12.337 7.251 -6.084 1.00 0.00 H new ATOM 0 HB2 GLU A 93 12.001 9.414 -8.179 1.00 0.00 H new ATOM 0 HB3 GLU A 93 10.993 9.367 -6.746 1.00 0.00 H new ATOM 0 HG2 GLU A 93 13.352 9.190 -5.508 1.00 0.00 H new ATOM 0 HG3 GLU A 93 13.929 9.931 -6.988 1.00 0.00 H new ATOM 1538 N PRO A 94 9.885 6.644 -6.531 1.00 0.00 N ATOM 1539 CA PRO A 94 8.581 6.041 -6.795 1.00 0.00 C ATOM 1540 C PRO A 94 7.614 7.060 -7.371 1.00 0.00 C ATOM 1541 O PRO A 94 7.446 8.143 -6.811 1.00 0.00 O ATOM 1542 CB PRO A 94 8.103 5.569 -5.409 1.00 0.00 C ATOM 1543 CG PRO A 94 9.230 5.846 -4.465 1.00 0.00 C ATOM 1544 CD PRO A 94 10.058 6.922 -5.104 1.00 0.00 C ATOM 0 HA PRO A 94 8.638 5.233 -7.524 1.00 0.00 H new ATOM 0 HB2 PRO A 94 7.201 6.101 -5.106 1.00 0.00 H new ATOM 0 HB3 PRO A 94 7.858 4.507 -5.422 1.00 0.00 H new ATOM 0 HG2 PRO A 94 8.854 6.169 -3.494 1.00 0.00 H new ATOM 0 HG3 PRO A 94 9.824 4.948 -4.294 1.00 0.00 H new ATOM 0 HD2 PRO A 94 9.705 7.918 -4.838 1.00 0.00 H new ATOM 0 HD3 PRO A 94 11.104 6.863 -4.802 1.00 0.00 H new ATOM 1552 N TRP A 95 6.978 6.726 -8.488 1.00 0.00 N ATOM 1553 CA TRP A 95 6.040 7.654 -9.099 1.00 0.00 C ATOM 1554 C TRP A 95 4.754 6.976 -9.541 1.00 0.00 C ATOM 1555 O TRP A 95 3.671 7.310 -9.060 1.00 0.00 O ATOM 1556 CB TRP A 95 6.676 8.386 -10.287 1.00 0.00 C ATOM 1557 CG TRP A 95 7.335 7.504 -11.319 1.00 0.00 C ATOM 1558 CD1 TRP A 95 8.637 7.097 -11.333 1.00 0.00 C ATOM 1559 CD2 TRP A 95 6.733 6.950 -12.500 1.00 0.00 C ATOM 1560 NE1 TRP A 95 8.890 6.344 -12.458 1.00 0.00 N ATOM 1561 CE2 TRP A 95 7.739 6.241 -13.190 1.00 0.00 C ATOM 1562 CE3 TRP A 95 5.446 6.985 -13.045 1.00 0.00 C ATOM 1563 CZ2 TRP A 95 7.498 5.585 -14.396 1.00 0.00 C ATOM 1564 CZ3 TRP A 95 5.207 6.328 -14.239 1.00 0.00 C ATOM 1565 CH2 TRP A 95 6.229 5.642 -14.905 1.00 0.00 C ATOM 0 H TRP A 95 7.092 5.839 -8.979 1.00 0.00 H new ATOM 0 HA TRP A 95 5.785 8.380 -8.327 1.00 0.00 H new ATOM 0 HB2 TRP A 95 5.906 8.979 -10.780 1.00 0.00 H new ATOM 0 HB3 TRP A 95 7.420 9.085 -9.904 1.00 0.00 H new ATOM 0 HD1 TRP A 95 9.365 7.332 -10.571 1.00 0.00 H new ATOM 0 HE1 TRP A 95 9.789 5.930 -12.705 1.00 0.00 H new ATOM 0 HE3 TRP A 95 4.651 7.516 -12.542 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 8.284 5.051 -14.910 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 4.214 6.345 -14.664 1.00 0.00 H new ATOM 0 HH2 TRP A 95 6.012 5.147 -15.840 1.00 0.00 H new ATOM 1576 N GLY A 96 4.871 6.037 -10.468 1.00 0.00 N ATOM 1577 CA GLY A 96 3.698 5.344 -10.972 1.00 0.00 C ATOM 1578 C GLY A 96 2.548 6.290 -11.282 1.00 0.00 C ATOM 1579 O GLY A 96 2.508 6.900 -12.349 1.00 0.00 O ATOM 0 H GLY A 96 5.755 5.741 -10.881 1.00 0.00 H new ATOM 0 HA2 GLY A 96 3.965 4.795 -11.875 1.00 0.00 H new ATOM 0 HA3 GLY A 96 3.371 4.609 -10.237 1.00 0.00 H new ATOM 1583 N LYS A 97 1.610 6.406 -10.341 1.00 0.00 N ATOM 1584 CA LYS A 97 0.451 7.280 -10.512 1.00 0.00 C ATOM 1585 C LYS A 97 -0.574 7.072 -9.393 1.00 0.00 C ATOM 1586 O LYS A 97 -1.779 7.169 -9.622 1.00 0.00 O ATOM 1587 CB LYS A 97 -0.211 7.035 -11.874 1.00 0.00 C ATOM 1588 CG LYS A 97 -0.274 8.276 -12.749 1.00 0.00 C ATOM 1589 CD LYS A 97 -0.399 7.914 -14.220 1.00 0.00 C ATOM 1590 CE LYS A 97 -1.288 8.898 -14.962 1.00 0.00 C ATOM 1591 NZ LYS A 97 -0.494 9.951 -15.654 1.00 0.00 N ATOM 0 H LYS A 97 1.631 5.905 -9.453 1.00 0.00 H new ATOM 0 HA LYS A 97 0.806 8.310 -10.466 1.00 0.00 H new ATOM 0 HB2 LYS A 97 0.339 6.256 -12.402 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -1.222 6.660 -11.716 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -1.124 8.890 -12.451 1.00 0.00 H new ATOM 0 HG3 LYS A 97 0.623 8.877 -12.596 1.00 0.00 H new ATOM 0 HD2 LYS A 97 0.590 7.899 -14.677 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -0.809 6.909 -14.315 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -1.893 8.361 -15.692 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -1.977 9.366 -14.259 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -1.137 10.602 -16.148 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 0.065 10.480 -14.955 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 0.146 9.507 -16.343 1.00 0.00 H new ATOM 1605 N GLU A 98 -0.091 6.795 -8.184 1.00 0.00 N ATOM 1606 CA GLU A 98 -0.976 6.583 -7.037 1.00 0.00 C ATOM 1607 C GLU A 98 -1.867 7.805 -6.813 1.00 0.00 C ATOM 1608 O GLU A 98 -2.989 7.684 -6.321 1.00 0.00 O ATOM 1609 CB GLU A 98 -0.172 6.277 -5.763 1.00 0.00 C ATOM 1610 CG GLU A 98 1.275 6.749 -5.797 1.00 0.00 C ATOM 1611 CD GLU A 98 1.409 8.214 -6.164 1.00 0.00 C ATOM 1612 OE1 GLU A 98 1.273 9.066 -5.262 1.00 0.00 O ATOM 1613 OE2 GLU A 98 1.651 8.510 -7.353 1.00 0.00 O ATOM 0 H GLU A 98 0.903 6.712 -7.972 1.00 0.00 H new ATOM 0 HA GLU A 98 -1.606 5.721 -7.259 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -0.672 6.742 -4.913 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -0.185 5.201 -5.591 1.00 0.00 H new ATOM 0 HG2 GLU A 98 1.730 6.581 -4.821 1.00 0.00 H new ATOM 0 HG3 GLU A 98 1.831 6.147 -6.516 1.00 0.00 H new ATOM 1620 N GLY A 99 -1.363 8.978 -7.188 1.00 0.00 N ATOM 1621 CA GLY A 99 -2.131 10.201 -7.032 1.00 0.00 C ATOM 1622 C GLY A 99 -1.870 10.913 -5.715 1.00 0.00 C ATOM 1623 O GLY A 99 -2.539 11.895 -5.396 1.00 0.00 O ATOM 0 H GLY A 99 -0.437 9.103 -7.597 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -1.896 10.876 -7.855 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -3.193 9.966 -7.106 1.00 0.00 H new ATOM 1627 N GLN A 100 -0.902 10.423 -4.945 1.00 0.00 N ATOM 1628 CA GLN A 100 -0.574 11.031 -3.661 1.00 0.00 C ATOM 1629 C GLN A 100 0.930 11.060 -3.427 1.00 0.00 C ATOM 1630 O GLN A 100 1.515 10.092 -2.940 1.00 0.00 O ATOM 1631 CB GLN A 100 -1.266 10.278 -2.524 1.00 0.00 C ATOM 1632 CG GLN A 100 -2.711 10.697 -2.307 1.00 0.00 C ATOM 1633 CD GLN A 100 -3.698 9.711 -2.899 1.00 0.00 C ATOM 1634 OE1 GLN A 100 -3.312 8.743 -3.554 1.00 0.00 O ATOM 1635 NE2 GLN A 100 -4.985 9.951 -2.670 1.00 0.00 N ATOM 0 H GLN A 100 -0.334 9.611 -5.187 1.00 0.00 H new ATOM 0 HA GLN A 100 -0.933 12.060 -3.680 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -1.234 9.209 -2.735 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -0.708 10.437 -1.601 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -2.900 10.797 -1.238 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -2.872 11.679 -2.753 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -5.262 10.765 -2.122 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -5.695 9.321 -3.043 1.00 0.00 H new ATOM 1644 N PRO A 101 1.578 12.185 -3.767 1.00 0.00 N ATOM 1645 CA PRO A 101 3.022 12.359 -3.589 1.00 0.00 C ATOM 1646 C PRO A 101 3.508 11.843 -2.236 1.00 0.00 C ATOM 1647 O PRO A 101 2.852 12.045 -1.214 1.00 0.00 O ATOM 1648 CB PRO A 101 3.175 13.874 -3.666 1.00 0.00 C ATOM 1649 CG PRO A 101 2.119 14.296 -4.622 1.00 0.00 C ATOM 1650 CD PRO A 101 0.949 13.390 -4.352 1.00 0.00 C ATOM 0 HA PRO A 101 3.606 11.806 -4.324 1.00 0.00 H new ATOM 0 HB2 PRO A 101 3.038 14.339 -2.690 1.00 0.00 H new ATOM 0 HB3 PRO A 101 4.167 14.157 -4.017 1.00 0.00 H new ATOM 0 HG2 PRO A 101 1.849 15.341 -4.472 1.00 0.00 H new ATOM 0 HG3 PRO A 101 2.461 14.199 -5.652 1.00 0.00 H new ATOM 0 HD2 PRO A 101 0.237 13.846 -3.664 1.00 0.00 H new ATOM 0 HD3 PRO A 101 0.403 13.155 -5.266 1.00 0.00 H new ATOM 1658 N GLY A 102 4.656 11.173 -2.236 1.00 0.00 N ATOM 1659 CA GLY A 102 5.199 10.637 -1.002 1.00 0.00 C ATOM 1660 C GLY A 102 6.683 10.917 -0.838 1.00 0.00 C ATOM 1661 O GLY A 102 7.317 11.491 -1.723 1.00 0.00 O ATOM 0 H GLY A 102 5.219 10.992 -3.067 1.00 0.00 H new ATOM 0 HA2 GLY A 102 4.658 11.064 -0.157 1.00 0.00 H new ATOM 0 HA3 GLY A 102 5.033 9.560 -0.975 1.00 0.00 H new ATOM 1665 N GLU A 103 7.233 10.505 0.302 1.00 0.00 N ATOM 1666 CA GLU A 103 8.650 10.702 0.593 1.00 0.00 C ATOM 1667 C GLU A 103 9.217 9.490 1.329 1.00 0.00 C ATOM 1668 O GLU A 103 8.475 8.734 1.954 1.00 0.00 O ATOM 1669 CB GLU A 103 8.850 11.965 1.435 1.00 0.00 C ATOM 1670 CG GLU A 103 8.571 13.252 0.676 1.00 0.00 C ATOM 1671 CD GLU A 103 7.229 13.861 1.032 1.00 0.00 C ATOM 1672 OE1 GLU A 103 6.268 13.093 1.247 1.00 0.00 O ATOM 1673 OE2 GLU A 103 7.140 15.105 1.096 1.00 0.00 O ATOM 0 H GLU A 103 6.716 10.031 1.042 1.00 0.00 H new ATOM 0 HA GLU A 103 9.182 10.820 -0.351 1.00 0.00 H new ATOM 0 HB2 GLU A 103 8.197 11.918 2.306 1.00 0.00 H new ATOM 0 HB3 GLU A 103 9.875 11.986 1.805 1.00 0.00 H new ATOM 0 HG2 GLU A 103 9.361 13.973 0.888 1.00 0.00 H new ATOM 0 HG3 GLU A 103 8.602 13.052 -0.395 1.00 0.00 H new ATOM 1680 N TRP A 104 10.533 9.305 1.252 1.00 0.00 N ATOM 1681 CA TRP A 104 11.174 8.173 1.918 1.00 0.00 C ATOM 1682 C TRP A 104 11.127 8.353 3.433 1.00 0.00 C ATOM 1683 O TRP A 104 11.847 9.180 3.994 1.00 0.00 O ATOM 1684 CB TRP A 104 12.634 8.010 1.455 1.00 0.00 C ATOM 1685 CG TRP A 104 12.885 8.473 0.050 1.00 0.00 C ATOM 1686 CD1 TRP A 104 12.005 8.446 -0.995 1.00 0.00 C ATOM 1687 CD2 TRP A 104 14.100 9.030 -0.463 1.00 0.00 C ATOM 1688 NE1 TRP A 104 12.599 8.953 -2.124 1.00 0.00 N ATOM 1689 CE2 TRP A 104 13.885 9.319 -1.824 1.00 0.00 C ATOM 1690 CE3 TRP A 104 15.349 9.314 0.096 1.00 0.00 C ATOM 1691 CZ2 TRP A 104 14.873 9.877 -2.632 1.00 0.00 C ATOM 1692 CZ3 TRP A 104 16.328 9.868 -0.706 1.00 0.00 C ATOM 1693 CH2 TRP A 104 16.085 10.145 -2.058 1.00 0.00 C ATOM 0 H TRP A 104 11.170 9.916 0.741 1.00 0.00 H new ATOM 0 HA TRP A 104 10.625 7.271 1.647 1.00 0.00 H new ATOM 0 HB2 TRP A 104 13.283 8.567 2.131 1.00 0.00 H new ATOM 0 HB3 TRP A 104 12.915 6.960 1.536 1.00 0.00 H new ATOM 0 HD1 TRP A 104 10.991 8.079 -0.941 1.00 0.00 H new ATOM 0 HE1 TRP A 104 12.155 9.043 -3.038 1.00 0.00 H new ATOM 0 HE3 TRP A 104 15.545 9.104 1.137 1.00 0.00 H new ATOM 0 HZ2 TRP A 104 14.688 10.090 -3.675 1.00 0.00 H new ATOM 0 HZ3 TRP A 104 17.297 10.091 -0.284 1.00 0.00 H new ATOM 0 HH2 TRP A 104 16.871 10.579 -2.659 1.00 0.00 H new ATOM 1704 N MET A 105 10.274 7.571 4.090 1.00 0.00 N ATOM 1705 CA MET A 105 10.130 7.640 5.542 1.00 0.00 C ATOM 1706 C MET A 105 10.472 6.301 6.185 1.00 0.00 C ATOM 1707 O MET A 105 10.506 5.273 5.513 1.00 0.00 O ATOM 1708 CB MET A 105 8.704 8.050 5.923 1.00 0.00 C ATOM 1709 CG MET A 105 8.095 9.085 4.991 1.00 0.00 C ATOM 1710 SD MET A 105 6.959 10.200 5.839 1.00 0.00 S ATOM 1711 CE MET A 105 5.576 10.205 4.701 1.00 0.00 C ATOM 0 H MET A 105 9.672 6.882 3.640 1.00 0.00 H new ATOM 0 HA MET A 105 10.826 8.393 5.912 1.00 0.00 H new ATOM 0 HB2 MET A 105 8.070 7.163 5.930 1.00 0.00 H new ATOM 0 HB3 MET A 105 8.709 8.447 6.938 1.00 0.00 H new ATOM 0 HG2 MET A 105 8.893 9.667 4.530 1.00 0.00 H new ATOM 0 HG3 MET A 105 7.565 8.576 4.186 1.00 0.00 H new ATOM 0 HE1 MET A 105 5.274 11.233 4.500 1.00 0.00 H new ATOM 0 HE2 MET A 105 5.870 9.724 3.768 1.00 0.00 H new ATOM 0 HE3 MET A 105 4.740 9.661 5.142 1.00 0.00 H new ATOM 1721 N SER A 106 10.717 6.318 7.490 1.00 0.00 N ATOM 1722 CA SER A 106 11.051 5.097 8.217 1.00 0.00 C ATOM 1723 C SER A 106 9.794 4.297 8.545 1.00 0.00 C ATOM 1724 O SER A 106 8.944 4.745 9.314 1.00 0.00 O ATOM 1725 CB SER A 106 11.804 5.436 9.505 1.00 0.00 C ATOM 1726 OG SER A 106 11.294 6.617 10.099 1.00 0.00 O ATOM 0 H SER A 106 10.691 7.160 8.065 1.00 0.00 H new ATOM 0 HA SER A 106 11.691 4.488 7.579 1.00 0.00 H new ATOM 0 HB2 SER A 106 11.721 4.607 10.208 1.00 0.00 H new ATOM 0 HB3 SER A 106 12.864 5.564 9.287 1.00 0.00 H new ATOM 0 HG SER A 106 11.791 6.811 10.921 1.00 0.00 H new ATOM 1732 N LEU A 107 9.686 3.109 7.957 1.00 0.00 N ATOM 1733 CA LEU A 107 8.535 2.242 8.188 1.00 0.00 C ATOM 1734 C LEU A 107 8.672 1.485 9.504 1.00 0.00 C ATOM 1735 O LEU A 107 7.676 1.110 10.124 1.00 0.00 O ATOM 1736 CB LEU A 107 8.376 1.251 7.034 1.00 0.00 C ATOM 1737 CG LEU A 107 6.930 0.896 6.681 1.00 0.00 C ATOM 1738 CD1 LEU A 107 6.257 0.181 7.842 1.00 0.00 C ATOM 1739 CD2 LEU A 107 6.154 2.148 6.301 1.00 0.00 C ATOM 0 H LEU A 107 10.381 2.725 7.317 1.00 0.00 H new ATOM 0 HA LEU A 107 7.648 2.873 8.245 1.00 0.00 H new ATOM 0 HB2 LEU A 107 8.859 1.666 6.149 1.00 0.00 H new ATOM 0 HB3 LEU A 107 8.908 0.334 7.287 1.00 0.00 H new ATOM 0 HG LEU A 107 6.939 0.223 5.824 1.00 0.00 H new ATOM 0 HD11 LEU A 107 5.230 -0.063 7.572 1.00 0.00 H new ATOM 0 HD12 LEU A 107 6.801 -0.736 8.069 1.00 0.00 H new ATOM 0 HD13 LEU A 107 6.258 0.829 8.718 1.00 0.00 H new ATOM 0 HD21 LEU A 107 5.127 1.878 6.053 1.00 0.00 H new ATOM 0 HD22 LEU A 107 6.154 2.844 7.140 1.00 0.00 H new ATOM 0 HD23 LEU A 107 6.624 2.620 5.438 1.00 0.00 H new ATOM 1751 N VAL A 108 9.913 1.260 9.928 1.00 0.00 N ATOM 1752 CA VAL A 108 10.183 0.546 11.171 1.00 0.00 C ATOM 1753 C VAL A 108 9.410 1.150 12.343 1.00 0.00 C ATOM 1754 O VAL A 108 9.156 0.478 13.341 1.00 0.00 O ATOM 1755 CB VAL A 108 11.689 0.550 11.503 1.00 0.00 C ATOM 1756 CG1 VAL A 108 12.196 1.973 11.687 1.00 0.00 C ATOM 1757 CG2 VAL A 108 11.969 -0.289 12.741 1.00 0.00 C ATOM 0 H VAL A 108 10.748 1.563 9.427 1.00 0.00 H new ATOM 0 HA VAL A 108 9.852 -0.482 11.020 1.00 0.00 H new ATOM 0 HB VAL A 108 12.225 0.106 10.664 1.00 0.00 H new ATOM 0 HG11 VAL A 108 13.260 1.953 11.921 1.00 0.00 H new ATOM 0 HG12 VAL A 108 12.037 2.538 10.768 1.00 0.00 H new ATOM 0 HG13 VAL A 108 11.654 2.449 12.504 1.00 0.00 H new ATOM 0 HG21 VAL A 108 13.037 -0.273 12.958 1.00 0.00 H new ATOM 0 HG22 VAL A 108 11.420 0.120 13.589 1.00 0.00 H new ATOM 0 HG23 VAL A 108 11.650 -1.316 12.564 1.00 0.00 H new ATOM 1767 N GLY A 109 9.039 2.421 12.214 1.00 0.00 N ATOM 1768 CA GLY A 109 8.301 3.086 13.268 1.00 0.00 C ATOM 1769 C GLY A 109 7.027 3.736 12.766 1.00 0.00 C ATOM 1770 O GLY A 109 6.718 4.872 13.124 1.00 0.00 O ATOM 0 H GLY A 109 9.237 3.000 11.398 1.00 0.00 H new ATOM 0 HA2 GLY A 109 8.054 2.363 14.045 1.00 0.00 H new ATOM 0 HA3 GLY A 109 8.935 3.844 13.728 1.00 0.00 H new ATOM 1774 N LEU A 110 6.282 3.011 11.937 1.00 0.00 N ATOM 1775 CA LEU A 110 5.030 3.522 11.390 1.00 0.00 C ATOM 1776 C LEU A 110 4.031 3.787 12.509 1.00 0.00 C ATOM 1777 O LEU A 110 4.069 3.132 13.551 1.00 0.00 O ATOM 1778 CB LEU A 110 4.440 2.533 10.384 1.00 0.00 C ATOM 1779 CG LEU A 110 3.094 2.947 9.788 1.00 0.00 C ATOM 1780 CD1 LEU A 110 2.981 2.473 8.347 1.00 0.00 C ATOM 1781 CD2 LEU A 110 1.950 2.395 10.626 1.00 0.00 C ATOM 0 H LEU A 110 6.523 2.069 11.630 1.00 0.00 H new ATOM 0 HA LEU A 110 5.239 4.460 10.875 1.00 0.00 H new ATOM 0 HB2 LEU A 110 5.153 2.394 9.572 1.00 0.00 H new ATOM 0 HB3 LEU A 110 4.322 1.566 10.873 1.00 0.00 H new ATOM 0 HG LEU A 110 3.032 4.035 9.796 1.00 0.00 H new ATOM 0 HD11 LEU A 110 2.017 2.776 7.939 1.00 0.00 H new ATOM 0 HD12 LEU A 110 3.782 2.916 7.754 1.00 0.00 H new ATOM 0 HD13 LEU A 110 3.063 1.387 8.314 1.00 0.00 H new ATOM 0 HD21 LEU A 110 0.999 2.699 10.188 1.00 0.00 H new ATOM 0 HD22 LEU A 110 2.008 1.307 10.649 1.00 0.00 H new ATOM 0 HD23 LEU A 110 2.023 2.784 11.642 1.00 0.00 H new ATOM 1793 N ASN A 111 3.150 4.761 12.303 1.00 0.00 N ATOM 1794 CA ASN A 111 2.164 5.113 13.317 1.00 0.00 C ATOM 1795 C ASN A 111 0.737 4.853 12.852 1.00 0.00 C ATOM 1796 O ASN A 111 0.347 5.232 11.748 1.00 0.00 O ATOM 1797 CB ASN A 111 2.321 6.582 13.712 1.00 0.00 C ATOM 1798 CG ASN A 111 2.753 6.751 15.156 1.00 0.00 C ATOM 1799 OD1 ASN A 111 3.922 6.559 15.491 1.00 0.00 O ATOM 1800 ND2 ASN A 111 1.811 7.113 16.017 1.00 0.00 N ATOM 0 H ASN A 111 3.099 5.317 11.449 1.00 0.00 H new ATOM 0 HA ASN A 111 2.348 4.475 14.181 1.00 0.00 H new ATOM 0 HB2 ASN A 111 3.055 7.054 13.059 1.00 0.00 H new ATOM 0 HB3 ASN A 111 1.375 7.100 13.556 1.00 0.00 H new ATOM 0 HD21 ASN A 111 2.043 7.243 17.002 1.00 0.00 H new ATOM 0 HD22 ASN A 111 0.855 7.261 15.694 1.00 0.00 H new ATOM 1807 N ALA A 112 -0.042 4.219 13.724 1.00 0.00 N ATOM 1808 CA ALA A 112 -1.436 3.922 13.434 1.00 0.00 C ATOM 1809 C ALA A 112 -2.278 5.200 13.475 1.00 0.00 C ATOM 1810 O ALA A 112 -3.413 5.225 13.002 1.00 0.00 O ATOM 1811 CB ALA A 112 -1.981 2.893 14.418 1.00 0.00 C ATOM 0 H ALA A 112 0.273 3.901 14.641 1.00 0.00 H new ATOM 0 HA ALA A 112 -1.495 3.503 12.430 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -3.025 2.684 14.185 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -1.401 1.973 14.341 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -1.907 3.285 15.432 1.00 0.00 H new ATOM 1817 N ASP A 113 -1.714 6.258 14.057 1.00 0.00 N ATOM 1818 CA ASP A 113 -2.408 7.538 14.166 1.00 0.00 C ATOM 1819 C ASP A 113 -2.367 8.313 12.848 1.00 0.00 C ATOM 1820 O ASP A 113 -3.392 8.804 12.376 1.00 0.00 O ATOM 1821 CB ASP A 113 -1.791 8.379 15.283 1.00 0.00 C ATOM 1822 CG ASP A 113 -2.829 9.181 16.044 1.00 0.00 C ATOM 1823 OD1 ASP A 113 -3.630 8.568 16.780 1.00 0.00 O ATOM 1824 OD2 ASP A 113 -2.840 10.423 15.904 1.00 0.00 O ATOM 0 H ASP A 113 -0.777 6.252 14.460 1.00 0.00 H new ATOM 0 HA ASP A 113 -3.452 7.330 14.403 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -1.261 7.725 15.976 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -1.052 9.058 14.857 1.00 0.00 H new ATOM 1829 N ASP A 114 -1.175 8.430 12.264 1.00 0.00 N ATOM 1830 CA ASP A 114 -1.006 9.157 11.006 1.00 0.00 C ATOM 1831 C ASP A 114 -1.704 8.435 9.860 1.00 0.00 C ATOM 1832 O ASP A 114 -2.224 9.066 8.940 1.00 0.00 O ATOM 1833 CB ASP A 114 0.479 9.362 10.661 1.00 0.00 C ATOM 1834 CG ASP A 114 1.433 8.653 11.605 1.00 0.00 C ATOM 1835 OD1 ASP A 114 1.615 9.138 12.741 1.00 0.00 O ATOM 1836 OD2 ASP A 114 1.998 7.614 11.205 1.00 0.00 O ATOM 0 H ASP A 114 -0.314 8.032 12.640 1.00 0.00 H new ATOM 0 HA ASP A 114 -1.464 10.137 11.142 1.00 0.00 H new ATOM 0 HB2 ASP A 114 0.658 9.008 9.646 1.00 0.00 H new ATOM 0 HB3 ASP A 114 0.700 10.429 10.670 1.00 0.00 H new ATOM 1841 N PHE A 115 -1.716 7.110 9.920 1.00 0.00 N ATOM 1842 CA PHE A 115 -2.355 6.304 8.889 1.00 0.00 C ATOM 1843 C PHE A 115 -3.843 6.124 9.214 1.00 0.00 C ATOM 1844 O PHE A 115 -4.296 6.524 10.287 1.00 0.00 O ATOM 1845 CB PHE A 115 -1.631 4.949 8.768 1.00 0.00 C ATOM 1846 CG PHE A 115 -2.371 3.789 9.370 1.00 0.00 C ATOM 1847 CD1 PHE A 115 -2.896 3.888 10.640 1.00 0.00 C ATOM 1848 CD2 PHE A 115 -2.532 2.605 8.670 1.00 0.00 C ATOM 1849 CE1 PHE A 115 -3.573 2.833 11.211 1.00 0.00 C ATOM 1850 CE2 PHE A 115 -3.209 1.544 9.233 1.00 0.00 C ATOM 1851 CZ PHE A 115 -3.731 1.659 10.507 1.00 0.00 C ATOM 0 H PHE A 115 -1.290 6.570 10.673 1.00 0.00 H new ATOM 0 HA PHE A 115 -2.284 6.811 7.927 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -1.452 4.741 7.713 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -0.655 5.029 9.248 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -2.775 4.806 11.196 1.00 0.00 H new ATOM 0 HD2 PHE A 115 -2.124 2.512 7.674 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -3.979 2.926 12.208 1.00 0.00 H new ATOM 0 HE2 PHE A 115 -3.331 0.625 8.679 1.00 0.00 H new ATOM 0 HZ PHE A 115 -4.262 0.830 10.951 1.00 0.00 H new ATOM 1861 N PRO A 116 -4.627 5.519 8.304 1.00 0.00 N ATOM 1862 CA PRO A 116 -6.059 5.300 8.536 1.00 0.00 C ATOM 1863 C PRO A 116 -6.309 4.286 9.653 1.00 0.00 C ATOM 1864 O PRO A 116 -5.766 3.184 9.626 1.00 0.00 O ATOM 1865 CB PRO A 116 -6.562 4.758 7.195 1.00 0.00 C ATOM 1866 CG PRO A 116 -5.359 4.166 6.547 1.00 0.00 C ATOM 1867 CD PRO A 116 -4.190 4.999 6.996 1.00 0.00 C ATOM 0 HA PRO A 116 -6.567 6.210 8.854 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -7.342 4.010 7.338 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -6.990 5.552 6.583 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -5.231 3.124 6.841 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -5.454 4.181 5.461 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -3.281 4.403 7.083 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -3.977 5.805 6.294 1.00 0.00 H new ATOM 1875 N PRO A 117 -7.134 4.644 10.655 1.00 0.00 N ATOM 1876 CA PRO A 117 -7.440 3.753 11.783 1.00 0.00 C ATOM 1877 C PRO A 117 -8.219 2.510 11.364 1.00 0.00 C ATOM 1878 O PRO A 117 -8.234 1.507 12.079 1.00 0.00 O ATOM 1879 CB PRO A 117 -8.289 4.626 12.712 1.00 0.00 C ATOM 1880 CG PRO A 117 -8.863 5.680 11.830 1.00 0.00 C ATOM 1881 CD PRO A 117 -7.825 5.940 10.774 1.00 0.00 C ATOM 0 HA PRO A 117 -6.531 3.369 12.245 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -9.074 4.043 13.193 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -7.684 5.062 13.506 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -9.801 5.348 11.384 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -9.082 6.586 12.395 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -8.278 6.243 9.830 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -7.141 6.736 11.069 1.00 0.00 H new ATOM 1889 N ALA A 118 -8.869 2.580 10.208 1.00 0.00 N ATOM 1890 CA ALA A 118 -9.653 1.459 9.701 1.00 0.00 C ATOM 1891 C ALA A 118 -8.765 0.315 9.221 1.00 0.00 C ATOM 1892 O ALA A 118 -9.254 -0.770 8.908 1.00 0.00 O ATOM 1893 CB ALA A 118 -10.570 1.923 8.580 1.00 0.00 C ATOM 0 H ALA A 118 -8.869 3.402 9.604 1.00 0.00 H new ATOM 0 HA ALA A 118 -10.257 1.080 10.525 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -11.150 1.077 8.210 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -11.247 2.689 8.957 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -9.972 2.336 7.768 1.00 0.00 H new ATOM 1899 N ASN A 119 -7.465 0.566 9.146 1.00 0.00 N ATOM 1900 CA ASN A 119 -6.521 -0.441 8.684 1.00 0.00 C ATOM 1901 C ASN A 119 -5.527 -0.819 9.782 1.00 0.00 C ATOM 1902 O ASN A 119 -4.382 -1.173 9.501 1.00 0.00 O ATOM 1903 CB ASN A 119 -5.783 0.099 7.462 1.00 0.00 C ATOM 1904 CG ASN A 119 -6.327 -0.466 6.165 1.00 0.00 C ATOM 1905 OD1 ASN A 119 -5.573 -0.942 5.317 1.00 0.00 O ATOM 1906 ND2 ASN A 119 -7.644 -0.407 6.003 1.00 0.00 N ATOM 0 H ASN A 119 -7.041 1.458 9.399 1.00 0.00 H new ATOM 0 HA ASN A 119 -7.070 -1.344 8.418 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -5.862 1.186 7.444 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -4.723 -0.142 7.544 1.00 0.00 H new ATOM 0 HD21 ASN A 119 -8.069 -0.765 5.148 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -8.230 -0.003 6.734 1.00 0.00 H new ATOM 1913 N GLU A 120 -5.972 -0.735 11.033 1.00 0.00 N ATOM 1914 CA GLU A 120 -5.122 -1.061 12.177 1.00 0.00 C ATOM 1915 C GLU A 120 -4.944 -2.571 12.368 1.00 0.00 C ATOM 1916 O GLU A 120 -3.902 -3.009 12.839 1.00 0.00 O ATOM 1917 CB GLU A 120 -5.685 -0.428 13.453 1.00 0.00 C ATOM 1918 CG GLU A 120 -4.808 0.676 14.019 1.00 0.00 C ATOM 1919 CD GLU A 120 -5.614 1.803 14.636 1.00 0.00 C ATOM 1920 OE1 GLU A 120 -6.791 1.570 14.983 1.00 0.00 O ATOM 1921 OE2 GLU A 120 -5.068 2.918 14.771 1.00 0.00 O ATOM 0 H GLU A 120 -6.917 -0.444 11.281 1.00 0.00 H new ATOM 0 HA GLU A 120 -4.135 -0.647 11.969 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -6.675 -0.023 13.242 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -5.812 -1.203 14.208 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -4.142 0.256 14.773 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -4.178 1.077 13.225 1.00 0.00 H new ATOM 1928 N PRO A 121 -5.948 -3.396 12.026 1.00 0.00 N ATOM 1929 CA PRO A 121 -5.849 -4.852 12.193 1.00 0.00 C ATOM 1930 C PRO A 121 -4.556 -5.435 11.620 1.00 0.00 C ATOM 1931 O PRO A 121 -3.921 -6.286 12.242 1.00 0.00 O ATOM 1932 CB PRO A 121 -7.058 -5.376 11.420 1.00 0.00 C ATOM 1933 CG PRO A 121 -8.052 -4.271 11.486 1.00 0.00 C ATOM 1934 CD PRO A 121 -7.255 -2.995 11.467 1.00 0.00 C ATOM 0 HA PRO A 121 -5.835 -5.135 13.246 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -6.797 -5.613 10.389 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -7.450 -6.289 11.868 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -8.740 -4.314 10.642 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -8.654 -4.341 12.392 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -7.155 -2.599 10.456 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -7.727 -2.218 12.068 1.00 0.00 H new ATOM 1942 N VAL A 122 -4.177 -4.979 10.430 1.00 0.00 N ATOM 1943 CA VAL A 122 -2.966 -5.464 9.773 1.00 0.00 C ATOM 1944 C VAL A 122 -1.714 -4.837 10.374 1.00 0.00 C ATOM 1945 O VAL A 122 -0.766 -5.535 10.735 1.00 0.00 O ATOM 1946 CB VAL A 122 -2.975 -5.168 8.257 1.00 0.00 C ATOM 1947 CG1 VAL A 122 -2.113 -6.176 7.512 1.00 0.00 C ATOM 1948 CG2 VAL A 122 -4.393 -5.163 7.706 1.00 0.00 C ATOM 0 H VAL A 122 -4.690 -4.274 9.900 1.00 0.00 H new ATOM 0 HA VAL A 122 -2.951 -6.542 9.931 1.00 0.00 H new ATOM 0 HB VAL A 122 -2.555 -4.174 8.106 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -2.131 -5.952 6.445 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -1.088 -6.119 7.878 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -2.502 -7.181 7.679 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -4.367 -4.952 6.637 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -4.851 -6.138 7.872 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -4.978 -4.396 8.213 1.00 0.00 H new ATOM 1958 N ILE A 123 -1.716 -3.513 10.464 1.00 0.00 N ATOM 1959 CA ILE A 123 -0.581 -2.779 11.005 1.00 0.00 C ATOM 1960 C ILE A 123 -0.377 -3.076 12.487 1.00 0.00 C ATOM 1961 O ILE A 123 0.750 -3.116 12.966 1.00 0.00 O ATOM 1962 CB ILE A 123 -0.757 -1.260 10.802 1.00 0.00 C ATOM 1963 CG1 ILE A 123 -0.774 -0.930 9.302 1.00 0.00 C ATOM 1964 CG2 ILE A 123 0.342 -0.490 11.523 1.00 0.00 C ATOM 1965 CD1 ILE A 123 0.435 -0.154 8.826 1.00 0.00 C ATOM 0 H ILE A 123 -2.495 -2.924 10.168 1.00 0.00 H new ATOM 0 HA ILE A 123 0.303 -3.111 10.460 1.00 0.00 H new ATOM 0 HB ILE A 123 -1.711 -0.954 11.232 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -0.841 -1.860 8.737 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -1.673 -0.355 9.078 1.00 0.00 H new ATOM 0 HG21 ILE A 123 0.199 0.579 11.367 1.00 0.00 H new ATOM 0 HG22 ILE A 123 0.301 -0.710 12.590 1.00 0.00 H new ATOM 0 HG23 ILE A 123 1.314 -0.788 11.129 1.00 0.00 H new ATOM 0 HD11 ILE A 123 0.346 0.039 7.757 1.00 0.00 H new ATOM 0 HD12 ILE A 123 0.493 0.793 9.362 1.00 0.00 H new ATOM 0 HD13 ILE A 123 1.338 -0.734 9.016 1.00 0.00 H new ATOM 1977 N ALA A 124 -1.469 -3.280 13.207 1.00 0.00 N ATOM 1978 CA ALA A 124 -1.396 -3.570 14.634 1.00 0.00 C ATOM 1979 C ALA A 124 -0.492 -4.766 14.901 1.00 0.00 C ATOM 1980 O ALA A 124 0.116 -4.872 15.967 1.00 0.00 O ATOM 1981 CB ALA A 124 -2.787 -3.821 15.195 1.00 0.00 C ATOM 0 H ALA A 124 -2.416 -3.251 12.829 1.00 0.00 H new ATOM 0 HA ALA A 124 -0.968 -2.702 15.136 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -2.716 -4.036 16.261 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -3.405 -2.936 15.044 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -3.238 -4.671 14.683 1.00 0.00 H new ATOM 1987 N LYS A 125 -0.413 -5.670 13.930 1.00 0.00 N ATOM 1988 CA LYS A 125 0.416 -6.864 14.068 1.00 0.00 C ATOM 1989 C LYS A 125 1.904 -6.538 13.919 1.00 0.00 C ATOM 1990 O LYS A 125 2.713 -6.888 14.778 1.00 0.00 O ATOM 1991 CB LYS A 125 0.009 -7.912 13.032 1.00 0.00 C ATOM 1992 CG LYS A 125 0.362 -9.335 13.435 1.00 0.00 C ATOM 1993 CD LYS A 125 -0.618 -9.883 14.460 1.00 0.00 C ATOM 1994 CE LYS A 125 -1.866 -10.441 13.795 1.00 0.00 C ATOM 1995 NZ LYS A 125 -2.645 -11.311 14.718 1.00 0.00 N ATOM 0 H LYS A 125 -0.910 -5.600 13.042 1.00 0.00 H new ATOM 0 HA LYS A 125 0.257 -7.262 15.070 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -1.066 -7.847 12.864 1.00 0.00 H new ATOM 0 HB3 LYS A 125 0.494 -7.681 12.084 1.00 0.00 H new ATOM 0 HG2 LYS A 125 0.363 -9.975 12.552 1.00 0.00 H new ATOM 0 HG3 LYS A 125 1.371 -9.358 13.846 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -0.135 -10.666 15.044 1.00 0.00 H new ATOM 0 HD3 LYS A 125 -0.898 -9.092 15.156 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -2.495 -9.618 13.455 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -1.582 -11.012 12.911 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 -3.488 -11.671 14.227 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 -2.054 -12.110 15.023 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -2.938 -10.760 15.550 1.00 0.00 H new ATOM 2009 N LEU A 126 2.259 -5.876 12.821 1.00 0.00 N ATOM 2010 CA LEU A 126 3.650 -5.516 12.556 1.00 0.00 C ATOM 2011 C LEU A 126 4.078 -4.294 13.362 1.00 0.00 C ATOM 2012 O LEU A 126 5.238 -4.177 13.760 1.00 0.00 O ATOM 2013 CB LEU A 126 3.853 -5.247 11.066 1.00 0.00 C ATOM 2014 CG LEU A 126 5.315 -5.195 10.615 1.00 0.00 C ATOM 2015 CD1 LEU A 126 5.741 -6.529 10.020 1.00 0.00 C ATOM 2016 CD2 LEU A 126 5.523 -4.070 9.611 1.00 0.00 C ATOM 0 H LEU A 126 1.603 -5.578 12.100 1.00 0.00 H new ATOM 0 HA LEU A 126 4.271 -6.358 12.862 1.00 0.00 H new ATOM 0 HB2 LEU A 126 3.340 -6.023 10.498 1.00 0.00 H new ATOM 0 HB3 LEU A 126 3.376 -4.300 10.814 1.00 0.00 H new ATOM 0 HG LEU A 126 5.937 -4.997 11.488 1.00 0.00 H new ATOM 0 HD11 LEU A 126 6.783 -6.471 9.706 1.00 0.00 H new ATOM 0 HD12 LEU A 126 5.631 -7.313 10.769 1.00 0.00 H new ATOM 0 HD13 LEU A 126 5.114 -6.760 9.158 1.00 0.00 H new ATOM 0 HD21 LEU A 126 6.568 -4.047 9.301 1.00 0.00 H new ATOM 0 HD22 LEU A 126 4.890 -4.238 8.740 1.00 0.00 H new ATOM 0 HD23 LEU A 126 5.261 -3.118 10.072 1.00 0.00 H new ATOM 2028 N LYS A 127 3.142 -3.383 13.595 1.00 0.00 N ATOM 2029 CA LYS A 127 3.422 -2.163 14.349 1.00 0.00 C ATOM 2030 C LYS A 127 4.041 -2.486 15.697 1.00 0.00 C ATOM 2031 O LYS A 127 5.002 -1.846 16.122 1.00 0.00 O ATOM 2032 CB LYS A 127 2.140 -1.376 14.557 1.00 0.00 C ATOM 2033 CG LYS A 127 2.354 -0.021 15.210 1.00 0.00 C ATOM 2034 CD LYS A 127 1.152 0.891 15.015 1.00 0.00 C ATOM 2035 CE LYS A 127 0.782 1.608 16.303 1.00 0.00 C ATOM 2036 NZ LYS A 127 -0.356 0.947 17.000 1.00 0.00 N ATOM 0 H LYS A 127 2.178 -3.465 13.272 1.00 0.00 H new ATOM 0 HA LYS A 127 4.130 -1.566 13.775 1.00 0.00 H new ATOM 0 HB2 LYS A 127 1.652 -1.232 13.593 1.00 0.00 H new ATOM 0 HB3 LYS A 127 1.460 -1.963 15.174 1.00 0.00 H new ATOM 0 HG2 LYS A 127 2.540 -0.155 16.276 1.00 0.00 H new ATOM 0 HG3 LYS A 127 3.242 0.451 14.788 1.00 0.00 H new ATOM 0 HD2 LYS A 127 1.373 1.625 14.239 1.00 0.00 H new ATOM 0 HD3 LYS A 127 0.302 0.305 14.667 1.00 0.00 H new ATOM 0 HE2 LYS A 127 1.647 1.634 16.965 1.00 0.00 H new ATOM 0 HE3 LYS A 127 0.520 2.642 16.080 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -0.577 1.467 17.873 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 -1.190 0.944 16.378 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -0.097 -0.032 17.236 1.00 0.00 H new ATOM 2050 N ARG A 128 3.497 -3.500 16.354 1.00 0.00 N ATOM 2051 CA ARG A 128 4.015 -3.926 17.642 1.00 0.00 C ATOM 2052 C ARG A 128 5.422 -4.486 17.471 1.00 0.00 C ATOM 2053 O ARG A 128 6.134 -4.721 18.449 1.00 0.00 O ATOM 2054 CB ARG A 128 3.097 -4.979 18.265 1.00 0.00 C ATOM 2055 CG ARG A 128 3.597 -5.513 19.597 1.00 0.00 C ATOM 2056 CD ARG A 128 2.527 -6.324 20.309 1.00 0.00 C ATOM 2057 NE ARG A 128 1.346 -5.521 20.617 1.00 0.00 N ATOM 2058 CZ ARG A 128 0.333 -5.950 21.366 1.00 0.00 C ATOM 2059 NH1 ARG A 128 0.352 -7.172 21.886 1.00 0.00 N ATOM 2060 NH2 ARG A 128 -0.703 -5.156 21.597 1.00 0.00 N ATOM 0 H ARG A 128 2.700 -4.040 16.017 1.00 0.00 H new ATOM 0 HA ARG A 128 4.053 -3.065 18.310 1.00 0.00 H new ATOM 0 HB2 ARG A 128 2.106 -4.547 18.405 1.00 0.00 H new ATOM 0 HB3 ARG A 128 2.987 -5.810 17.569 1.00 0.00 H new ATOM 0 HG2 ARG A 128 4.477 -6.134 19.434 1.00 0.00 H new ATOM 0 HG3 ARG A 128 3.907 -4.682 20.230 1.00 0.00 H new ATOM 0 HD2 ARG A 128 2.238 -7.170 19.685 1.00 0.00 H new ATOM 0 HD3 ARG A 128 2.937 -6.734 21.232 1.00 0.00 H new ATOM 0 HE ARG A 128 1.295 -4.576 20.236 1.00 0.00 H new ATOM 0 HH11 ARG A 128 1.146 -7.788 21.712 1.00 0.00 H new ATOM 0 HH12 ARG A 128 -0.428 -7.495 22.459 1.00 0.00 H new ATOM 0 HH21 ARG A 128 -0.724 -4.216 21.201 1.00 0.00 H new ATOM 0 HH22 ARG A 128 -1.479 -5.485 22.171 1.00 0.00 H new ATOM 2074 N LEU A 129 5.820 -4.694 16.214 1.00 0.00 N ATOM 2075 CA LEU A 129 7.146 -5.221 15.906 1.00 0.00 C ATOM 2076 C LEU A 129 7.412 -6.517 16.669 1.00 0.00 C ATOM 2077 O LEU A 129 7.998 -7.456 16.130 1.00 0.00 O ATOM 2078 CB LEU A 129 8.220 -4.181 16.244 1.00 0.00 C ATOM 2079 CG LEU A 129 8.708 -3.340 15.060 1.00 0.00 C ATOM 2080 CD1 LEU A 129 7.529 -2.777 14.280 1.00 0.00 C ATOM 2081 CD2 LEU A 129 9.616 -2.217 15.542 1.00 0.00 C ATOM 0 H LEU A 129 5.242 -4.505 15.395 1.00 0.00 H new ATOM 0 HA LEU A 129 7.184 -5.440 14.839 1.00 0.00 H new ATOM 0 HB2 LEU A 129 7.826 -3.510 17.008 1.00 0.00 H new ATOM 0 HB3 LEU A 129 9.076 -4.695 16.682 1.00 0.00 H new ATOM 0 HG LEU A 129 9.282 -3.985 14.394 1.00 0.00 H new ATOM 0 HD11 LEU A 129 7.897 -2.183 13.443 1.00 0.00 H new ATOM 0 HD12 LEU A 129 6.918 -3.597 13.902 1.00 0.00 H new ATOM 0 HD13 LEU A 129 6.927 -2.148 14.935 1.00 0.00 H new ATOM 0 HD21 LEU A 129 9.953 -1.630 14.688 1.00 0.00 H new ATOM 0 HD22 LEU A 129 9.066 -1.574 16.230 1.00 0.00 H new ATOM 0 HD23 LEU A 129 10.479 -2.642 16.054 1.00 0.00 H new TER 2093 LEU A 129 HETATM 2094 MG MG A 130 -4.165 3.038 -9.717 1.00 0.00 MG HETATM 2095 OP3 8OG A 131 -8.695 6.051 -4.208 1.00 20.00 O HETATM 2096 P 8OG A 131 -9.670 4.788 -4.418 1.00 20.00 P HETATM 2097 OP1 8OG A 131 -8.850 3.556 -4.428 1.00 20.00 O HETATM 2098 OP2 8OG A 131 -10.556 5.074 -5.569 1.00 20.00 O HETATM 2099 O5' 8OG A 131 -10.552 4.812 -3.071 1.00 20.00 O HETATM 2100 C5' 8OG A 131 -11.413 3.715 -2.756 1.00 20.00 C HETATM 2101 C4' 8OG A 131 -10.611 2.420 -2.610 1.00 20.00 C HETATM 2102 O4' 8OG A 131 -9.556 2.334 -1.645 1.00 20.00 O HETATM 2103 C3' 8OG A 131 -11.481 1.214 -2.250 1.00 20.00 C HETATM 2104 O3' 8OG A 131 -11.513 0.256 -3.312 1.00 20.00 O HETATM 2105 C2' 8OG A 131 -10.908 0.613 -0.963 1.00 20.00 C HETATM 2106 C1' 8OG A 131 -9.693 1.441 -0.532 1.00 20.00 C HETATM 2107 N9 8OG A 131 -9.625 1.805 0.901 1.00 20.00 N HETATM 2108 C8 8OG A 131 -10.679 2.388 1.554 1.00 20.00 C HETATM 2109 N7 8OG A 131 -10.248 2.527 2.847 1.00 20.00 N HETATM 2110 C5 8OG A 131 -8.973 2.048 3.002 1.00 20.00 C HETATM 2111 C6 8OG A 131 -8.106 1.950 4.032 1.00 20.00 C HETATM 2112 O6 8OG A 131 -8.473 2.371 5.184 1.00 20.00 O HETATM 2113 N1 8OG A 131 -6.832 1.408 3.902 1.00 20.00 N HETATM 2114 C2 8OG A 131 -6.460 0.957 2.663 1.00 20.00 C HETATM 2115 N2 8OG A 131 -5.232 0.434 2.539 1.00 20.00 N HETATM 2116 N3 8OG A 131 -7.284 1.012 1.534 1.00 20.00 N HETATM 2117 C4 8OG A 131 -8.562 1.583 1.768 1.00 20.00 C HETATM 2118 O8 8OG A 131 -11.820 2.717 1.073 1.00 20.00 O HETATM 0 HO3' 8OG A 131 -10.620 0.175 -3.707 1.00 20.00 H new HETATM 0 H5'' 8OG A 131 -11.950 3.922 -1.830 1.00 20.00 H new HETATM 0 H2'' 8OG A 131 -11.663 0.613 -0.177 1.00 20.00 H new HETATM 0 H7 8OG A 131 -10.805 2.935 3.598 1.00 20.00 H new HETATM 0 H5' 8OG A 131 -12.162 3.598 -3.539 1.00 20.00 H new HETATM 0 H4' 8OG A 131 -10.174 2.422 -3.609 1.00 20.00 H new HETATM 0 H3' 8OG A 131 -12.515 1.522 -2.096 1.00 20.00 H new HETATM 0 H22 8OG A 131 -4.915 0.086 1.634 1.00 20.00 H new HETATM 0 H21 8OG A 131 -4.615 0.384 3.350 1.00 20.00 H new HETATM 0 H2' 8OG A 131 -10.619 -0.425 -1.127 1.00 20.00 H new HETATM 0 H1' 8OG A 131 -8.727 0.954 -0.399 1.00 20.00 H new HETATM 0 H1 8OG A 131 -6.198 1.348 4.699 1.00 20.00 H new HETATM 2131 O HOH A5071 -4.357 5.136 -9.599 1.00 0.00 O HETATM 2132 O HOH A5072 -5.452 3.027 -11.390 1.00 0.00 O