USER MOD reduce.3.24.130724 H: found=0, std=0, add=679, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 679 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 5 LYS NZ :NH3+ 157:sc= -4.06! (180deg=-4.9!) USER MOD Set 1.2: A 80 LYS NZ :NH3+ -136:sc= -0.474 (180deg=-1.27) USER MOD Set 2.1: A 72 SER OG : rot -21:sc= 0.558 USER MOD Set 2.2: A 73 THR OG1 : rot 116:sc= 0.774 USER MOD Set 3.1: A 40 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 42 TYR OH : rot 180:sc= 0 USER MOD Set 4.1: A 11 SER OG : rot 180:sc= 0 USER MOD Set 4.2: A 15 THR OG1 : rot 71:sc= 1.16 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 THR OG1 : rot 108:sc= 0.135 USER MOD Single : A 16 THR OG1 : rot 28:sc= -1.5 USER MOD Single : A 21 SER OG : rot 84:sc= 0.628 USER MOD Single : A 22 SER OG : rot -26:sc= 0.341 USER MOD Single : A 24 THR OG1 : rot -170:sc= -0.769 USER MOD Single : A 37 SER OG : rot -104:sc= 0.651 USER MOD Single : A 45 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 THR OG1 : rot -85:sc= 0.585 USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 GLN : amide:sc= -6.39! C(o=-6.4!,f=-7.1!) USER MOD Single : A 65 LYS NZ :NH3+ 150:sc= -0.225 (180deg=-1.14) USER MOD Single : A 67 GLN : amide:sc= -0.363 K(o=-0.36,f=-2.8!) USER MOD Single : A 71 SER OG : rot -77:sc= 0.383 USER MOD Single : A 75 LYS NZ :NH3+ -174:sc= -0.623 (180deg=-0.804) USER MOD Single : A 77 ASN :FLIP amide:sc= -0.689 F(o=-5.1!,f=-0.69) USER MOD Single : A 81 LYS NZ :NH3+ -140:sc= -0.172 (180deg=-0.893) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -6.310 1.141 0.902 1.00 0.00 N ATOM 2 CA MET A 1 -6.997 0.737 -0.357 1.00 0.00 C ATOM 3 C MET A 1 -6.355 -0.538 -0.892 1.00 0.00 C ATOM 4 O MET A 1 -6.920 -1.626 -0.775 1.00 0.00 O ATOM 5 CB MET A 1 -6.869 1.862 -1.389 1.00 0.00 C ATOM 6 CG MET A 1 -7.660 1.497 -2.648 1.00 0.00 C ATOM 7 SD MET A 1 -7.468 2.811 -3.882 1.00 0.00 S ATOM 8 CE MET A 1 -6.244 1.988 -4.934 1.00 0.00 C ATOM 0 H1 MET A 1 -6.745 2.011 1.271 1.00 0.00 H new ATOM 0 H2 MET A 1 -6.402 0.382 1.607 1.00 0.00 H new ATOM 0 H3 MET A 1 -5.303 1.313 0.708 1.00 0.00 H new ATOM 0 HA MET A 1 -8.053 0.552 -0.161 1.00 0.00 H new ATOM 0 HB2 MET A 1 -7.243 2.797 -0.971 1.00 0.00 H new ATOM 0 HB3 MET A 1 -5.820 2.022 -1.640 1.00 0.00 H new ATOM 0 HG2 MET A 1 -7.305 0.549 -3.052 1.00 0.00 H new ATOM 0 HG3 MET A 1 -8.714 1.364 -2.403 1.00 0.00 H new ATOM 0 HE1 MET A 1 -5.985 2.639 -5.769 1.00 0.00 H new ATOM 0 HE2 MET A 1 -5.349 1.772 -4.350 1.00 0.00 H new ATOM 0 HE3 MET A 1 -6.661 1.056 -5.317 1.00 0.00 H new ATOM 20 N LYS A 2 -5.172 -0.394 -1.485 1.00 0.00 N ATOM 21 CA LYS A 2 -4.452 -1.538 -2.044 1.00 0.00 C ATOM 22 C LYS A 2 -2.946 -1.354 -1.882 1.00 0.00 C ATOM 23 O LYS A 2 -2.187 -1.511 -2.839 1.00 0.00 O ATOM 24 CB LYS A 2 -4.796 -1.693 -3.532 1.00 0.00 C ATOM 25 CG LYS A 2 -4.474 -3.119 -3.999 1.00 0.00 C ATOM 26 CD LYS A 2 -4.955 -3.317 -5.442 1.00 0.00 C ATOM 27 CE LYS A 2 -4.032 -2.580 -6.420 1.00 0.00 C ATOM 28 NZ LYS A 2 -4.301 -3.057 -7.806 1.00 0.00 N ATOM 0 H LYS A 2 -4.692 0.500 -1.591 1.00 0.00 H new ATOM 0 HA LYS A 2 -4.755 -2.436 -1.505 1.00 0.00 H new ATOM 0 HB2 LYS A 2 -5.852 -1.478 -3.694 1.00 0.00 H new ATOM 0 HB3 LYS A 2 -4.230 -0.972 -4.122 1.00 0.00 H new ATOM 0 HG2 LYS A 2 -3.401 -3.298 -3.937 1.00 0.00 H new ATOM 0 HG3 LYS A 2 -4.957 -3.844 -3.343 1.00 0.00 H new ATOM 0 HD2 LYS A 2 -4.975 -4.380 -5.682 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -5.975 -2.947 -5.546 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -4.198 -1.505 -6.355 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -2.989 -2.758 -6.158 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -3.676 -2.559 -8.472 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -4.122 -4.080 -7.862 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -5.293 -2.866 -8.053 1.00 0.00 H new ATOM 42 N ASP A 3 -2.521 -1.028 -0.663 1.00 0.00 N ATOM 43 CA ASP A 3 -1.103 -0.829 -0.364 1.00 0.00 C ATOM 44 C ASP A 3 -0.675 -1.759 0.773 1.00 0.00 C ATOM 45 O ASP A 3 -0.683 -1.366 1.939 1.00 0.00 O ATOM 46 CB ASP A 3 -0.852 0.625 0.045 1.00 0.00 C ATOM 47 CG ASP A 3 0.648 0.908 0.039 1.00 0.00 C ATOM 48 OD1 ASP A 3 1.395 0.002 -0.291 1.00 0.00 O ATOM 49 OD2 ASP A 3 1.026 2.023 0.357 1.00 0.00 O ATOM 0 H ASP A 3 -3.140 -0.896 0.137 1.00 0.00 H new ATOM 0 HA ASP A 3 -0.521 -1.057 -1.257 1.00 0.00 H new ATOM 0 HB2 ASP A 3 -1.362 1.300 -0.642 1.00 0.00 H new ATOM 0 HB3 ASP A 3 -1.263 0.810 1.037 1.00 0.00 H new ATOM 54 N PRO A 4 -0.308 -2.978 0.457 1.00 0.00 N ATOM 55 CA PRO A 4 0.128 -3.976 1.478 1.00 0.00 C ATOM 56 C PRO A 4 1.255 -3.436 2.359 1.00 0.00 C ATOM 57 O PRO A 4 1.508 -3.955 3.446 1.00 0.00 O ATOM 58 CB PRO A 4 0.599 -5.180 0.642 1.00 0.00 C ATOM 59 CG PRO A 4 -0.108 -5.044 -0.669 1.00 0.00 C ATOM 60 CD PRO A 4 -0.277 -3.541 -0.903 1.00 0.00 C ATOM 0 HA PRO A 4 -0.673 -4.232 2.172 1.00 0.00 H new ATOM 0 HB2 PRO A 4 1.681 -5.169 0.510 1.00 0.00 H new ATOM 0 HB3 PRO A 4 0.347 -6.122 1.130 1.00 0.00 H new ATOM 0 HG2 PRO A 4 0.469 -5.502 -1.473 1.00 0.00 H new ATOM 0 HG3 PRO A 4 -1.075 -5.546 -0.645 1.00 0.00 H new ATOM 0 HD2 PRO A 4 0.547 -3.131 -1.487 1.00 0.00 H new ATOM 0 HD3 PRO A 4 -1.195 -3.321 -1.449 1.00 0.00 H new ATOM 68 N LYS A 5 1.927 -2.396 1.877 1.00 0.00 N ATOM 69 CA LYS A 5 3.025 -1.795 2.624 1.00 0.00 C ATOM 70 C LYS A 5 2.501 -0.968 3.797 1.00 0.00 C ATOM 71 O LYS A 5 3.261 -0.609 4.696 1.00 0.00 O ATOM 72 CB LYS A 5 3.849 -0.895 1.694 1.00 0.00 C ATOM 73 CG LYS A 5 4.522 -1.741 0.594 1.00 0.00 C ATOM 74 CD LYS A 5 5.875 -2.280 1.089 1.00 0.00 C ATOM 75 CE LYS A 5 6.308 -3.472 0.228 1.00 0.00 C ATOM 76 NZ LYS A 5 5.353 -4.599 0.427 1.00 0.00 N ATOM 0 H LYS A 5 1.732 -1.954 0.978 1.00 0.00 H new ATOM 0 HA LYS A 5 3.651 -2.596 3.017 1.00 0.00 H new ATOM 0 HB2 LYS A 5 3.205 -0.141 1.241 1.00 0.00 H new ATOM 0 HB3 LYS A 5 4.607 -0.363 2.269 1.00 0.00 H new ATOM 0 HG2 LYS A 5 3.872 -2.571 0.315 1.00 0.00 H new ATOM 0 HG3 LYS A 5 4.669 -1.136 -0.301 1.00 0.00 H new ATOM 0 HD2 LYS A 5 6.629 -1.494 1.042 1.00 0.00 H new ATOM 0 HD3 LYS A 5 5.795 -2.584 2.133 1.00 0.00 H new ATOM 0 HE2 LYS A 5 6.335 -3.185 -0.823 1.00 0.00 H new ATOM 0 HE3 LYS A 5 7.317 -3.783 0.499 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 5.390 -5.234 -0.395 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 5.613 -5.127 1.284 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 4.389 -4.223 0.531 1.00 0.00 H new ATOM 90 N THR A 6 1.199 -0.669 3.786 1.00 0.00 N ATOM 91 CA THR A 6 0.582 0.122 4.859 1.00 0.00 C ATOM 92 C THR A 6 -0.421 -0.720 5.641 1.00 0.00 C ATOM 93 O THR A 6 -0.672 -0.471 6.821 1.00 0.00 O ATOM 94 CB THR A 6 -0.141 1.335 4.262 1.00 0.00 C ATOM 95 OG1 THR A 6 0.747 2.042 3.409 1.00 0.00 O ATOM 96 CG2 THR A 6 -0.627 2.264 5.381 1.00 0.00 C ATOM 0 H THR A 6 0.554 -0.960 3.052 1.00 0.00 H new ATOM 0 HA THR A 6 1.370 0.455 5.534 1.00 0.00 H new ATOM 0 HB THR A 6 -1.002 0.990 3.690 1.00 0.00 H new ATOM 0 HG1 THR A 6 0.486 1.901 2.475 1.00 0.00 H new ATOM 0 HG21 THR A 6 -1.139 3.122 4.945 1.00 0.00 H new ATOM 0 HG22 THR A 6 -1.315 1.723 6.030 1.00 0.00 H new ATOM 0 HG23 THR A 6 0.227 2.609 5.964 1.00 0.00 H new ATOM 104 N LEU A 7 -0.998 -1.716 4.976 1.00 0.00 N ATOM 105 CA LEU A 7 -1.980 -2.586 5.622 1.00 0.00 C ATOM 106 C LEU A 7 -1.286 -3.747 6.328 1.00 0.00 C ATOM 107 O LEU A 7 -1.476 -3.958 7.525 1.00 0.00 O ATOM 108 CB LEU A 7 -2.970 -3.129 4.573 1.00 0.00 C ATOM 109 CG LEU A 7 -4.106 -2.120 4.330 1.00 0.00 C ATOM 110 CD1 LEU A 7 -4.992 -1.970 5.587 1.00 0.00 C ATOM 111 CD2 LEU A 7 -3.496 -0.764 3.942 1.00 0.00 C ATOM 0 H LEU A 7 -0.807 -1.941 4.000 1.00 0.00 H new ATOM 0 HA LEU A 7 -2.525 -2.003 6.364 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -2.446 -3.327 3.638 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -3.385 -4.078 4.913 1.00 0.00 H new ATOM 0 HG LEU A 7 -4.739 -2.484 3.521 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -5.787 -1.251 5.388 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -5.431 -2.935 5.840 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -4.384 -1.618 6.420 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -4.294 -0.042 3.768 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -2.856 -0.409 4.749 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -2.905 -0.878 3.033 1.00 0.00 H new ATOM 123 N LEU A 8 -0.487 -4.502 5.586 1.00 0.00 N ATOM 124 CA LEU A 8 0.212 -5.637 6.173 1.00 0.00 C ATOM 125 C LEU A 8 1.249 -5.156 7.188 1.00 0.00 C ATOM 126 O LEU A 8 1.490 -5.811 8.202 1.00 0.00 O ATOM 127 CB LEU A 8 0.885 -6.485 5.065 1.00 0.00 C ATOM 128 CG LEU A 8 0.658 -7.995 5.304 1.00 0.00 C ATOM 129 CD1 LEU A 8 1.162 -8.396 6.703 1.00 0.00 C ATOM 130 CD2 LEU A 8 -0.841 -8.348 5.152 1.00 0.00 C ATOM 0 H LEU A 8 -0.308 -4.353 4.593 1.00 0.00 H new ATOM 0 HA LEU A 8 -0.513 -6.263 6.693 1.00 0.00 H new ATOM 0 HB2 LEU A 8 0.482 -6.203 4.092 1.00 0.00 H new ATOM 0 HB3 LEU A 8 1.954 -6.274 5.041 1.00 0.00 H new ATOM 0 HG LEU A 8 1.222 -8.552 4.556 1.00 0.00 H new ATOM 0 HD11 LEU A 8 0.996 -9.462 6.858 1.00 0.00 H new ATOM 0 HD12 LEU A 8 2.227 -8.180 6.782 1.00 0.00 H new ATOM 0 HD13 LEU A 8 0.620 -7.830 7.461 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -0.983 -9.415 5.324 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -1.423 -7.783 5.880 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -1.174 -8.095 4.145 1.00 0.00 H new ATOM 142 N ARG A 9 1.870 -4.018 6.894 1.00 0.00 N ATOM 143 CA ARG A 9 2.894 -3.469 7.774 1.00 0.00 C ATOM 144 C ARG A 9 2.298 -3.151 9.143 1.00 0.00 C ATOM 145 O ARG A 9 3.017 -3.057 10.138 1.00 0.00 O ATOM 146 CB ARG A 9 3.482 -2.201 7.149 1.00 0.00 C ATOM 147 CG ARG A 9 4.667 -1.711 7.984 1.00 0.00 C ATOM 148 CD ARG A 9 5.218 -0.417 7.383 1.00 0.00 C ATOM 149 NE ARG A 9 6.430 -0.017 8.090 1.00 0.00 N ATOM 150 CZ ARG A 9 7.609 -0.551 7.791 1.00 0.00 C ATOM 151 NH1 ARG A 9 7.698 -1.454 6.854 1.00 0.00 N ATOM 152 NH2 ARG A 9 8.679 -0.171 8.436 1.00 0.00 N ATOM 0 H ARG A 9 1.684 -3.462 6.059 1.00 0.00 H new ATOM 0 HA ARG A 9 3.686 -4.206 7.903 1.00 0.00 H new ATOM 0 HB2 ARG A 9 3.805 -2.404 6.128 1.00 0.00 H new ATOM 0 HB3 ARG A 9 2.719 -1.425 7.094 1.00 0.00 H new ATOM 0 HG2 ARG A 9 4.353 -1.541 9.014 1.00 0.00 H new ATOM 0 HG3 ARG A 9 5.446 -2.473 8.010 1.00 0.00 H new ATOM 0 HD2 ARG A 9 5.435 -0.561 6.325 1.00 0.00 H new ATOM 0 HD3 ARG A 9 4.470 0.373 7.450 1.00 0.00 H new ATOM 0 HE ARG A 9 6.371 0.685 8.827 1.00 0.00 H new ATOM 0 HH11 ARG A 9 6.862 -1.750 6.350 1.00 0.00 H new ATOM 0 HH12 ARG A 9 8.604 -1.864 6.625 1.00 0.00 H new ATOM 0 HH21 ARG A 9 8.609 0.535 9.169 1.00 0.00 H new ATOM 0 HH22 ARG A 9 9.585 -0.580 8.207 1.00 0.00 H new ATOM 166 N VAL A 10 0.976 -2.999 9.194 1.00 0.00 N ATOM 167 CA VAL A 10 0.302 -2.699 10.453 1.00 0.00 C ATOM 168 C VAL A 10 0.671 -3.727 11.522 1.00 0.00 C ATOM 169 O VAL A 10 0.783 -3.387 12.698 1.00 0.00 O ATOM 170 CB VAL A 10 -1.228 -2.678 10.248 1.00 0.00 C ATOM 171 CG1 VAL A 10 -1.787 -4.110 10.258 1.00 0.00 C ATOM 172 CG2 VAL A 10 -1.887 -1.865 11.374 1.00 0.00 C ATOM 0 H VAL A 10 0.357 -3.078 8.387 1.00 0.00 H new ATOM 0 HA VAL A 10 0.629 -1.715 10.790 1.00 0.00 H new ATOM 0 HB VAL A 10 -1.448 -2.218 9.285 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -2.867 -4.080 10.112 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -1.328 -4.685 9.454 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -1.563 -4.581 11.215 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -2.967 -1.851 11.228 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -1.657 -2.323 12.336 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -1.505 -0.844 11.357 1.00 0.00 H new ATOM 182 N SER A 11 0.849 -4.976 11.118 1.00 0.00 N ATOM 183 CA SER A 11 1.190 -6.024 12.074 1.00 0.00 C ATOM 184 C SER A 11 2.450 -5.655 12.853 1.00 0.00 C ATOM 185 O SER A 11 2.487 -5.789 14.074 1.00 0.00 O ATOM 186 CB SER A 11 1.421 -7.340 11.333 1.00 0.00 C ATOM 187 OG SER A 11 1.757 -8.355 12.271 1.00 0.00 O ATOM 0 H SER A 11 0.765 -5.288 10.150 1.00 0.00 H new ATOM 0 HA SER A 11 0.363 -6.134 12.775 1.00 0.00 H new ATOM 0 HB2 SER A 11 0.525 -7.622 10.781 1.00 0.00 H new ATOM 0 HB3 SER A 11 2.222 -7.224 10.603 1.00 0.00 H new ATOM 0 HG SER A 11 1.904 -9.201 11.799 1.00 0.00 H new ATOM 193 N ILE A 12 3.473 -5.179 12.157 1.00 0.00 N ATOM 194 CA ILE A 12 4.707 -4.790 12.833 1.00 0.00 C ATOM 195 C ILE A 12 4.448 -3.594 13.749 1.00 0.00 C ATOM 196 O ILE A 12 4.903 -3.565 14.891 1.00 0.00 O ATOM 197 CB ILE A 12 5.778 -4.434 11.801 1.00 0.00 C ATOM 198 CG1 ILE A 12 6.183 -5.697 11.040 1.00 0.00 C ATOM 199 CG2 ILE A 12 7.002 -3.832 12.497 1.00 0.00 C ATOM 200 CD1 ILE A 12 7.049 -5.316 9.839 1.00 0.00 C ATOM 0 H ILE A 12 3.477 -5.054 11.145 1.00 0.00 H new ATOM 0 HA ILE A 12 5.059 -5.627 13.435 1.00 0.00 H new ATOM 0 HB ILE A 12 5.376 -3.699 11.104 1.00 0.00 H new ATOM 0 HG12 ILE A 12 6.732 -6.370 11.698 1.00 0.00 H new ATOM 0 HG13 ILE A 12 5.295 -6.233 10.705 1.00 0.00 H new ATOM 0 HG21 ILE A 12 7.758 -3.582 11.752 1.00 0.00 H new ATOM 0 HG22 ILE A 12 6.709 -2.929 13.033 1.00 0.00 H new ATOM 0 HG23 ILE A 12 7.412 -4.555 13.202 1.00 0.00 H new ATOM 0 HD11 ILE A 12 7.337 -6.217 9.298 1.00 0.00 H new ATOM 0 HD12 ILE A 12 6.484 -4.660 9.177 1.00 0.00 H new ATOM 0 HD13 ILE A 12 7.944 -4.799 10.185 1.00 0.00 H new ATOM 212 N ILE A 13 3.731 -2.602 13.237 1.00 0.00 N ATOM 213 CA ILE A 13 3.442 -1.406 14.023 1.00 0.00 C ATOM 214 C ILE A 13 2.580 -1.762 15.231 1.00 0.00 C ATOM 215 O ILE A 13 2.834 -1.308 16.347 1.00 0.00 O ATOM 216 CB ILE A 13 2.711 -0.376 13.159 1.00 0.00 C ATOM 217 CG1 ILE A 13 3.490 -0.141 11.857 1.00 0.00 C ATOM 218 CG2 ILE A 13 2.587 0.945 13.922 1.00 0.00 C ATOM 219 CD1 ILE A 13 4.936 0.301 12.123 1.00 0.00 C ATOM 0 H ILE A 13 3.343 -2.599 12.294 1.00 0.00 H new ATOM 0 HA ILE A 13 4.384 -0.983 14.370 1.00 0.00 H new ATOM 0 HB ILE A 13 1.716 -0.753 12.922 1.00 0.00 H new ATOM 0 HG12 ILE A 13 3.494 -1.057 11.267 1.00 0.00 H new ATOM 0 HG13 ILE A 13 2.982 0.619 11.263 1.00 0.00 H new ATOM 0 HG21 ILE A 13 2.066 1.675 13.303 1.00 0.00 H new ATOM 0 HG22 ILE A 13 2.025 0.783 14.842 1.00 0.00 H new ATOM 0 HG23 ILE A 13 3.581 1.319 14.165 1.00 0.00 H new ATOM 0 HD11 ILE A 13 5.450 0.456 11.174 1.00 0.00 H new ATOM 0 HD12 ILE A 13 4.933 1.232 12.690 1.00 0.00 H new ATOM 0 HD13 ILE A 13 5.453 -0.470 12.694 1.00 0.00 H new ATOM 231 N GLY A 14 1.564 -2.584 15.001 1.00 0.00 N ATOM 232 CA GLY A 14 0.674 -3.008 16.077 1.00 0.00 C ATOM 233 C GLY A 14 1.387 -3.971 17.021 1.00 0.00 C ATOM 234 O GLY A 14 1.247 -3.883 18.240 1.00 0.00 O ATOM 0 H GLY A 14 1.336 -2.969 14.085 1.00 0.00 H new ATOM 0 HA2 GLY A 14 0.327 -2.137 16.633 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -0.209 -3.490 15.657 1.00 0.00 H new ATOM 238 N THR A 15 2.148 -4.894 16.444 1.00 0.00 N ATOM 239 CA THR A 15 2.880 -5.877 17.235 1.00 0.00 C ATOM 240 C THR A 15 3.990 -5.205 18.035 1.00 0.00 C ATOM 241 O THR A 15 4.458 -5.746 19.036 1.00 0.00 O ATOM 242 CB THR A 15 3.490 -6.948 16.326 1.00 0.00 C ATOM 243 OG1 THR A 15 2.452 -7.658 15.665 1.00 0.00 O ATOM 244 CG2 THR A 15 4.319 -7.922 17.168 1.00 0.00 C ATOM 0 H THR A 15 2.274 -4.983 15.436 1.00 0.00 H new ATOM 0 HA THR A 15 2.176 -6.345 17.923 1.00 0.00 H new ATOM 0 HB THR A 15 4.132 -6.471 15.585 1.00 0.00 H new ATOM 0 HG1 THR A 15 2.035 -7.078 14.994 1.00 0.00 H new ATOM 0 HG21 THR A 15 4.753 -8.684 16.521 1.00 0.00 H new ATOM 0 HG22 THR A 15 5.117 -7.378 17.673 1.00 0.00 H new ATOM 0 HG23 THR A 15 3.678 -8.398 17.910 1.00 0.00 H new ATOM 252 N THR A 16 4.408 -4.023 17.589 1.00 0.00 N ATOM 253 CA THR A 16 5.463 -3.286 18.278 1.00 0.00 C ATOM 254 C THR A 16 4.885 -2.510 19.459 1.00 0.00 C ATOM 255 O THR A 16 5.524 -2.373 20.499 1.00 0.00 O ATOM 256 CB THR A 16 6.145 -2.320 17.296 1.00 0.00 C ATOM 257 OG1 THR A 16 5.161 -1.728 16.460 1.00 0.00 O ATOM 258 CG2 THR A 16 7.163 -3.076 16.429 1.00 0.00 C ATOM 0 H THR A 16 4.036 -3.558 16.761 1.00 0.00 H new ATOM 0 HA THR A 16 6.200 -3.994 18.656 1.00 0.00 H new ATOM 0 HB THR A 16 6.666 -1.547 17.861 1.00 0.00 H new ATOM 0 HG1 THR A 16 4.304 -1.699 16.934 1.00 0.00 H new ATOM 0 HG21 THR A 16 7.639 -2.381 15.738 1.00 0.00 H new ATOM 0 HG22 THR A 16 7.921 -3.528 17.069 1.00 0.00 H new ATOM 0 HG23 THR A 16 6.652 -3.856 15.865 1.00 0.00 H new ATOM 266 N LEU A 17 3.669 -2.001 19.294 1.00 0.00 N ATOM 267 CA LEU A 17 3.023 -1.244 20.362 1.00 0.00 C ATOM 268 C LEU A 17 2.603 -2.179 21.491 1.00 0.00 C ATOM 269 O LEU A 17 2.851 -1.907 22.666 1.00 0.00 O ATOM 270 CB LEU A 17 1.800 -0.506 19.800 1.00 0.00 C ATOM 271 CG LEU A 17 1.204 0.460 20.863 1.00 0.00 C ATOM 272 CD1 LEU A 17 0.748 1.763 20.195 1.00 0.00 C ATOM 273 CD2 LEU A 17 -0.008 -0.182 21.553 1.00 0.00 C ATOM 0 H LEU A 17 3.116 -2.096 18.442 1.00 0.00 H new ATOM 0 HA LEU A 17 3.728 -0.515 20.762 1.00 0.00 H new ATOM 0 HB2 LEU A 17 2.085 0.056 18.910 1.00 0.00 H new ATOM 0 HB3 LEU A 17 1.043 -1.228 19.492 1.00 0.00 H new ATOM 0 HG LEU A 17 1.979 0.669 21.601 1.00 0.00 H new ATOM 0 HD11 LEU A 17 0.332 2.432 20.948 1.00 0.00 H new ATOM 0 HD12 LEU A 17 1.600 2.243 19.714 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -0.013 1.541 19.447 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -0.413 0.508 22.294 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -0.773 -0.406 20.810 1.00 0.00 H new ATOM 0 HD23 LEU A 17 0.300 -1.104 22.046 1.00 0.00 H new ATOM 285 N VAL A 18 1.970 -3.283 21.115 1.00 0.00 N ATOM 286 CA VAL A 18 1.509 -4.274 22.081 1.00 0.00 C ATOM 287 C VAL A 18 2.685 -4.989 22.741 1.00 0.00 C ATOM 288 O VAL A 18 2.666 -5.244 23.945 1.00 0.00 O ATOM 289 CB VAL A 18 0.598 -5.303 21.409 1.00 0.00 C ATOM 290 CG1 VAL A 18 0.144 -6.328 22.454 1.00 0.00 C ATOM 291 CG2 VAL A 18 -0.625 -4.596 20.816 1.00 0.00 C ATOM 0 H VAL A 18 1.763 -3.516 20.144 1.00 0.00 H new ATOM 0 HA VAL A 18 0.945 -3.744 22.849 1.00 0.00 H new ATOM 0 HB VAL A 18 1.141 -5.809 20.611 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -0.506 -7.065 21.982 1.00 0.00 H new ATOM 0 HG12 VAL A 18 1.016 -6.829 22.875 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -0.401 -5.820 23.249 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -1.273 -5.330 20.338 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -1.174 -4.091 21.611 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -0.299 -3.864 20.077 1.00 0.00 H new ATOM 301 N ALA A 19 3.699 -5.324 21.950 1.00 0.00 N ATOM 302 CA ALA A 19 4.864 -6.020 22.486 1.00 0.00 C ATOM 303 C ALA A 19 5.494 -5.190 23.601 1.00 0.00 C ATOM 304 O ALA A 19 5.715 -5.668 24.714 1.00 0.00 O ATOM 305 CB ALA A 19 5.891 -6.238 21.372 1.00 0.00 C ATOM 0 H ALA A 19 3.739 -5.129 20.950 1.00 0.00 H new ATOM 0 HA ALA A 19 4.551 -6.984 22.886 1.00 0.00 H new ATOM 0 HB1 ALA A 19 6.760 -6.758 21.775 1.00 0.00 H new ATOM 0 HB2 ALA A 19 5.445 -6.838 20.578 1.00 0.00 H new ATOM 0 HB3 ALA A 19 6.200 -5.274 20.968 1.00 0.00 H new ATOM 311 N LEU A 20 5.785 -3.938 23.266 1.00 0.00 N ATOM 312 CA LEU A 20 6.401 -3.005 24.202 1.00 0.00 C ATOM 313 C LEU A 20 5.486 -2.716 25.388 1.00 0.00 C ATOM 314 O LEU A 20 5.960 -2.574 26.514 1.00 0.00 O ATOM 315 CB LEU A 20 6.749 -1.693 23.492 1.00 0.00 C ATOM 316 CG LEU A 20 7.800 -1.946 22.404 1.00 0.00 C ATOM 317 CD1 LEU A 20 7.994 -0.662 21.590 1.00 0.00 C ATOM 318 CD2 LEU A 20 9.142 -2.369 23.025 1.00 0.00 C ATOM 0 H LEU A 20 5.602 -3.543 22.344 1.00 0.00 H new ATOM 0 HA LEU A 20 7.312 -3.470 24.578 1.00 0.00 H new ATOM 0 HB2 LEU A 20 5.852 -1.261 23.049 1.00 0.00 H new ATOM 0 HB3 LEU A 20 7.128 -0.969 24.214 1.00 0.00 H new ATOM 0 HG LEU A 20 7.452 -2.753 21.759 1.00 0.00 H new ATOM 0 HD11 LEU A 20 8.740 -0.833 20.814 1.00 0.00 H new ATOM 0 HD12 LEU A 20 7.048 -0.377 21.128 1.00 0.00 H new ATOM 0 HD13 LEU A 20 8.332 0.138 22.248 1.00 0.00 H new ATOM 0 HD21 LEU A 20 9.871 -2.543 22.233 1.00 0.00 H new ATOM 0 HD22 LEU A 20 9.503 -1.579 23.684 1.00 0.00 H new ATOM 0 HD23 LEU A 20 9.005 -3.285 23.599 1.00 0.00 H new ATOM 330 N SER A 21 4.181 -2.617 25.147 1.00 0.00 N ATOM 331 CA SER A 21 3.248 -2.331 26.232 1.00 0.00 C ATOM 332 C SER A 21 3.301 -3.436 27.281 1.00 0.00 C ATOM 333 O SER A 21 2.899 -3.246 28.424 1.00 0.00 O ATOM 334 CB SER A 21 1.834 -2.200 25.666 1.00 0.00 C ATOM 335 OG SER A 21 1.695 -0.912 25.080 1.00 0.00 O ATOM 0 H SER A 21 3.752 -2.728 24.228 1.00 0.00 H new ATOM 0 HA SER A 21 3.530 -1.393 26.710 1.00 0.00 H new ATOM 0 HB2 SER A 21 1.652 -2.975 24.922 1.00 0.00 H new ATOM 0 HB3 SER A 21 1.096 -2.337 26.457 1.00 0.00 H new ATOM 0 HG SER A 21 2.053 -0.927 24.168 1.00 0.00 H new ATOM 341 N SER A 22 3.748 -4.611 26.860 1.00 0.00 N ATOM 342 CA SER A 22 3.820 -5.760 27.758 1.00 0.00 C ATOM 343 C SER A 22 5.048 -5.667 28.666 1.00 0.00 C ATOM 344 O SER A 22 5.169 -6.421 29.632 1.00 0.00 O ATOM 345 CB SER A 22 3.854 -7.062 26.959 1.00 0.00 C ATOM 346 OG SER A 22 3.797 -8.162 27.858 1.00 0.00 O ATOM 0 H SER A 22 4.065 -4.795 25.908 1.00 0.00 H new ATOM 0 HA SER A 22 2.928 -5.755 28.384 1.00 0.00 H new ATOM 0 HB2 SER A 22 3.014 -7.099 26.265 1.00 0.00 H new ATOM 0 HB3 SER A 22 4.764 -7.112 26.361 1.00 0.00 H new ATOM 0 HG SER A 22 4.158 -7.892 28.728 1.00 0.00 H new ATOM 352 N PHE A 23 5.952 -4.737 28.355 1.00 0.00 N ATOM 353 CA PHE A 23 7.171 -4.544 29.152 1.00 0.00 C ATOM 354 C PHE A 23 7.104 -3.241 29.949 1.00 0.00 C ATOM 355 O PHE A 23 7.430 -3.225 31.136 1.00 0.00 O ATOM 356 CB PHE A 23 8.391 -4.547 28.227 1.00 0.00 C ATOM 357 CG PHE A 23 8.700 -5.966 27.805 1.00 0.00 C ATOM 358 CD1 PHE A 23 9.358 -6.824 28.693 1.00 0.00 C ATOM 359 CD2 PHE A 23 8.344 -6.419 26.529 1.00 0.00 C ATOM 360 CE1 PHE A 23 9.660 -8.135 28.307 1.00 0.00 C ATOM 361 CE2 PHE A 23 8.646 -7.731 26.141 1.00 0.00 C ATOM 362 CZ PHE A 23 9.304 -8.589 27.031 1.00 0.00 C ATOM 0 H PHE A 23 5.866 -4.105 27.559 1.00 0.00 H new ATOM 0 HA PHE A 23 7.258 -5.364 29.865 1.00 0.00 H new ATOM 0 HB2 PHE A 23 8.197 -3.929 27.350 1.00 0.00 H new ATOM 0 HB3 PHE A 23 9.250 -4.113 28.739 1.00 0.00 H new ATOM 0 HD1 PHE A 23 9.633 -6.474 29.677 1.00 0.00 H new ATOM 0 HD2 PHE A 23 7.836 -5.757 25.843 1.00 0.00 H new ATOM 0 HE1 PHE A 23 10.168 -8.797 28.993 1.00 0.00 H new ATOM 0 HE2 PHE A 23 8.372 -8.080 25.157 1.00 0.00 H new ATOM 0 HZ PHE A 23 9.537 -9.601 26.733 1.00 0.00 H new ATOM 372 N THR A 24 6.682 -2.155 29.305 1.00 0.00 N ATOM 373 CA THR A 24 6.583 -0.865 29.989 1.00 0.00 C ATOM 374 C THR A 24 5.987 -1.024 31.402 1.00 0.00 C ATOM 375 O THR A 24 6.561 -0.517 32.367 1.00 0.00 O ATOM 376 CB THR A 24 5.737 0.120 29.143 1.00 0.00 C ATOM 377 OG1 THR A 24 5.381 -0.504 27.918 1.00 0.00 O ATOM 378 CG2 THR A 24 6.518 1.407 28.836 1.00 0.00 C ATOM 0 H THR A 24 6.406 -2.140 28.323 1.00 0.00 H new ATOM 0 HA THR A 24 7.588 -0.459 30.102 1.00 0.00 H new ATOM 0 HB THR A 24 4.847 0.383 29.715 1.00 0.00 H new ATOM 0 HG1 THR A 24 4.985 0.160 27.316 1.00 0.00 H new ATOM 0 HG21 THR A 24 5.897 2.077 28.241 1.00 0.00 H new ATOM 0 HG22 THR A 24 6.791 1.899 29.770 1.00 0.00 H new ATOM 0 HG23 THR A 24 7.422 1.160 28.279 1.00 0.00 H new ATOM 386 N PRO A 25 4.867 -1.703 31.557 1.00 0.00 N ATOM 387 CA PRO A 25 4.241 -1.891 32.901 1.00 0.00 C ATOM 388 C PRO A 25 5.266 -2.272 33.965 1.00 0.00 C ATOM 389 O PRO A 25 5.205 -1.788 35.092 1.00 0.00 O ATOM 390 CB PRO A 25 3.232 -3.024 32.671 1.00 0.00 C ATOM 391 CG PRO A 25 2.850 -2.919 31.228 1.00 0.00 C ATOM 392 CD PRO A 25 4.062 -2.326 30.490 1.00 0.00 C ATOM 0 HA PRO A 25 3.781 -0.976 33.274 1.00 0.00 H new ATOM 0 HB2 PRO A 25 3.673 -3.996 32.892 1.00 0.00 H new ATOM 0 HB3 PRO A 25 2.362 -2.914 33.318 1.00 0.00 H new ATOM 0 HG2 PRO A 25 2.592 -3.898 30.824 1.00 0.00 H new ATOM 0 HG3 PRO A 25 1.973 -2.283 31.105 1.00 0.00 H new ATOM 0 HD2 PRO A 25 4.625 -3.098 29.965 1.00 0.00 H new ATOM 0 HD3 PRO A 25 3.754 -1.593 29.744 1.00 0.00 H new ATOM 400 N VAL A 26 6.204 -3.147 33.629 1.00 0.00 N ATOM 401 CA VAL A 26 7.195 -3.557 34.616 1.00 0.00 C ATOM 402 C VAL A 26 7.783 -2.331 35.314 1.00 0.00 C ATOM 403 O VAL A 26 7.883 -2.304 36.538 1.00 0.00 O ATOM 404 CB VAL A 26 8.302 -4.365 33.938 1.00 0.00 C ATOM 405 CG1 VAL A 26 9.397 -4.718 34.948 1.00 0.00 C ATOM 406 CG2 VAL A 26 7.701 -5.654 33.374 1.00 0.00 C ATOM 0 H VAL A 26 6.300 -3.576 32.709 1.00 0.00 H new ATOM 0 HA VAL A 26 6.711 -4.183 35.365 1.00 0.00 H new ATOM 0 HB VAL A 26 8.740 -3.771 33.136 1.00 0.00 H new ATOM 0 HG11 VAL A 26 10.178 -5.293 34.451 1.00 0.00 H new ATOM 0 HG12 VAL A 26 9.824 -3.802 35.356 1.00 0.00 H new ATOM 0 HG13 VAL A 26 8.969 -5.310 35.757 1.00 0.00 H new ATOM 0 HG21 VAL A 26 8.483 -6.238 32.888 1.00 0.00 H new ATOM 0 HG22 VAL A 26 7.264 -6.237 34.185 1.00 0.00 H new ATOM 0 HG23 VAL A 26 6.928 -5.407 32.647 1.00 0.00 H new ATOM 416 N LEU A 27 8.198 -1.326 34.551 1.00 0.00 N ATOM 417 CA LEU A 27 8.784 -0.135 35.159 1.00 0.00 C ATOM 418 C LEU A 27 7.779 0.586 36.064 1.00 0.00 C ATOM 419 O LEU A 27 8.072 0.857 37.228 1.00 0.00 O ATOM 420 CB LEU A 27 9.259 0.802 34.039 1.00 0.00 C ATOM 421 CG LEU A 27 9.843 2.106 34.603 1.00 0.00 C ATOM 422 CD1 LEU A 27 11.149 1.826 35.355 1.00 0.00 C ATOM 423 CD2 LEU A 27 10.114 3.073 33.447 1.00 0.00 C ATOM 0 H LEU A 27 8.142 -1.309 33.533 1.00 0.00 H new ATOM 0 HA LEU A 27 9.626 -0.433 35.784 1.00 0.00 H new ATOM 0 HB2 LEU A 27 10.013 0.296 33.436 1.00 0.00 H new ATOM 0 HB3 LEU A 27 8.424 1.033 33.378 1.00 0.00 H new ATOM 0 HG LEU A 27 9.129 2.547 35.298 1.00 0.00 H new ATOM 0 HD11 LEU A 27 11.550 2.760 35.748 1.00 0.00 H new ATOM 0 HD12 LEU A 27 10.954 1.139 36.179 1.00 0.00 H new ATOM 0 HD13 LEU A 27 11.873 1.379 34.673 1.00 0.00 H new ATOM 0 HD21 LEU A 27 10.529 4.002 33.839 1.00 0.00 H new ATOM 0 HD22 LEU A 27 10.825 2.622 32.754 1.00 0.00 H new ATOM 0 HD23 LEU A 27 9.182 3.285 32.924 1.00 0.00 H new ATOM 435 N VAL A 28 6.606 0.908 35.522 1.00 0.00 N ATOM 436 CA VAL A 28 5.586 1.628 36.290 1.00 0.00 C ATOM 437 C VAL A 28 5.201 0.862 37.559 1.00 0.00 C ATOM 438 O VAL A 28 4.887 1.475 38.579 1.00 0.00 O ATOM 439 CB VAL A 28 4.345 1.920 35.407 1.00 0.00 C ATOM 440 CG1 VAL A 28 4.775 1.986 33.939 1.00 0.00 C ATOM 441 CG2 VAL A 28 3.268 0.834 35.571 1.00 0.00 C ATOM 0 H VAL A 28 6.338 0.685 34.563 1.00 0.00 H new ATOM 0 HA VAL A 28 6.009 2.582 36.604 1.00 0.00 H new ATOM 0 HB VAL A 28 3.919 2.872 35.723 1.00 0.00 H new ATOM 0 HG11 VAL A 28 3.906 2.191 33.314 1.00 0.00 H new ATOM 0 HG12 VAL A 28 5.510 2.781 33.811 1.00 0.00 H new ATOM 0 HG13 VAL A 28 5.216 1.033 33.646 1.00 0.00 H new ATOM 0 HG21 VAL A 28 2.413 1.071 34.938 1.00 0.00 H new ATOM 0 HG22 VAL A 28 3.679 -0.133 35.279 1.00 0.00 H new ATOM 0 HG23 VAL A 28 2.948 0.793 36.612 1.00 0.00 H new ATOM 451 N ILE A 29 5.219 -0.465 37.495 1.00 0.00 N ATOM 452 CA ILE A 29 4.861 -1.278 38.657 1.00 0.00 C ATOM 453 C ILE A 29 5.490 -0.706 39.933 1.00 0.00 C ATOM 454 O ILE A 29 4.917 -0.822 41.016 1.00 0.00 O ATOM 455 CB ILE A 29 5.298 -2.751 38.437 1.00 0.00 C ATOM 456 CG1 ILE A 29 4.337 -3.708 39.165 1.00 0.00 C ATOM 457 CG2 ILE A 29 6.725 -2.989 38.966 1.00 0.00 C ATOM 458 CD1 ILE A 29 4.663 -5.152 38.776 1.00 0.00 C ATOM 0 H ILE A 29 5.474 -0.997 36.663 1.00 0.00 H new ATOM 0 HA ILE A 29 3.778 -1.255 38.777 1.00 0.00 H new ATOM 0 HB ILE A 29 5.275 -2.944 37.365 1.00 0.00 H new ATOM 0 HG12 ILE A 29 4.428 -3.581 40.244 1.00 0.00 H new ATOM 0 HG13 ILE A 29 3.305 -3.474 38.903 1.00 0.00 H new ATOM 0 HG21 ILE A 29 7.006 -4.029 38.799 1.00 0.00 H new ATOM 0 HG22 ILE A 29 7.422 -2.336 38.440 1.00 0.00 H new ATOM 0 HG23 ILE A 29 6.758 -2.771 40.033 1.00 0.00 H new ATOM 0 HD11 ILE A 29 3.983 -5.830 39.291 1.00 0.00 H new ATOM 0 HD12 ILE A 29 4.549 -5.273 37.699 1.00 0.00 H new ATOM 0 HD13 ILE A 29 5.690 -5.383 39.061 1.00 0.00 H new ATOM 470 N LEU A 30 6.674 -0.110 39.799 1.00 0.00 N ATOM 471 CA LEU A 30 7.365 0.451 40.957 1.00 0.00 C ATOM 472 C LEU A 30 6.382 1.251 41.815 1.00 0.00 C ATOM 473 O LEU A 30 6.543 1.348 43.029 1.00 0.00 O ATOM 474 CB LEU A 30 8.552 1.339 40.509 1.00 0.00 C ATOM 475 CG LEU A 30 9.801 1.038 41.354 1.00 0.00 C ATOM 476 CD1 LEU A 30 10.971 1.890 40.853 1.00 0.00 C ATOM 477 CD2 LEU A 30 9.531 1.367 42.829 1.00 0.00 C ATOM 0 H LEU A 30 7.168 -0.004 38.913 1.00 0.00 H new ATOM 0 HA LEU A 30 7.766 -0.367 41.556 1.00 0.00 H new ATOM 0 HB2 LEU A 30 8.768 1.163 39.455 1.00 0.00 H new ATOM 0 HB3 LEU A 30 8.284 2.391 40.608 1.00 0.00 H new ATOM 0 HG LEU A 30 10.046 -0.020 41.262 1.00 0.00 H new ATOM 0 HD11 LEU A 30 11.858 1.678 41.451 1.00 0.00 H new ATOM 0 HD12 LEU A 30 11.173 1.653 39.808 1.00 0.00 H new ATOM 0 HD13 LEU A 30 10.717 2.946 40.943 1.00 0.00 H new ATOM 0 HD21 LEU A 30 10.422 1.150 43.419 1.00 0.00 H new ATOM 0 HD22 LEU A 30 9.279 2.423 42.926 1.00 0.00 H new ATOM 0 HD23 LEU A 30 8.700 0.761 43.191 1.00 0.00 H new ATOM 489 N LEU A 31 5.373 1.830 41.178 1.00 0.00 N ATOM 490 CA LEU A 31 4.375 2.606 41.908 1.00 0.00 C ATOM 491 C LEU A 31 3.507 1.674 42.756 1.00 0.00 C ATOM 492 O LEU A 31 3.091 2.024 43.860 1.00 0.00 O ATOM 493 CB LEU A 31 3.510 3.412 40.928 1.00 0.00 C ATOM 494 CG LEU A 31 2.803 4.578 41.650 1.00 0.00 C ATOM 495 CD1 LEU A 31 2.308 5.590 40.608 1.00 0.00 C ATOM 496 CD2 LEU A 31 1.613 4.079 42.507 1.00 0.00 C ATOM 0 H LEU A 31 5.223 1.780 40.170 1.00 0.00 H new ATOM 0 HA LEU A 31 4.883 3.306 42.572 1.00 0.00 H new ATOM 0 HB2 LEU A 31 4.133 3.801 40.122 1.00 0.00 H new ATOM 0 HB3 LEU A 31 2.767 2.759 40.470 1.00 0.00 H new ATOM 0 HG LEU A 31 3.519 5.051 42.322 1.00 0.00 H new ATOM 0 HD11 LEU A 31 1.807 6.416 41.113 1.00 0.00 H new ATOM 0 HD12 LEU A 31 3.156 5.972 40.040 1.00 0.00 H new ATOM 0 HD13 LEU A 31 1.608 5.101 39.930 1.00 0.00 H new ATOM 0 HD21 LEU A 31 1.139 4.927 43.001 1.00 0.00 H new ATOM 0 HD22 LEU A 31 0.886 3.580 41.865 1.00 0.00 H new ATOM 0 HD23 LEU A 31 1.975 3.378 43.259 1.00 0.00 H new ATOM 508 N GLY A 32 3.210 0.496 42.218 1.00 0.00 N ATOM 509 CA GLY A 32 2.367 -0.465 42.924 1.00 0.00 C ATOM 510 C GLY A 32 3.086 -1.116 44.108 1.00 0.00 C ATOM 511 O GLY A 32 2.561 -1.137 45.220 1.00 0.00 O ATOM 0 H GLY A 32 3.537 0.184 41.303 1.00 0.00 H new ATOM 0 HA2 GLY A 32 1.468 0.038 43.281 1.00 0.00 H new ATOM 0 HA3 GLY A 32 2.044 -1.240 42.229 1.00 0.00 H new ATOM 515 N VAL A 33 4.266 -1.676 43.862 1.00 0.00 N ATOM 516 CA VAL A 33 5.008 -2.365 44.920 1.00 0.00 C ATOM 517 C VAL A 33 5.209 -1.468 46.143 1.00 0.00 C ATOM 518 O VAL A 33 5.038 -1.912 47.279 1.00 0.00 O ATOM 519 CB VAL A 33 6.372 -2.815 44.386 1.00 0.00 C ATOM 520 CG1 VAL A 33 6.173 -3.633 43.109 1.00 0.00 C ATOM 521 CG2 VAL A 33 7.228 -1.589 44.073 1.00 0.00 C ATOM 0 H VAL A 33 4.727 -1.669 42.952 1.00 0.00 H new ATOM 0 HA VAL A 33 4.423 -3.232 45.228 1.00 0.00 H new ATOM 0 HB VAL A 33 6.872 -3.426 45.138 1.00 0.00 H new ATOM 0 HG11 VAL A 33 7.142 -3.954 42.728 1.00 0.00 H new ATOM 0 HG12 VAL A 33 5.562 -4.508 43.329 1.00 0.00 H new ATOM 0 HG13 VAL A 33 5.673 -3.021 42.359 1.00 0.00 H new ATOM 0 HG21 VAL A 33 8.198 -1.910 43.693 1.00 0.00 H new ATOM 0 HG22 VAL A 33 6.728 -0.978 43.321 1.00 0.00 H new ATOM 0 HG23 VAL A 33 7.370 -1.003 44.981 1.00 0.00 H new ATOM 531 N VAL A 34 5.585 -0.214 45.911 1.00 0.00 N ATOM 532 CA VAL A 34 5.811 0.723 47.013 1.00 0.00 C ATOM 533 C VAL A 34 4.493 1.124 47.670 1.00 0.00 C ATOM 534 O VAL A 34 4.422 1.306 48.885 1.00 0.00 O ATOM 535 CB VAL A 34 6.521 1.974 46.493 1.00 0.00 C ATOM 536 CG1 VAL A 34 5.619 2.688 45.486 1.00 0.00 C ATOM 537 CG2 VAL A 34 6.827 2.919 47.657 1.00 0.00 C ATOM 0 H VAL A 34 5.739 0.176 44.981 1.00 0.00 H new ATOM 0 HA VAL A 34 6.434 0.227 47.758 1.00 0.00 H new ATOM 0 HB VAL A 34 7.454 1.683 46.010 1.00 0.00 H new ATOM 0 HG11 VAL A 34 6.123 3.580 45.114 1.00 0.00 H new ATOM 0 HG12 VAL A 34 5.403 2.019 44.653 1.00 0.00 H new ATOM 0 HG13 VAL A 34 4.686 2.975 45.972 1.00 0.00 H new ATOM 0 HG21 VAL A 34 7.333 3.808 47.280 1.00 0.00 H new ATOM 0 HG22 VAL A 34 5.896 3.210 48.144 1.00 0.00 H new ATOM 0 HG23 VAL A 34 7.470 2.413 48.377 1.00 0.00 H new ATOM 547 N GLY A 35 3.455 1.280 46.854 1.00 0.00 N ATOM 548 CA GLY A 35 2.147 1.679 47.361 1.00 0.00 C ATOM 549 C GLY A 35 1.582 0.625 48.305 1.00 0.00 C ATOM 550 O GLY A 35 0.960 0.951 49.317 1.00 0.00 O ATOM 0 H GLY A 35 3.494 1.137 45.845 1.00 0.00 H new ATOM 0 HA2 GLY A 35 2.231 2.632 47.883 1.00 0.00 H new ATOM 0 HA3 GLY A 35 1.461 1.831 46.528 1.00 0.00 H new ATOM 554 N LEU A 36 1.807 -0.638 47.969 1.00 0.00 N ATOM 555 CA LEU A 36 1.320 -1.737 48.793 1.00 0.00 C ATOM 556 C LEU A 36 2.000 -1.730 50.159 1.00 0.00 C ATOM 557 O LEU A 36 1.439 -2.222 51.137 1.00 0.00 O ATOM 558 CB LEU A 36 1.578 -3.078 48.096 1.00 0.00 C ATOM 559 CG LEU A 36 0.704 -3.195 46.840 1.00 0.00 C ATOM 560 CD1 LEU A 36 1.170 -4.401 46.018 1.00 0.00 C ATOM 561 CD2 LEU A 36 -0.781 -3.367 47.217 1.00 0.00 C ATOM 0 H LEU A 36 2.321 -0.927 47.136 1.00 0.00 H new ATOM 0 HA LEU A 36 0.247 -1.606 48.934 1.00 0.00 H new ATOM 0 HB2 LEU A 36 2.631 -3.160 47.825 1.00 0.00 H new ATOM 0 HB3 LEU A 36 1.360 -3.900 48.778 1.00 0.00 H new ATOM 0 HG LEU A 36 0.804 -2.281 46.255 1.00 0.00 H new ATOM 0 HD11 LEU A 36 0.554 -4.491 45.123 1.00 0.00 H new ATOM 0 HD12 LEU A 36 2.212 -4.264 45.729 1.00 0.00 H new ATOM 0 HD13 LEU A 36 1.076 -5.307 46.616 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -1.380 -3.448 46.310 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -0.903 -4.271 47.814 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -1.112 -2.504 47.795 1.00 0.00 H new ATOM 573 N SER A 37 3.211 -1.183 50.223 1.00 0.00 N ATOM 574 CA SER A 37 3.942 -1.134 51.484 1.00 0.00 C ATOM 575 C SER A 37 3.187 -0.287 52.502 1.00 0.00 C ATOM 576 O SER A 37 3.058 -0.649 53.665 1.00 0.00 O ATOM 577 CB SER A 37 5.332 -0.534 51.261 1.00 0.00 C ATOM 578 OG SER A 37 5.211 0.870 51.075 1.00 0.00 O ATOM 0 H SER A 37 3.701 -0.773 49.428 1.00 0.00 H new ATOM 0 HA SER A 37 4.040 -2.151 51.865 1.00 0.00 H new ATOM 0 HB2 SER A 37 5.974 -0.746 52.116 1.00 0.00 H new ATOM 0 HB3 SER A 37 5.802 -0.989 50.389 1.00 0.00 H new ATOM 0 HG SER A 37 5.313 1.084 50.124 1.00 0.00 H new ATOM 584 N ALA A 38 2.645 0.827 52.034 1.00 0.00 N ATOM 585 CA ALA A 38 1.875 1.696 52.912 1.00 0.00 C ATOM 586 C ALA A 38 0.759 0.896 53.572 1.00 0.00 C ATOM 587 O ALA A 38 0.521 1.033 54.772 1.00 0.00 O ATOM 588 CB ALA A 38 1.301 2.886 52.138 1.00 0.00 C ATOM 0 H ALA A 38 2.721 1.147 51.069 1.00 0.00 H new ATOM 0 HA ALA A 38 2.536 2.090 53.684 1.00 0.00 H new ATOM 0 HB1 ALA A 38 0.730 3.520 52.816 1.00 0.00 H new ATOM 0 HB2 ALA A 38 2.116 3.463 51.701 1.00 0.00 H new ATOM 0 HB3 ALA A 38 0.648 2.523 51.345 1.00 0.00 H new ATOM 594 N LEU A 39 0.069 0.073 52.798 1.00 0.00 N ATOM 595 CA LEU A 39 -1.018 -0.726 53.348 1.00 0.00 C ATOM 596 C LEU A 39 -0.506 -1.700 54.415 1.00 0.00 C ATOM 597 O LEU A 39 -0.759 -1.512 55.605 1.00 0.00 O ATOM 598 CB LEU A 39 -1.705 -1.497 52.216 1.00 0.00 C ATOM 599 CG LEU A 39 -2.169 -0.515 51.133 1.00 0.00 C ATOM 600 CD1 LEU A 39 -2.771 -1.302 49.965 1.00 0.00 C ATOM 601 CD2 LEU A 39 -3.228 0.446 51.700 1.00 0.00 C ATOM 0 H LEU A 39 0.238 -0.060 51.801 1.00 0.00 H new ATOM 0 HA LEU A 39 -1.734 -0.057 53.824 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -1.017 -2.226 51.789 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -2.557 -2.053 52.606 1.00 0.00 H new ATOM 0 HG LEU A 39 -1.313 0.067 50.790 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -3.103 -0.609 49.192 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -2.018 -1.973 49.552 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -3.621 -1.885 50.319 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -3.547 1.137 50.920 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -4.087 -0.126 52.052 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -2.801 1.009 52.530 1.00 0.00 H new ATOM 613 N THR A 40 0.184 -2.754 53.981 1.00 0.00 N ATOM 614 CA THR A 40 0.695 -3.763 54.913 1.00 0.00 C ATOM 615 C THR A 40 1.982 -3.337 55.626 1.00 0.00 C ATOM 616 O THR A 40 2.087 -3.472 56.844 1.00 0.00 O ATOM 617 CB THR A 40 0.944 -5.070 54.159 1.00 0.00 C ATOM 618 OG1 THR A 40 -0.222 -5.425 53.432 1.00 0.00 O ATOM 619 CG2 THR A 40 1.301 -6.180 55.150 1.00 0.00 C ATOM 0 H THR A 40 0.401 -2.932 53.001 1.00 0.00 H new ATOM 0 HA THR A 40 -0.065 -3.893 55.684 1.00 0.00 H new ATOM 0 HB THR A 40 1.774 -4.936 53.465 1.00 0.00 H new ATOM 0 HG1 THR A 40 -0.063 -6.262 52.947 1.00 0.00 H new ATOM 0 HG21 THR A 40 1.477 -7.109 54.608 1.00 0.00 H new ATOM 0 HG22 THR A 40 2.202 -5.903 55.698 1.00 0.00 H new ATOM 0 HG23 THR A 40 0.478 -6.320 55.851 1.00 0.00 H new ATOM 627 N GLY A 41 2.967 -2.847 54.871 1.00 0.00 N ATOM 628 CA GLY A 41 4.252 -2.442 55.464 1.00 0.00 C ATOM 629 C GLY A 41 5.375 -3.348 54.970 1.00 0.00 C ATOM 630 O GLY A 41 5.956 -4.112 55.742 1.00 0.00 O ATOM 0 H GLY A 41 2.906 -2.720 53.861 1.00 0.00 H new ATOM 0 HA2 GLY A 41 4.470 -1.407 55.203 1.00 0.00 H new ATOM 0 HA3 GLY A 41 4.189 -2.490 56.551 1.00 0.00 H new ATOM 634 N TYR A 42 5.679 -3.252 53.676 1.00 0.00 N ATOM 635 CA TYR A 42 6.739 -4.059 53.071 1.00 0.00 C ATOM 636 C TYR A 42 8.030 -3.253 52.960 1.00 0.00 C ATOM 637 O TYR A 42 8.941 -3.637 52.233 1.00 0.00 O ATOM 638 CB TYR A 42 6.326 -4.527 51.671 1.00 0.00 C ATOM 639 CG TYR A 42 5.158 -5.485 51.776 1.00 0.00 C ATOM 640 CD1 TYR A 42 5.331 -6.725 52.403 1.00 0.00 C ATOM 641 CD2 TYR A 42 3.908 -5.131 51.257 1.00 0.00 C ATOM 642 CE1 TYR A 42 4.252 -7.610 52.511 1.00 0.00 C ATOM 643 CE2 TYR A 42 2.829 -6.016 51.365 1.00 0.00 C ATOM 644 CZ TYR A 42 3.001 -7.256 51.993 1.00 0.00 C ATOM 645 OH TYR A 42 1.938 -8.129 52.099 1.00 0.00 O ATOM 0 H TYR A 42 5.206 -2.624 53.026 1.00 0.00 H new ATOM 0 HA TYR A 42 6.904 -4.925 53.712 1.00 0.00 H new ATOM 0 HB2 TYR A 42 6.051 -3.669 51.057 1.00 0.00 H new ATOM 0 HB3 TYR A 42 7.166 -5.016 51.178 1.00 0.00 H new ATOM 0 HD1 TYR A 42 6.296 -6.998 52.803 1.00 0.00 H new ATOM 0 HD2 TYR A 42 3.776 -4.175 50.773 1.00 0.00 H new ATOM 0 HE1 TYR A 42 4.385 -8.567 52.994 1.00 0.00 H new ATOM 0 HE2 TYR A 42 1.864 -5.743 50.964 1.00 0.00 H new ATOM 0 HH TYR A 42 1.143 -7.728 51.689 1.00 0.00 H new ATOM 655 N LEU A 43 8.088 -2.121 53.662 1.00 0.00 N ATOM 656 CA LEU A 43 9.266 -1.246 53.616 1.00 0.00 C ATOM 657 C LEU A 43 10.555 -2.072 53.522 1.00 0.00 C ATOM 658 O LEU A 43 11.457 -1.753 52.747 1.00 0.00 O ATOM 659 CB LEU A 43 9.287 -0.358 54.888 1.00 0.00 C ATOM 660 CG LEU A 43 9.433 1.136 54.513 1.00 0.00 C ATOM 661 CD1 LEU A 43 10.687 1.346 53.630 1.00 0.00 C ATOM 662 CD2 LEU A 43 8.161 1.630 53.778 1.00 0.00 C ATOM 0 H LEU A 43 7.338 -1.787 54.267 1.00 0.00 H new ATOM 0 HA LEU A 43 9.208 -0.615 52.729 1.00 0.00 H new ATOM 0 HB2 LEU A 43 8.369 -0.507 55.456 1.00 0.00 H new ATOM 0 HB3 LEU A 43 10.113 -0.658 55.533 1.00 0.00 H new ATOM 0 HG LEU A 43 9.553 1.718 55.427 1.00 0.00 H new ATOM 0 HD11 LEU A 43 10.778 2.401 53.373 1.00 0.00 H new ATOM 0 HD12 LEU A 43 11.575 1.027 54.177 1.00 0.00 H new ATOM 0 HD13 LEU A 43 10.592 0.757 52.718 1.00 0.00 H new ATOM 0 HD21 LEU A 43 8.276 2.683 53.519 1.00 0.00 H new ATOM 0 HD22 LEU A 43 8.017 1.047 52.869 1.00 0.00 H new ATOM 0 HD23 LEU A 43 7.295 1.509 54.428 1.00 0.00 H new ATOM 674 N ASP A 44 10.622 -3.133 54.315 1.00 0.00 N ATOM 675 CA ASP A 44 11.790 -4.007 54.317 1.00 0.00 C ATOM 676 C ASP A 44 11.930 -4.741 52.985 1.00 0.00 C ATOM 677 O ASP A 44 13.040 -4.979 52.508 1.00 0.00 O ATOM 678 CB ASP A 44 11.674 -5.023 55.456 1.00 0.00 C ATOM 679 CG ASP A 44 12.842 -6.000 55.403 1.00 0.00 C ATOM 680 OD1 ASP A 44 13.869 -5.700 55.988 1.00 0.00 O ATOM 681 OD2 ASP A 44 12.693 -7.037 54.777 1.00 0.00 O ATOM 0 H ASP A 44 9.885 -3.410 54.963 1.00 0.00 H new ATOM 0 HA ASP A 44 12.677 -3.391 54.463 1.00 0.00 H new ATOM 0 HB2 ASP A 44 11.664 -4.506 56.416 1.00 0.00 H new ATOM 0 HB3 ASP A 44 10.732 -5.565 55.376 1.00 0.00 H new ATOM 686 N TYR A 45 10.793 -5.114 52.392 1.00 0.00 N ATOM 687 CA TYR A 45 10.785 -5.842 51.117 1.00 0.00 C ATOM 688 C TYR A 45 10.322 -4.950 49.964 1.00 0.00 C ATOM 689 O TYR A 45 9.480 -5.354 49.161 1.00 0.00 O ATOM 690 CB TYR A 45 9.846 -7.043 51.227 1.00 0.00 C ATOM 691 CG TYR A 45 10.306 -7.937 52.353 1.00 0.00 C ATOM 692 CD1 TYR A 45 11.309 -8.889 52.127 1.00 0.00 C ATOM 693 CD2 TYR A 45 9.731 -7.816 53.623 1.00 0.00 C ATOM 694 CE1 TYR A 45 11.735 -9.718 53.171 1.00 0.00 C ATOM 695 CE2 TYR A 45 10.158 -8.644 54.668 1.00 0.00 C ATOM 696 CZ TYR A 45 11.160 -9.596 54.441 1.00 0.00 C ATOM 697 OH TYR A 45 11.581 -10.413 55.471 1.00 0.00 O ATOM 0 H TYR A 45 9.866 -4.925 52.773 1.00 0.00 H new ATOM 0 HA TYR A 45 11.803 -6.170 50.909 1.00 0.00 H new ATOM 0 HB2 TYR A 45 8.826 -6.706 51.409 1.00 0.00 H new ATOM 0 HB3 TYR A 45 9.835 -7.598 50.289 1.00 0.00 H new ATOM 0 HD1 TYR A 45 11.753 -8.983 51.147 1.00 0.00 H new ATOM 0 HD2 TYR A 45 8.957 -7.083 53.797 1.00 0.00 H new ATOM 0 HE1 TYR A 45 12.508 -10.452 52.996 1.00 0.00 H new ATOM 0 HE2 TYR A 45 9.715 -8.549 55.648 1.00 0.00 H new ATOM 0 HH TYR A 45 11.080 -10.197 56.285 1.00 0.00 H new ATOM 707 N VAL A 46 10.870 -3.736 49.888 1.00 0.00 N ATOM 708 CA VAL A 46 10.509 -2.788 48.826 1.00 0.00 C ATOM 709 C VAL A 46 11.745 -2.415 48.008 1.00 0.00 C ATOM 710 O VAL A 46 11.652 -2.164 46.807 1.00 0.00 O ATOM 711 CB VAL A 46 9.875 -1.524 49.442 1.00 0.00 C ATOM 712 CG1 VAL A 46 9.854 -0.385 48.407 1.00 0.00 C ATOM 713 CG2 VAL A 46 8.425 -1.834 49.888 1.00 0.00 C ATOM 0 H VAL A 46 11.565 -3.384 50.547 1.00 0.00 H new ATOM 0 HA VAL A 46 9.783 -3.260 48.164 1.00 0.00 H new ATOM 0 HB VAL A 46 10.468 -1.217 50.304 1.00 0.00 H new ATOM 0 HG11 VAL A 46 9.404 0.503 48.852 1.00 0.00 H new ATOM 0 HG12 VAL A 46 10.873 -0.158 48.095 1.00 0.00 H new ATOM 0 HG13 VAL A 46 9.269 -0.692 47.540 1.00 0.00 H new ATOM 0 HG21 VAL A 46 7.979 -0.940 50.323 1.00 0.00 H new ATOM 0 HG22 VAL A 46 7.838 -2.149 49.025 1.00 0.00 H new ATOM 0 HG23 VAL A 46 8.435 -2.632 50.630 1.00 0.00 H new ATOM 723 N LEU A 47 12.894 -2.361 48.670 1.00 0.00 N ATOM 724 CA LEU A 47 14.134 -1.997 47.996 1.00 0.00 C ATOM 725 C LEU A 47 14.537 -3.057 46.971 1.00 0.00 C ATOM 726 O LEU A 47 15.013 -2.730 45.884 1.00 0.00 O ATOM 727 CB LEU A 47 15.250 -1.798 49.032 1.00 0.00 C ATOM 728 CG LEU A 47 15.074 -0.449 49.753 1.00 0.00 C ATOM 729 CD1 LEU A 47 15.317 0.735 48.800 1.00 0.00 C ATOM 730 CD2 LEU A 47 13.660 -0.363 50.343 1.00 0.00 C ATOM 0 H LEU A 47 12.993 -2.563 49.665 1.00 0.00 H new ATOM 0 HA LEU A 47 13.974 -1.062 47.460 1.00 0.00 H new ATOM 0 HB2 LEU A 47 15.231 -2.611 49.758 1.00 0.00 H new ATOM 0 HB3 LEU A 47 16.222 -1.831 48.540 1.00 0.00 H new ATOM 0 HG LEU A 47 15.813 -0.391 50.553 1.00 0.00 H new ATOM 0 HD11 LEU A 47 15.184 1.671 49.342 1.00 0.00 H new ATOM 0 HD12 LEU A 47 16.333 0.684 48.407 1.00 0.00 H new ATOM 0 HD13 LEU A 47 14.606 0.690 47.975 1.00 0.00 H new ATOM 0 HD21 LEU A 47 13.536 0.592 50.853 1.00 0.00 H new ATOM 0 HD22 LEU A 47 12.926 -0.444 49.541 1.00 0.00 H new ATOM 0 HD23 LEU A 47 13.512 -1.176 51.054 1.00 0.00 H new ATOM 742 N LEU A 48 14.363 -4.328 47.332 1.00 0.00 N ATOM 743 CA LEU A 48 14.736 -5.426 46.442 1.00 0.00 C ATOM 744 C LEU A 48 13.835 -5.480 45.198 1.00 0.00 C ATOM 745 O LEU A 48 14.331 -5.378 44.077 1.00 0.00 O ATOM 746 CB LEU A 48 14.688 -6.763 47.227 1.00 0.00 C ATOM 747 CG LEU A 48 16.112 -7.266 47.551 1.00 0.00 C ATOM 748 CD1 LEU A 48 16.038 -8.284 48.696 1.00 0.00 C ATOM 749 CD2 LEU A 48 16.720 -7.936 46.306 1.00 0.00 C ATOM 0 H LEU A 48 13.970 -4.621 48.226 1.00 0.00 H new ATOM 0 HA LEU A 48 15.752 -5.256 46.086 1.00 0.00 H new ATOM 0 HB2 LEU A 48 14.128 -6.626 48.152 1.00 0.00 H new ATOM 0 HB3 LEU A 48 14.158 -7.514 46.641 1.00 0.00 H new ATOM 0 HG LEU A 48 16.738 -6.424 47.847 1.00 0.00 H new ATOM 0 HD11 LEU A 48 17.040 -8.643 48.929 1.00 0.00 H new ATOM 0 HD12 LEU A 48 15.608 -7.809 49.578 1.00 0.00 H new ATOM 0 HD13 LEU A 48 15.413 -9.125 48.396 1.00 0.00 H new ATOM 0 HD21 LEU A 48 17.725 -8.290 46.537 1.00 0.00 H new ATOM 0 HD22 LEU A 48 16.098 -8.780 46.006 1.00 0.00 H new ATOM 0 HD23 LEU A 48 16.768 -7.214 45.491 1.00 0.00 H new ATOM 761 N PRO A 49 12.541 -5.647 45.354 1.00 0.00 N ATOM 762 CA PRO A 49 11.614 -5.723 44.192 1.00 0.00 C ATOM 763 C PRO A 49 11.944 -4.721 43.080 1.00 0.00 C ATOM 764 O PRO A 49 11.556 -4.921 41.930 1.00 0.00 O ATOM 765 CB PRO A 49 10.248 -5.403 44.798 1.00 0.00 C ATOM 766 CG PRO A 49 10.340 -5.789 46.244 1.00 0.00 C ATOM 767 CD PRO A 49 11.838 -5.789 46.635 1.00 0.00 C ATOM 0 HA PRO A 49 11.673 -6.699 43.710 1.00 0.00 H new ATOM 0 HB2 PRO A 49 10.011 -4.344 44.690 1.00 0.00 H new ATOM 0 HB3 PRO A 49 9.457 -5.959 44.295 1.00 0.00 H new ATOM 0 HG2 PRO A 49 9.783 -5.087 46.864 1.00 0.00 H new ATOM 0 HG3 PRO A 49 9.902 -6.774 46.406 1.00 0.00 H new ATOM 0 HD2 PRO A 49 12.073 -4.968 47.312 1.00 0.00 H new ATOM 0 HD3 PRO A 49 12.118 -6.712 47.143 1.00 0.00 H new ATOM 775 N ALA A 50 12.647 -3.643 43.423 1.00 0.00 N ATOM 776 CA ALA A 50 12.998 -2.633 42.430 1.00 0.00 C ATOM 777 C ALA A 50 14.042 -3.181 41.463 1.00 0.00 C ATOM 778 O ALA A 50 14.028 -2.885 40.268 1.00 0.00 O ATOM 779 CB ALA A 50 13.535 -1.384 43.131 1.00 0.00 C ATOM 0 H ALA A 50 12.980 -3.449 44.367 1.00 0.00 H new ATOM 0 HA ALA A 50 12.105 -2.369 41.863 1.00 0.00 H new ATOM 0 HB1 ALA A 50 13.796 -0.632 42.386 1.00 0.00 H new ATOM 0 HB2 ALA A 50 12.771 -0.984 43.798 1.00 0.00 H new ATOM 0 HB3 ALA A 50 14.421 -1.644 43.710 1.00 0.00 H new ATOM 785 N LEU A 51 14.949 -3.981 42.010 1.00 0.00 N ATOM 786 CA LEU A 51 16.024 -4.582 41.230 1.00 0.00 C ATOM 787 C LEU A 51 15.457 -5.458 40.115 1.00 0.00 C ATOM 788 O LEU A 51 16.108 -5.665 39.093 1.00 0.00 O ATOM 789 CB LEU A 51 16.933 -5.416 42.142 1.00 0.00 C ATOM 790 CG LEU A 51 17.912 -4.498 42.881 1.00 0.00 C ATOM 791 CD1 LEU A 51 17.134 -3.487 43.725 1.00 0.00 C ATOM 792 CD2 LEU A 51 18.804 -5.345 43.793 1.00 0.00 C ATOM 0 H LEU A 51 14.961 -4.230 42.999 1.00 0.00 H new ATOM 0 HA LEU A 51 16.610 -3.782 40.777 1.00 0.00 H new ATOM 0 HB2 LEU A 51 16.331 -5.973 42.860 1.00 0.00 H new ATOM 0 HB3 LEU A 51 17.483 -6.148 41.551 1.00 0.00 H new ATOM 0 HG LEU A 51 18.527 -3.963 42.157 1.00 0.00 H new ATOM 0 HD11 LEU A 51 17.833 -2.836 44.249 1.00 0.00 H new ATOM 0 HD12 LEU A 51 16.495 -2.887 43.077 1.00 0.00 H new ATOM 0 HD13 LEU A 51 16.518 -4.017 44.451 1.00 0.00 H new ATOM 0 HD21 LEU A 51 19.503 -4.697 44.322 1.00 0.00 H new ATOM 0 HD22 LEU A 51 18.185 -5.877 44.515 1.00 0.00 H new ATOM 0 HD23 LEU A 51 19.360 -6.065 43.192 1.00 0.00 H new ATOM 804 N ALA A 52 14.251 -5.973 40.310 1.00 0.00 N ATOM 805 CA ALA A 52 13.634 -6.820 39.298 1.00 0.00 C ATOM 806 C ALA A 52 13.470 -6.053 37.988 1.00 0.00 C ATOM 807 O ALA A 52 13.643 -6.609 36.906 1.00 0.00 O ATOM 808 CB ALA A 52 12.268 -7.305 39.786 1.00 0.00 C ATOM 0 H ALA A 52 13.687 -5.823 41.147 1.00 0.00 H new ATOM 0 HA ALA A 52 14.281 -7.680 39.123 1.00 0.00 H new ATOM 0 HB1 ALA A 52 11.813 -7.938 39.024 1.00 0.00 H new ATOM 0 HB2 ALA A 52 12.392 -7.877 40.706 1.00 0.00 H new ATOM 0 HB3 ALA A 52 11.624 -6.447 39.977 1.00 0.00 H new ATOM 814 N ILE A 53 13.133 -4.775 38.092 1.00 0.00 N ATOM 815 CA ILE A 53 12.953 -3.944 36.904 1.00 0.00 C ATOM 816 C ILE A 53 14.280 -3.776 36.158 1.00 0.00 C ATOM 817 O ILE A 53 14.323 -3.848 34.929 1.00 0.00 O ATOM 818 CB ILE A 53 12.402 -2.563 37.303 1.00 0.00 C ATOM 819 CG1 ILE A 53 10.960 -2.698 37.873 1.00 0.00 C ATOM 820 CG2 ILE A 53 12.386 -1.646 36.069 1.00 0.00 C ATOM 821 CD1 ILE A 53 10.996 -2.695 39.406 1.00 0.00 C ATOM 0 H ILE A 53 12.979 -4.292 38.977 1.00 0.00 H new ATOM 0 HA ILE A 53 12.240 -4.438 36.244 1.00 0.00 H new ATOM 0 HB ILE A 53 13.043 -2.134 38.073 1.00 0.00 H new ATOM 0 HG12 ILE A 53 10.341 -1.876 37.515 1.00 0.00 H new ATOM 0 HG13 ILE A 53 10.504 -3.621 37.514 1.00 0.00 H new ATOM 0 HG21 ILE A 53 11.996 -0.667 36.348 1.00 0.00 H new ATOM 0 HG22 ILE A 53 13.400 -1.537 35.684 1.00 0.00 H new ATOM 0 HG23 ILE A 53 11.751 -2.083 35.299 1.00 0.00 H new ATOM 0 HD11 ILE A 53 9.982 -2.790 39.794 1.00 0.00 H new ATOM 0 HD12 ILE A 53 11.599 -3.532 39.757 1.00 0.00 H new ATOM 0 HD13 ILE A 53 11.433 -1.760 39.758 1.00 0.00 H new ATOM 833 N PHE A 54 15.359 -3.533 36.897 1.00 0.00 N ATOM 834 CA PHE A 54 16.669 -3.334 36.271 1.00 0.00 C ATOM 835 C PHE A 54 16.927 -4.438 35.242 1.00 0.00 C ATOM 836 O PHE A 54 17.462 -4.199 34.159 1.00 0.00 O ATOM 837 CB PHE A 54 17.762 -3.351 37.358 1.00 0.00 C ATOM 838 CG PHE A 54 17.926 -1.958 37.938 1.00 0.00 C ATOM 839 CD1 PHE A 54 16.882 -1.377 38.665 1.00 0.00 C ATOM 840 CD2 PHE A 54 19.113 -1.247 37.728 1.00 0.00 C ATOM 841 CE1 PHE A 54 17.024 -0.084 39.183 1.00 0.00 C ATOM 842 CE2 PHE A 54 19.256 0.045 38.247 1.00 0.00 C ATOM 843 CZ PHE A 54 18.211 0.627 38.974 1.00 0.00 C ATOM 0 H PHE A 54 15.357 -3.469 37.915 1.00 0.00 H new ATOM 0 HA PHE A 54 16.687 -2.371 35.760 1.00 0.00 H new ATOM 0 HB2 PHE A 54 17.494 -4.055 38.146 1.00 0.00 H new ATOM 0 HB3 PHE A 54 18.706 -3.692 36.933 1.00 0.00 H new ATOM 0 HD1 PHE A 54 15.966 -1.926 38.827 1.00 0.00 H new ATOM 0 HD2 PHE A 54 19.919 -1.695 37.165 1.00 0.00 H new ATOM 0 HE1 PHE A 54 16.217 0.365 39.744 1.00 0.00 H new ATOM 0 HE2 PHE A 54 20.173 0.593 38.087 1.00 0.00 H new ATOM 0 HZ PHE A 54 18.321 1.624 39.373 1.00 0.00 H new ATOM 853 N ILE A 55 16.525 -5.651 35.609 1.00 0.00 N ATOM 854 CA ILE A 55 16.685 -6.821 34.748 1.00 0.00 C ATOM 855 C ILE A 55 15.928 -6.653 33.432 1.00 0.00 C ATOM 856 O ILE A 55 16.316 -7.233 32.418 1.00 0.00 O ATOM 857 CB ILE A 55 16.208 -8.094 35.459 1.00 0.00 C ATOM 858 CG1 ILE A 55 17.116 -8.384 36.659 1.00 0.00 C ATOM 859 CG2 ILE A 55 16.267 -9.275 34.483 1.00 0.00 C ATOM 860 CD1 ILE A 55 16.511 -9.511 37.498 1.00 0.00 C ATOM 0 H ILE A 55 16.082 -5.851 36.506 1.00 0.00 H new ATOM 0 HA ILE A 55 17.748 -6.915 34.526 1.00 0.00 H new ATOM 0 HB ILE A 55 15.184 -7.953 35.804 1.00 0.00 H new ATOM 0 HG12 ILE A 55 18.111 -8.666 36.315 1.00 0.00 H new ATOM 0 HG13 ILE A 55 17.231 -7.486 37.266 1.00 0.00 H new ATOM 0 HG21 ILE A 55 15.928 -10.180 34.987 1.00 0.00 H new ATOM 0 HG22 ILE A 55 15.622 -9.073 33.628 1.00 0.00 H new ATOM 0 HG23 ILE A 55 17.292 -9.413 34.140 1.00 0.00 H new ATOM 0 HD11 ILE A 55 17.157 -9.717 38.351 1.00 0.00 H new ATOM 0 HD12 ILE A 55 15.525 -9.211 37.854 1.00 0.00 H new ATOM 0 HD13 ILE A 55 16.419 -10.410 36.888 1.00 0.00 H new ATOM 872 N GLY A 56 14.849 -5.873 33.443 1.00 0.00 N ATOM 873 CA GLY A 56 14.060 -5.662 32.234 1.00 0.00 C ATOM 874 C GLY A 56 14.920 -5.142 31.085 1.00 0.00 C ATOM 875 O GLY A 56 14.714 -5.503 29.927 1.00 0.00 O ATOM 0 H GLY A 56 14.504 -5.381 34.268 1.00 0.00 H new ATOM 0 HA2 GLY A 56 13.587 -6.599 31.940 1.00 0.00 H new ATOM 0 HA3 GLY A 56 13.260 -4.951 32.441 1.00 0.00 H new ATOM 879 N LEU A 57 15.868 -4.272 31.410 1.00 0.00 N ATOM 880 CA LEU A 57 16.733 -3.691 30.388 1.00 0.00 C ATOM 881 C LEU A 57 17.562 -4.780 29.702 1.00 0.00 C ATOM 882 O LEU A 57 17.804 -4.727 28.496 1.00 0.00 O ATOM 883 CB LEU A 57 17.666 -2.642 31.014 1.00 0.00 C ATOM 884 CG LEU A 57 18.181 -1.677 29.926 1.00 0.00 C ATOM 885 CD1 LEU A 57 17.043 -0.763 29.424 1.00 0.00 C ATOM 886 CD2 LEU A 57 19.315 -0.818 30.504 1.00 0.00 C ATOM 0 H LEU A 57 16.057 -3.955 32.361 1.00 0.00 H new ATOM 0 HA LEU A 57 16.103 -3.207 29.641 1.00 0.00 H new ATOM 0 HB2 LEU A 57 17.134 -2.084 31.784 1.00 0.00 H new ATOM 0 HB3 LEU A 57 18.507 -3.136 31.501 1.00 0.00 H new ATOM 0 HG LEU A 57 18.551 -2.262 29.084 1.00 0.00 H new ATOM 0 HD11 LEU A 57 17.428 -0.090 28.657 1.00 0.00 H new ATOM 0 HD12 LEU A 57 16.244 -1.374 29.003 1.00 0.00 H new ATOM 0 HD13 LEU A 57 16.652 -0.178 30.257 1.00 0.00 H new ATOM 0 HD21 LEU A 57 19.681 -0.135 29.737 1.00 0.00 H new ATOM 0 HD22 LEU A 57 18.941 -0.245 31.352 1.00 0.00 H new ATOM 0 HD23 LEU A 57 20.129 -1.464 30.833 1.00 0.00 H new ATOM 898 N THR A 58 18.000 -5.757 30.489 1.00 0.00 N ATOM 899 CA THR A 58 18.812 -6.855 29.965 1.00 0.00 C ATOM 900 C THR A 58 18.031 -7.694 28.951 1.00 0.00 C ATOM 901 O THR A 58 18.502 -7.916 27.835 1.00 0.00 O ATOM 902 CB THR A 58 19.284 -7.760 31.107 1.00 0.00 C ATOM 903 OG1 THR A 58 18.199 -8.571 31.531 1.00 0.00 O ATOM 904 CG2 THR A 58 19.785 -6.921 32.287 1.00 0.00 C ATOM 0 H THR A 58 17.808 -5.813 31.489 1.00 0.00 H new ATOM 0 HA THR A 58 19.673 -6.413 29.463 1.00 0.00 H new ATOM 0 HB THR A 58 20.104 -8.384 30.751 1.00 0.00 H new ATOM 0 HG1 THR A 58 17.660 -8.080 32.186 1.00 0.00 H new ATOM 0 HG21 THR A 58 20.116 -7.581 33.088 1.00 0.00 H new ATOM 0 HG22 THR A 58 20.619 -6.298 31.963 1.00 0.00 H new ATOM 0 HG23 THR A 58 18.977 -6.286 32.651 1.00 0.00 H new ATOM 912 N ILE A 59 16.845 -8.158 29.331 1.00 0.00 N ATOM 913 CA ILE A 59 16.033 -8.969 28.423 1.00 0.00 C ATOM 914 C ILE A 59 15.485 -8.119 27.280 1.00 0.00 C ATOM 915 O ILE A 59 15.429 -8.553 26.129 1.00 0.00 O ATOM 916 CB ILE A 59 14.885 -9.611 29.200 1.00 0.00 C ATOM 917 CG1 ILE A 59 14.080 -10.535 28.278 1.00 0.00 C ATOM 918 CG2 ILE A 59 13.977 -8.533 29.779 1.00 0.00 C ATOM 919 CD1 ILE A 59 13.034 -11.310 29.089 1.00 0.00 C ATOM 0 H ILE A 59 16.427 -7.991 30.246 1.00 0.00 H new ATOM 0 HA ILE A 59 16.661 -9.750 27.993 1.00 0.00 H new ATOM 0 HB ILE A 59 15.299 -10.200 30.018 1.00 0.00 H new ATOM 0 HG12 ILE A 59 13.588 -9.948 27.502 1.00 0.00 H new ATOM 0 HG13 ILE A 59 14.750 -11.232 27.774 1.00 0.00 H new ATOM 0 HG21 ILE A 59 13.162 -9.002 30.331 1.00 0.00 H new ATOM 0 HG22 ILE A 59 14.552 -7.896 30.451 1.00 0.00 H new ATOM 0 HG23 ILE A 59 13.567 -7.929 28.969 1.00 0.00 H new ATOM 0 HD11 ILE A 59 12.468 -11.963 28.424 1.00 0.00 H new ATOM 0 HD12 ILE A 59 13.534 -11.911 29.848 1.00 0.00 H new ATOM 0 HD13 ILE A 59 12.355 -10.608 29.572 1.00 0.00 H new ATOM 931 N TYR A 60 15.076 -6.901 27.626 1.00 0.00 N ATOM 932 CA TYR A 60 14.520 -5.963 26.655 1.00 0.00 C ATOM 933 C TYR A 60 15.459 -5.766 25.468 1.00 0.00 C ATOM 934 O TYR A 60 15.004 -5.553 24.344 1.00 0.00 O ATOM 935 CB TYR A 60 14.240 -4.615 27.335 1.00 0.00 C ATOM 936 CG TYR A 60 13.932 -3.568 26.284 1.00 0.00 C ATOM 937 CD1 TYR A 60 12.749 -3.646 25.540 1.00 0.00 C ATOM 938 CD2 TYR A 60 14.845 -2.534 26.041 1.00 0.00 C ATOM 939 CE1 TYR A 60 12.479 -2.691 24.551 1.00 0.00 C ATOM 940 CE2 TYR A 60 14.574 -1.580 25.053 1.00 0.00 C ATOM 941 CZ TYR A 60 13.392 -1.658 24.309 1.00 0.00 C ATOM 942 OH TYR A 60 13.126 -0.718 23.334 1.00 0.00 O ATOM 0 H TYR A 60 15.120 -6.539 28.579 1.00 0.00 H new ATOM 0 HA TYR A 60 13.587 -6.381 26.276 1.00 0.00 H new ATOM 0 HB2 TYR A 60 13.400 -4.711 28.023 1.00 0.00 H new ATOM 0 HB3 TYR A 60 15.103 -4.308 27.926 1.00 0.00 H new ATOM 0 HD1 TYR A 60 12.044 -4.442 25.728 1.00 0.00 H new ATOM 0 HD2 TYR A 60 15.757 -2.473 26.615 1.00 0.00 H new ATOM 0 HE1 TYR A 60 11.567 -2.752 23.976 1.00 0.00 H new ATOM 0 HE2 TYR A 60 15.278 -0.783 24.865 1.00 0.00 H new ATOM 0 HH TYR A 60 13.860 -0.070 23.295 1.00 0.00 H new ATOM 952 N ALA A 61 16.761 -5.806 25.716 1.00 0.00 N ATOM 953 CA ALA A 61 17.731 -5.603 24.649 1.00 0.00 C ATOM 954 C ALA A 61 17.531 -6.629 23.537 1.00 0.00 C ATOM 955 O ALA A 61 17.651 -6.305 22.355 1.00 0.00 O ATOM 956 CB ALA A 61 19.147 -5.723 25.214 1.00 0.00 C ATOM 0 H ALA A 61 17.167 -5.975 26.636 1.00 0.00 H new ATOM 0 HA ALA A 61 17.587 -4.607 24.231 1.00 0.00 H new ATOM 0 HB1 ALA A 61 19.872 -5.571 24.414 1.00 0.00 H new ATOM 0 HB2 ALA A 61 19.296 -4.969 25.987 1.00 0.00 H new ATOM 0 HB3 ALA A 61 19.284 -6.715 25.644 1.00 0.00 H new ATOM 962 N ILE A 62 17.247 -7.866 23.923 1.00 0.00 N ATOM 963 CA ILE A 62 17.048 -8.943 22.960 1.00 0.00 C ATOM 964 C ILE A 62 15.863 -8.663 22.034 1.00 0.00 C ATOM 965 O ILE A 62 15.849 -9.100 20.884 1.00 0.00 O ATOM 966 CB ILE A 62 16.797 -10.257 23.704 1.00 0.00 C ATOM 967 CG1 ILE A 62 18.045 -10.631 24.510 1.00 0.00 C ATOM 968 CG2 ILE A 62 16.495 -11.369 22.693 1.00 0.00 C ATOM 969 CD1 ILE A 62 17.718 -11.782 25.464 1.00 0.00 C ATOM 0 H ILE A 62 17.149 -8.150 24.898 1.00 0.00 H new ATOM 0 HA ILE A 62 17.950 -9.014 22.352 1.00 0.00 H new ATOM 0 HB ILE A 62 15.948 -10.136 24.377 1.00 0.00 H new ATOM 0 HG12 ILE A 62 18.851 -10.922 23.836 1.00 0.00 H new ATOM 0 HG13 ILE A 62 18.398 -9.767 25.074 1.00 0.00 H new ATOM 0 HG21 ILE A 62 16.316 -12.304 23.223 1.00 0.00 H new ATOM 0 HG22 ILE A 62 15.609 -11.105 22.115 1.00 0.00 H new ATOM 0 HG23 ILE A 62 17.344 -11.490 22.020 1.00 0.00 H new ATOM 0 HD11 ILE A 62 18.608 -12.045 26.035 1.00 0.00 H new ATOM 0 HD12 ILE A 62 16.926 -11.475 26.147 1.00 0.00 H new ATOM 0 HD13 ILE A 62 17.387 -12.647 24.890 1.00 0.00 H new ATOM 981 N GLN A 63 14.863 -7.954 22.554 1.00 0.00 N ATOM 982 CA GLN A 63 13.662 -7.643 21.782 1.00 0.00 C ATOM 983 C GLN A 63 13.958 -6.696 20.623 1.00 0.00 C ATOM 984 O GLN A 63 13.557 -6.943 19.486 1.00 0.00 O ATOM 985 CB GLN A 63 12.628 -6.987 22.701 1.00 0.00 C ATOM 986 CG GLN A 63 12.283 -7.946 23.841 1.00 0.00 C ATOM 987 CD GLN A 63 11.357 -7.260 24.840 1.00 0.00 C ATOM 988 OE1 GLN A 63 11.442 -7.513 26.042 1.00 0.00 O ATOM 989 NE2 GLN A 63 10.468 -6.406 24.412 1.00 0.00 N ATOM 0 H GLN A 63 14.861 -7.585 23.505 1.00 0.00 H new ATOM 0 HA GLN A 63 13.281 -8.578 21.370 1.00 0.00 H new ATOM 0 HB2 GLN A 63 13.022 -6.053 23.103 1.00 0.00 H new ATOM 0 HB3 GLN A 63 11.730 -6.737 22.136 1.00 0.00 H new ATOM 0 HG2 GLN A 63 11.803 -8.840 23.442 1.00 0.00 H new ATOM 0 HG3 GLN A 63 13.195 -8.271 24.342 1.00 0.00 H new ATOM 0 HE21 GLN A 63 10.399 -6.198 23.416 1.00 0.00 H new ATOM 0 HE22 GLN A 63 9.842 -5.947 25.074 1.00 0.00 H new ATOM 998 N ARG A 64 14.665 -5.615 20.928 1.00 0.00 N ATOM 999 CA ARG A 64 15.029 -4.612 19.933 1.00 0.00 C ATOM 1000 C ARG A 64 16.168 -5.087 19.039 1.00 0.00 C ATOM 1001 O ARG A 64 16.377 -4.549 17.951 1.00 0.00 O ATOM 1002 CB ARG A 64 15.420 -3.305 20.627 1.00 0.00 C ATOM 1003 CG ARG A 64 16.649 -3.525 21.509 1.00 0.00 C ATOM 1004 CD ARG A 64 17.024 -2.212 22.199 1.00 0.00 C ATOM 1005 NE ARG A 64 18.188 -2.413 23.053 1.00 0.00 N ATOM 1006 CZ ARG A 64 19.412 -2.476 22.541 1.00 0.00 C ATOM 1007 NH1 ARG A 64 19.586 -2.363 21.252 1.00 0.00 N ATOM 1008 NH2 ARG A 64 20.441 -2.651 23.325 1.00 0.00 N ATOM 0 H ARG A 64 15.002 -5.409 21.868 1.00 0.00 H new ATOM 0 HA ARG A 64 14.158 -4.444 19.299 1.00 0.00 H new ATOM 0 HB2 ARG A 64 15.630 -2.538 19.882 1.00 0.00 H new ATOM 0 HB3 ARG A 64 14.589 -2.943 21.232 1.00 0.00 H new ATOM 0 HG2 ARG A 64 16.442 -4.293 22.254 1.00 0.00 H new ATOM 0 HG3 ARG A 64 17.483 -3.882 20.906 1.00 0.00 H new ATOM 0 HD2 ARG A 64 17.238 -1.447 21.452 1.00 0.00 H new ATOM 0 HD3 ARG A 64 16.185 -1.851 22.793 1.00 0.00 H new ATOM 0 HE ARG A 64 18.060 -2.507 24.061 1.00 0.00 H new ATOM 0 HH11 ARG A 64 18.782 -2.226 20.639 1.00 0.00 H new ATOM 0 HH12 ARG A 64 20.526 -2.411 20.858 1.00 0.00 H new ATOM 0 HH21 ARG A 64 20.306 -2.740 24.332 1.00 0.00 H new ATOM 0 HH22 ARG A 64 21.380 -2.699 22.930 1.00 0.00 H new ATOM 1022 N LYS A 65 16.951 -6.040 19.531 1.00 0.00 N ATOM 1023 CA LYS A 65 18.113 -6.514 18.790 1.00 0.00 C ATOM 1024 C LYS A 65 17.722 -6.901 17.361 1.00 0.00 C ATOM 1025 O LYS A 65 18.375 -6.483 16.405 1.00 0.00 O ATOM 1026 CB LYS A 65 18.697 -7.738 19.524 1.00 0.00 C ATOM 1027 CG LYS A 65 20.219 -7.814 19.359 1.00 0.00 C ATOM 1028 CD LYS A 65 20.590 -7.982 17.884 1.00 0.00 C ATOM 1029 CE LYS A 65 22.071 -8.343 17.772 1.00 0.00 C ATOM 1030 NZ LYS A 65 22.321 -9.642 18.457 1.00 0.00 N ATOM 0 H LYS A 65 16.804 -6.496 20.432 1.00 0.00 H new ATOM 0 HA LYS A 65 18.856 -5.719 18.734 1.00 0.00 H new ATOM 0 HB2 LYS A 65 18.446 -7.683 20.583 1.00 0.00 H new ATOM 0 HB3 LYS A 65 18.241 -8.649 19.136 1.00 0.00 H new ATOM 0 HG2 LYS A 65 20.679 -6.909 19.755 1.00 0.00 H new ATOM 0 HG3 LYS A 65 20.612 -8.651 19.937 1.00 0.00 H new ATOM 0 HD2 LYS A 65 19.979 -8.762 17.430 1.00 0.00 H new ATOM 0 HD3 LYS A 65 20.387 -7.060 17.339 1.00 0.00 H new ATOM 0 HE2 LYS A 65 22.361 -8.411 16.723 1.00 0.00 H new ATOM 0 HE3 LYS A 65 22.682 -7.560 18.221 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 23.112 -10.133 17.993 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 22.559 -9.468 19.454 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 21.467 -10.233 18.402 1.00 0.00 H new ATOM 1044 N ARG A 66 16.656 -7.679 17.190 1.00 0.00 N ATOM 1045 CA ARG A 66 16.243 -8.060 15.843 1.00 0.00 C ATOM 1046 C ARG A 66 15.824 -6.822 15.047 1.00 0.00 C ATOM 1047 O ARG A 66 16.238 -6.636 13.903 1.00 0.00 O ATOM 1048 CB ARG A 66 15.074 -9.062 15.921 1.00 0.00 C ATOM 1049 CG ARG A 66 14.188 -8.731 17.127 1.00 0.00 C ATOM 1050 CD ARG A 66 12.868 -9.496 17.031 1.00 0.00 C ATOM 1051 NE ARG A 66 11.998 -9.126 18.142 1.00 0.00 N ATOM 1052 CZ ARG A 66 10.704 -9.428 18.132 1.00 0.00 C ATOM 1053 NH1 ARG A 66 10.193 -10.075 17.121 1.00 0.00 N ATOM 1054 NH2 ARG A 66 9.945 -9.077 19.134 1.00 0.00 N ATOM 0 H ARG A 66 16.077 -8.049 17.944 1.00 0.00 H new ATOM 0 HA ARG A 66 17.084 -8.531 15.334 1.00 0.00 H new ATOM 0 HB2 ARG A 66 14.486 -9.022 15.004 1.00 0.00 H new ATOM 0 HB3 ARG A 66 15.459 -10.078 16.008 1.00 0.00 H new ATOM 0 HG2 ARG A 66 14.704 -8.994 18.051 1.00 0.00 H new ATOM 0 HG3 ARG A 66 13.995 -7.659 17.164 1.00 0.00 H new ATOM 0 HD2 ARG A 66 12.377 -9.274 16.084 1.00 0.00 H new ATOM 0 HD3 ARG A 66 13.058 -10.569 17.048 1.00 0.00 H new ATOM 0 HE ARG A 66 12.390 -8.627 18.940 1.00 0.00 H new ATOM 0 HH11 ARG A 66 10.787 -10.349 16.338 1.00 0.00 H new ATOM 0 HH12 ARG A 66 9.200 -10.307 17.113 1.00 0.00 H new ATOM 0 HH21 ARG A 66 10.345 -8.571 19.924 1.00 0.00 H new ATOM 0 HH22 ARG A 66 8.952 -9.309 19.127 1.00 0.00 H new ATOM 1068 N GLN A 67 14.978 -5.995 15.655 1.00 0.00 N ATOM 1069 CA GLN A 67 14.478 -4.795 14.994 1.00 0.00 C ATOM 1070 C GLN A 67 15.641 -3.934 14.493 1.00 0.00 C ATOM 1071 O GLN A 67 15.502 -3.200 13.515 1.00 0.00 O ATOM 1072 CB GLN A 67 13.590 -3.990 15.976 1.00 0.00 C ATOM 1073 CG GLN A 67 12.106 -4.121 15.605 1.00 0.00 C ATOM 1074 CD GLN A 67 11.652 -5.570 15.759 1.00 0.00 C ATOM 1075 OE1 GLN A 67 12.048 -6.430 14.972 1.00 0.00 O ATOM 1076 NE2 GLN A 67 10.839 -5.892 16.728 1.00 0.00 N ATOM 0 H GLN A 67 14.625 -6.134 16.602 1.00 0.00 H new ATOM 0 HA GLN A 67 13.878 -5.089 14.133 1.00 0.00 H new ATOM 0 HB2 GLN A 67 13.748 -4.349 16.993 1.00 0.00 H new ATOM 0 HB3 GLN A 67 13.882 -2.940 15.959 1.00 0.00 H new ATOM 0 HG2 GLN A 67 11.505 -3.474 16.244 1.00 0.00 H new ATOM 0 HG3 GLN A 67 11.949 -3.790 14.578 1.00 0.00 H new ATOM 0 HE21 GLN A 67 10.513 -5.177 17.379 1.00 0.00 H new ATOM 0 HE22 GLN A 67 10.530 -6.858 16.835 1.00 0.00 H new ATOM 1085 N ALA A 68 16.782 -4.023 15.164 1.00 0.00 N ATOM 1086 CA ALA A 68 17.940 -3.237 14.760 1.00 0.00 C ATOM 1087 C ALA A 68 18.288 -3.517 13.299 1.00 0.00 C ATOM 1088 O ALA A 68 18.380 -2.606 12.477 1.00 0.00 O ATOM 1089 CB ALA A 68 19.132 -3.590 15.652 1.00 0.00 C ATOM 0 H ALA A 68 16.930 -4.621 15.977 1.00 0.00 H new ATOM 0 HA ALA A 68 17.705 -2.178 14.867 1.00 0.00 H new ATOM 0 HB1 ALA A 68 19.999 -3.002 15.350 1.00 0.00 H new ATOM 0 HB2 ALA A 68 18.887 -3.369 16.691 1.00 0.00 H new ATOM 0 HB3 ALA A 68 19.360 -4.651 15.551 1.00 0.00 H new ATOM 1095 N ASP A 69 18.457 -4.798 12.988 1.00 0.00 N ATOM 1096 CA ASP A 69 18.774 -5.229 11.630 1.00 0.00 C ATOM 1097 C ASP A 69 17.564 -5.109 10.706 1.00 0.00 C ATOM 1098 O ASP A 69 17.700 -4.707 9.550 1.00 0.00 O ATOM 1099 CB ASP A 69 19.259 -6.680 11.642 1.00 0.00 C ATOM 1100 CG ASP A 69 19.599 -7.117 10.221 1.00 0.00 C ATOM 1101 OD1 ASP A 69 19.686 -6.251 9.367 1.00 0.00 O ATOM 1102 OD2 ASP A 69 19.770 -8.306 10.007 1.00 0.00 O ATOM 0 H ASP A 69 18.379 -5.560 13.662 1.00 0.00 H new ATOM 0 HA ASP A 69 19.561 -4.576 11.251 1.00 0.00 H new ATOM 0 HB2 ASP A 69 20.136 -6.776 12.282 1.00 0.00 H new ATOM 0 HB3 ASP A 69 18.488 -7.328 12.058 1.00 0.00 H new ATOM 1107 N ALA A 70 16.389 -5.474 11.206 1.00 0.00 N ATOM 1108 CA ALA A 70 15.176 -5.416 10.393 1.00 0.00 C ATOM 1109 C ALA A 70 14.997 -4.031 9.775 1.00 0.00 C ATOM 1110 O ALA A 70 14.757 -3.905 8.575 1.00 0.00 O ATOM 1111 CB ALA A 70 13.957 -5.745 11.260 1.00 0.00 C ATOM 0 H ALA A 70 16.249 -5.810 12.159 1.00 0.00 H new ATOM 0 HA ALA A 70 15.269 -6.147 9.589 1.00 0.00 H new ATOM 0 HB1 ALA A 70 13.054 -5.701 10.651 1.00 0.00 H new ATOM 0 HB2 ALA A 70 14.066 -6.747 11.675 1.00 0.00 H new ATOM 0 HB3 ALA A 70 13.882 -5.022 12.072 1.00 0.00 H new ATOM 1117 N SER A 71 15.111 -2.996 10.601 1.00 0.00 N ATOM 1118 CA SER A 71 14.953 -1.629 10.118 1.00 0.00 C ATOM 1119 C SER A 71 16.023 -1.295 9.082 1.00 0.00 C ATOM 1120 O SER A 71 15.739 -0.669 8.061 1.00 0.00 O ATOM 1121 CB SER A 71 15.058 -0.652 11.290 1.00 0.00 C ATOM 1122 OG SER A 71 16.321 -0.812 11.921 1.00 0.00 O ATOM 0 H SER A 71 15.310 -3.076 11.598 1.00 0.00 H new ATOM 0 HA SER A 71 13.972 -1.540 9.650 1.00 0.00 H new ATOM 0 HB2 SER A 71 14.942 0.372 10.936 1.00 0.00 H new ATOM 0 HB3 SER A 71 14.255 -0.835 12.004 1.00 0.00 H new ATOM 0 HG SER A 71 16.308 -1.618 12.479 1.00 0.00 H new ATOM 1128 N SER A 72 17.255 -1.711 9.357 1.00 0.00 N ATOM 1129 CA SER A 72 18.363 -1.446 8.446 1.00 0.00 C ATOM 1130 C SER A 72 18.275 -2.338 7.212 1.00 0.00 C ATOM 1131 O SER A 72 18.796 -1.995 6.151 1.00 0.00 O ATOM 1132 CB SER A 72 19.694 -1.691 9.155 1.00 0.00 C ATOM 1133 OG SER A 72 19.809 -3.072 9.469 1.00 0.00 O ATOM 0 H SER A 72 17.511 -2.230 10.197 1.00 0.00 H new ATOM 0 HA SER A 72 18.302 -0.404 8.132 1.00 0.00 H new ATOM 0 HB2 SER A 72 20.522 -1.381 8.517 1.00 0.00 H new ATOM 0 HB3 SER A 72 19.751 -1.093 10.065 1.00 0.00 H new ATOM 0 HG SER A 72 18.918 -3.481 9.477 1.00 0.00 H new ATOM 1139 N THR A 73 17.627 -3.492 7.362 1.00 0.00 N ATOM 1140 CA THR A 73 17.485 -4.443 6.257 1.00 0.00 C ATOM 1141 C THR A 73 16.040 -4.927 6.149 1.00 0.00 C ATOM 1142 O THR A 73 15.704 -6.006 6.638 1.00 0.00 O ATOM 1143 CB THR A 73 18.408 -5.642 6.491 1.00 0.00 C ATOM 1144 OG1 THR A 73 19.723 -5.174 6.754 1.00 0.00 O ATOM 1145 CG2 THR A 73 18.419 -6.526 5.243 1.00 0.00 C ATOM 0 H THR A 73 17.193 -3.792 8.235 1.00 0.00 H new ATOM 0 HA THR A 73 17.758 -3.943 5.328 1.00 0.00 H new ATOM 0 HB THR A 73 18.050 -6.222 7.341 1.00 0.00 H new ATOM 0 HG1 THR A 73 19.985 -5.427 7.664 1.00 0.00 H new ATOM 0 HG21 THR A 73 19.076 -7.380 5.408 1.00 0.00 H new ATOM 0 HG22 THR A 73 17.408 -6.879 5.039 1.00 0.00 H new ATOM 0 HG23 THR A 73 18.781 -5.949 4.392 1.00 0.00 H new ATOM 1153 N PRO A 74 15.187 -4.158 5.521 1.00 0.00 N ATOM 1154 CA PRO A 74 13.749 -4.530 5.354 1.00 0.00 C ATOM 1155 C PRO A 74 13.590 -5.922 4.743 1.00 0.00 C ATOM 1156 O PRO A 74 14.134 -6.208 3.676 1.00 0.00 O ATOM 1157 CB PRO A 74 13.203 -3.449 4.404 1.00 0.00 C ATOM 1158 CG PRO A 74 14.119 -2.277 4.567 1.00 0.00 C ATOM 1159 CD PRO A 74 15.492 -2.853 4.911 1.00 0.00 C ATOM 0 HA PRO A 74 13.220 -4.573 6.306 1.00 0.00 H new ATOM 0 HB2 PRO A 74 13.195 -3.801 3.372 1.00 0.00 H new ATOM 0 HB3 PRO A 74 12.177 -3.184 4.659 1.00 0.00 H new ATOM 0 HG2 PRO A 74 14.163 -1.687 3.652 1.00 0.00 H new ATOM 0 HG3 PRO A 74 13.766 -1.614 5.357 1.00 0.00 H new ATOM 0 HD2 PRO A 74 16.113 -2.963 4.022 1.00 0.00 H new ATOM 0 HD3 PRO A 74 16.035 -2.207 5.601 1.00 0.00 H new ATOM 1167 N LYS A 75 12.836 -6.779 5.423 1.00 0.00 N ATOM 1168 CA LYS A 75 12.612 -8.133 4.932 1.00 0.00 C ATOM 1169 C LYS A 75 11.519 -8.146 3.865 1.00 0.00 C ATOM 1170 O LYS A 75 11.511 -9.003 2.981 1.00 0.00 O ATOM 1171 CB LYS A 75 12.214 -9.049 6.093 1.00 0.00 C ATOM 1172 CG LYS A 75 13.170 -8.813 7.264 1.00 0.00 C ATOM 1173 CD LYS A 75 12.940 -9.878 8.340 1.00 0.00 C ATOM 1174 CE LYS A 75 13.810 -9.573 9.570 1.00 0.00 C ATOM 1175 NZ LYS A 75 15.060 -8.880 9.146 1.00 0.00 N ATOM 0 H LYS A 75 12.374 -6.563 6.306 1.00 0.00 H new ATOM 0 HA LYS A 75 13.538 -8.496 4.485 1.00 0.00 H new ATOM 0 HB2 LYS A 75 11.188 -8.846 6.398 1.00 0.00 H new ATOM 0 HB3 LYS A 75 12.253 -10.092 5.780 1.00 0.00 H new ATOM 0 HG2 LYS A 75 14.202 -8.850 6.916 1.00 0.00 H new ATOM 0 HG3 LYS A 75 13.010 -7.819 7.682 1.00 0.00 H new ATOM 0 HD2 LYS A 75 11.888 -9.900 8.624 1.00 0.00 H new ATOM 0 HD3 LYS A 75 13.184 -10.865 7.946 1.00 0.00 H new ATOM 0 HE2 LYS A 75 13.257 -8.948 10.272 1.00 0.00 H new ATOM 0 HE3 LYS A 75 14.055 -10.498 10.092 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 15.690 -8.767 9.966 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 15.540 -9.445 8.416 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 14.824 -7.944 8.759 1.00 0.00 H new ATOM 1189 N PHE A 76 10.589 -7.195 3.966 1.00 0.00 N ATOM 1190 CA PHE A 76 9.481 -7.101 3.014 1.00 0.00 C ATOM 1191 C PHE A 76 9.844 -6.186 1.848 1.00 0.00 C ATOM 1192 O PHE A 76 9.849 -6.608 0.695 1.00 0.00 O ATOM 1193 CB PHE A 76 8.240 -6.554 3.722 1.00 0.00 C ATOM 1194 CG PHE A 76 8.109 -7.208 5.076 1.00 0.00 C ATOM 1195 CD1 PHE A 76 8.895 -6.757 6.143 1.00 0.00 C ATOM 1196 CD2 PHE A 76 7.206 -8.261 5.268 1.00 0.00 C ATOM 1197 CE1 PHE A 76 8.777 -7.357 7.403 1.00 0.00 C ATOM 1198 CE2 PHE A 76 7.088 -8.861 6.527 1.00 0.00 C ATOM 1199 CZ PHE A 76 7.873 -8.410 7.595 1.00 0.00 C ATOM 0 H PHE A 76 10.581 -6.481 4.695 1.00 0.00 H new ATOM 0 HA PHE A 76 9.276 -8.098 2.624 1.00 0.00 H new ATOM 0 HB2 PHE A 76 8.318 -5.473 3.834 1.00 0.00 H new ATOM 0 HB3 PHE A 76 7.350 -6.749 3.124 1.00 0.00 H new ATOM 0 HD1 PHE A 76 9.593 -5.946 5.994 1.00 0.00 H new ATOM 0 HD2 PHE A 76 6.601 -8.610 4.445 1.00 0.00 H new ATOM 0 HE1 PHE A 76 9.383 -7.008 8.226 1.00 0.00 H new ATOM 0 HE2 PHE A 76 6.391 -9.673 6.675 1.00 0.00 H new ATOM 0 HZ PHE A 76 7.782 -8.874 8.566 1.00 0.00 H new ATOM 1209 N ASN A 77 10.152 -4.932 2.163 1.00 0.00 N ATOM 1210 CA ASN A 77 10.518 -3.958 1.138 1.00 0.00 C ATOM 1211 C ASN A 77 11.796 -4.372 0.417 1.00 0.00 C ATOM 1212 O ASN A 77 12.028 -3.976 -0.725 1.00 0.00 O ATOM 1213 CB ASN A 77 10.697 -2.571 1.761 1.00 0.00 C ATOM 1214 CG ASN A 77 9.418 -2.144 2.472 1.00 0.00 C ATOM 1215 OD1 ASN A 77 8.412 -2.972 2.545 1.00 0.00 O flip ATOM 1216 ND2 ASN A 77 9.332 -1.021 2.969 1.00 0.00 N flip ATOM 0 H ASN A 77 10.156 -4.566 3.115 1.00 0.00 H new ATOM 0 HA ASN A 77 9.709 -3.921 0.408 1.00 0.00 H new ATOM 0 HB2 ASN A 77 11.527 -2.586 2.468 1.00 0.00 H new ATOM 0 HB3 ASN A 77 10.951 -1.847 0.987 1.00 0.00 H new ATOM 0 HD21 ASN A 77 10.120 -0.376 2.911 1.00 0.00 H new ATOM 0 HD22 ASN A 77 8.473 -0.736 3.439 1.00 0.00 H new ATOM 1223 N GLY A 78 12.631 -5.150 1.094 1.00 0.00 N ATOM 1224 CA GLY A 78 13.889 -5.594 0.502 1.00 0.00 C ATOM 1225 C GLY A 78 13.656 -6.496 -0.706 1.00 0.00 C ATOM 1226 O GLY A 78 14.084 -6.180 -1.816 1.00 0.00 O ATOM 0 H GLY A 78 12.464 -5.484 2.043 1.00 0.00 H new ATOM 0 HA2 GLY A 78 14.476 -4.726 0.201 1.00 0.00 H new ATOM 0 HA3 GLY A 78 14.474 -6.130 1.249 1.00 0.00 H new ATOM 1230 N VAL A 79 12.989 -7.624 -0.484 1.00 0.00 N ATOM 1231 CA VAL A 79 12.720 -8.568 -1.564 1.00 0.00 C ATOM 1232 C VAL A 79 11.737 -7.977 -2.580 1.00 0.00 C ATOM 1233 O VAL A 79 11.925 -8.121 -3.788 1.00 0.00 O ATOM 1234 CB VAL A 79 12.169 -9.875 -0.981 1.00 0.00 C ATOM 1235 CG1 VAL A 79 10.798 -9.625 -0.348 1.00 0.00 C ATOM 1236 CG2 VAL A 79 12.042 -10.918 -2.097 1.00 0.00 C ATOM 0 H VAL A 79 12.627 -7.906 0.427 1.00 0.00 H new ATOM 0 HA VAL A 79 13.654 -8.774 -2.087 1.00 0.00 H new ATOM 0 HB VAL A 79 12.851 -10.244 -0.215 1.00 0.00 H new ATOM 0 HG11 VAL A 79 10.412 -10.557 0.064 1.00 0.00 H new ATOM 0 HG12 VAL A 79 10.894 -8.888 0.449 1.00 0.00 H new ATOM 0 HG13 VAL A 79 10.110 -9.251 -1.106 1.00 0.00 H new ATOM 0 HG21 VAL A 79 11.650 -11.847 -1.684 1.00 0.00 H new ATOM 0 HG22 VAL A 79 11.363 -10.548 -2.865 1.00 0.00 H new ATOM 0 HG23 VAL A 79 13.022 -11.101 -2.537 1.00 0.00 H new ATOM 1246 N LYS A 80 10.693 -7.307 -2.086 1.00 0.00 N ATOM 1247 CA LYS A 80 9.696 -6.696 -2.971 1.00 0.00 C ATOM 1248 C LYS A 80 10.241 -5.401 -3.571 1.00 0.00 C ATOM 1249 O LYS A 80 11.100 -5.427 -4.453 1.00 0.00 O ATOM 1250 CB LYS A 80 8.406 -6.399 -2.183 1.00 0.00 C ATOM 1251 CG LYS A 80 7.565 -7.675 -2.045 1.00 0.00 C ATOM 1252 CD LYS A 80 6.361 -7.427 -1.123 1.00 0.00 C ATOM 1253 CE LYS A 80 6.821 -7.265 0.333 1.00 0.00 C ATOM 1254 NZ LYS A 80 5.680 -7.539 1.252 1.00 0.00 N ATOM 0 H LYS A 80 10.516 -7.174 -1.090 1.00 0.00 H new ATOM 0 HA LYS A 80 9.473 -7.393 -3.779 1.00 0.00 H new ATOM 0 HB2 LYS A 80 8.655 -6.010 -1.196 1.00 0.00 H new ATOM 0 HB3 LYS A 80 7.829 -5.628 -2.693 1.00 0.00 H new ATOM 0 HG2 LYS A 80 7.219 -7.998 -3.027 1.00 0.00 H new ATOM 0 HG3 LYS A 80 8.179 -8.481 -1.643 1.00 0.00 H new ATOM 0 HD2 LYS A 80 5.829 -6.532 -1.444 1.00 0.00 H new ATOM 0 HD3 LYS A 80 5.661 -8.259 -1.199 1.00 0.00 H new ATOM 0 HE2 LYS A 80 7.643 -7.949 0.543 1.00 0.00 H new ATOM 0 HE3 LYS A 80 7.198 -6.255 0.496 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 5.658 -6.819 2.002 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 4.789 -7.509 0.717 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 5.796 -8.480 1.679 1.00 0.00 H new ATOM 1268 N LYS A 81 9.736 -4.271 -3.086 1.00 0.00 N ATOM 1269 CA LYS A 81 10.177 -2.972 -3.582 1.00 0.00 C ATOM 1270 C LYS A 81 11.611 -2.693 -3.130 1.00 0.00 C ATOM 1271 O LYS A 81 11.776 -2.051 -2.106 1.00 0.00 O ATOM 1272 CB LYS A 81 9.219 -1.875 -3.063 1.00 0.00 C ATOM 1273 CG LYS A 81 8.147 -1.548 -4.112 1.00 0.00 C ATOM 1274 CD LYS A 81 7.261 -2.775 -4.342 1.00 0.00 C ATOM 1275 CE LYS A 81 6.186 -2.437 -5.378 1.00 0.00 C ATOM 1276 NZ LYS A 81 5.414 -1.248 -4.921 1.00 0.00 N ATOM 1277 OXT LYS A 81 12.521 -3.123 -3.820 1.00 0.00 O ATOM 0 H LYS A 81 9.026 -4.228 -2.355 1.00 0.00 H new ATOM 0 HA LYS A 81 10.159 -2.974 -4.672 1.00 0.00 H new ATOM 0 HB2 LYS A 81 8.743 -2.208 -2.141 1.00 0.00 H new ATOM 0 HB3 LYS A 81 9.785 -0.975 -2.822 1.00 0.00 H new ATOM 0 HG2 LYS A 81 7.540 -0.707 -3.776 1.00 0.00 H new ATOM 0 HG3 LYS A 81 8.619 -1.247 -5.047 1.00 0.00 H new ATOM 0 HD2 LYS A 81 7.865 -3.614 -4.688 1.00 0.00 H new ATOM 0 HD3 LYS A 81 6.796 -3.082 -3.405 1.00 0.00 H new ATOM 0 HE2 LYS A 81 6.648 -2.235 -6.344 1.00 0.00 H new ATOM 0 HE3 LYS A 81 5.518 -3.287 -5.515 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 4.406 -1.385 -5.136 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 5.536 -1.128 -3.895 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 5.761 -0.399 -5.412 1.00 0.00 H new TER 1291 LYS A 81