USER MOD reduce.3.24.130724 H: found=0, std=0, add=1050, rem=0, adj=16 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 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -154:sc= -0.155 (180deg=-0.774) USER MOD Single : A 2 LYS NZ :NH3+ 157:sc= -0.0104 (180deg=-0.339) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 GLN : amide:sc= -0.0278 K(o=-0.028,f=-1.1) USER MOD Single : A 13 ASN :FLIP amide:sc= -7.32! C(o=-9.6!,f=-7.3!) USER MOD Single : A 15 ASN : amide:sc= -0.462 K(o=-0.46,f=-1.6) USER MOD Single : A 16 ASN : amide:sc= -1.12! C(o=-1.1!,f=-1.4!) USER MOD Single : A 21 THR OG1 : rot -155:sc= 0.828 USER MOD Single : A 28 HIS : no HD1:sc= -0.0392 X(o=-0.039,f=-0.00055) USER MOD Single : A 29 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 31 ASN : amide:sc= -3.02 K(o=-3,f=-5.2!) USER MOD Single : A 32 LYS NZ :NH3+ -164:sc= -0.0176 (180deg=-0.205) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 MET CE :methyl -107:sc= -1.04 (180deg=-5.04!) USER MOD Single : A 45 THR OG1 : rot 180:sc= -0.316 USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 61 THR OG1 : rot 104:sc= 0.307 USER MOD Single : A 63 GLN : amide:sc= -0.337 K(o=-0.34,f=-3.7!) USER MOD Single : A 64 HIS : no HD1:sc= -22.4! C(o=-22!,f=-25!) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ -118:sc= 0 (180deg=-0.459) USER MOD Single : A 73 TYR OH : rot 180:sc=-0.00298 USER MOD Single : A 79 HIS : no HD1:sc= -6.99 K(o=-7,f=-7.6!) USER MOD Single : A 81 THR OG1 : rot -120:sc= -1.58 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 GLN : amide:sc= -0.567 X(o=-0.57,f=-0.59) USER MOD Single : A 105 MET CE :methyl -166:sc= -0.0603 (180deg=-0.513) USER MOD Single : A 106 SER OG : rot -4:sc= 0.873 USER MOD Single : A 111 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 119 ASN : amide:sc= -5.77! C(o=-5.8!,f=-13!) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ -144:sc= 0 (180deg=-0.923) USER MOD Single : A 131 8OG O3' : rot 40:sc= -1.59! USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -25.083 -7.100 -4.016 1.00 0.00 N ATOM 2 CA MET A 1 -23.804 -7.277 -3.282 1.00 0.00 C ATOM 3 C MET A 1 -22.665 -6.532 -3.970 1.00 0.00 C ATOM 4 O MET A 1 -22.390 -6.752 -5.150 1.00 0.00 O ATOM 5 CB MET A 1 -23.486 -8.773 -3.207 1.00 0.00 C ATOM 6 CG MET A 1 -24.667 -9.623 -2.768 1.00 0.00 C ATOM 7 SD MET A 1 -25.214 -9.240 -1.093 1.00 0.00 S ATOM 8 CE MET A 1 -26.256 -10.655 -0.745 1.00 0.00 C ATOM 0 H1 MET A 1 -25.880 -7.212 -3.357 1.00 0.00 H new ATOM 0 H2 MET A 1 -25.113 -6.150 -4.437 1.00 0.00 H new ATOM 0 H3 MET A 1 -25.153 -7.815 -4.768 1.00 0.00 H new ATOM 0 HA MET A 1 -23.909 -6.864 -2.279 1.00 0.00 H new ATOM 0 HB2 MET A 1 -23.147 -9.114 -4.185 1.00 0.00 H new ATOM 0 HB3 MET A 1 -22.660 -8.926 -2.512 1.00 0.00 H new ATOM 0 HG2 MET A 1 -25.495 -9.472 -3.460 1.00 0.00 H new ATOM 0 HG3 MET A 1 -24.392 -10.676 -2.824 1.00 0.00 H new ATOM 0 HE1 MET A 1 -26.670 -10.564 0.259 1.00 0.00 H new ATOM 0 HE2 MET A 1 -27.069 -10.695 -1.470 1.00 0.00 H new ATOM 0 HE3 MET A 1 -25.664 -11.568 -0.812 1.00 0.00 H new ATOM 20 N LYS A 2 -22.007 -5.649 -3.227 1.00 0.00 N ATOM 21 CA LYS A 2 -20.897 -4.871 -3.766 1.00 0.00 C ATOM 22 C LYS A 2 -19.561 -5.410 -3.265 1.00 0.00 C ATOM 23 O LYS A 2 -19.412 -5.730 -2.086 1.00 0.00 O ATOM 24 CB LYS A 2 -21.047 -3.398 -3.383 1.00 0.00 C ATOM 25 CG LYS A 2 -20.742 -2.438 -4.523 1.00 0.00 C ATOM 26 CD LYS A 2 -21.409 -1.089 -4.308 1.00 0.00 C ATOM 27 CE LYS A 2 -20.525 0.050 -4.788 1.00 0.00 C ATOM 28 NZ LYS A 2 -19.994 -0.197 -6.157 1.00 0.00 N ATOM 0 H LYS A 2 -22.223 -5.454 -2.249 1.00 0.00 H new ATOM 0 HA LYS A 2 -20.916 -4.959 -4.852 1.00 0.00 H new ATOM 0 HB2 LYS A 2 -22.065 -3.224 -3.035 1.00 0.00 H new ATOM 0 HB3 LYS A 2 -20.382 -3.179 -2.547 1.00 0.00 H new ATOM 0 HG2 LYS A 2 -19.664 -2.303 -4.608 1.00 0.00 H new ATOM 0 HG3 LYS A 2 -21.084 -2.868 -5.464 1.00 0.00 H new ATOM 0 HD2 LYS A 2 -22.360 -1.063 -4.840 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -21.633 -0.957 -3.249 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -21.095 0.979 -4.782 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -19.694 0.181 -4.095 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -19.740 0.709 -6.600 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -19.150 -0.802 -6.098 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -20.720 -0.671 -6.731 1.00 0.00 H new ATOM 42 N LYS A 3 -18.592 -5.506 -4.169 1.00 0.00 N ATOM 43 CA LYS A 3 -17.267 -6.004 -3.820 1.00 0.00 C ATOM 44 C LYS A 3 -16.182 -5.200 -4.526 1.00 0.00 C ATOM 45 O LYS A 3 -16.304 -4.874 -5.707 1.00 0.00 O ATOM 46 CB LYS A 3 -17.142 -7.484 -4.186 1.00 0.00 C ATOM 47 CG LYS A 3 -18.350 -8.315 -3.785 1.00 0.00 C ATOM 48 CD LYS A 3 -17.987 -9.781 -3.619 1.00 0.00 C ATOM 49 CE LYS A 3 -18.308 -10.580 -4.872 1.00 0.00 C ATOM 50 NZ LYS A 3 -17.100 -10.802 -5.714 1.00 0.00 N ATOM 0 H LYS A 3 -18.700 -5.245 -5.149 1.00 0.00 H new ATOM 0 HA LYS A 3 -17.135 -5.892 -2.744 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -16.992 -7.572 -5.262 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -16.254 -7.894 -3.706 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -18.762 -7.933 -2.851 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -19.129 -8.215 -4.541 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -16.925 -9.870 -3.391 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -18.531 -10.198 -2.771 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -18.735 -11.542 -4.589 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -19.065 -10.054 -5.454 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -17.361 -11.350 -6.558 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -16.706 -9.884 -6.005 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -16.387 -11.327 -5.167 1.00 0.00 H new ATOM 64 N LEU A 4 -15.122 -4.881 -3.792 1.00 0.00 N ATOM 65 CA LEU A 4 -14.014 -4.112 -4.344 1.00 0.00 C ATOM 66 C LEU A 4 -12.689 -4.554 -3.729 1.00 0.00 C ATOM 67 O LEU A 4 -12.591 -4.751 -2.518 1.00 0.00 O ATOM 68 CB LEU A 4 -14.241 -2.620 -4.098 1.00 0.00 C ATOM 69 CG LEU A 4 -14.511 -2.235 -2.644 1.00 0.00 C ATOM 70 CD1 LEU A 4 -13.207 -1.944 -1.920 1.00 0.00 C ATOM 71 CD2 LEU A 4 -15.441 -1.034 -2.576 1.00 0.00 C ATOM 0 H LEU A 4 -15.007 -5.143 -2.813 1.00 0.00 H new ATOM 0 HA LEU A 4 -13.968 -4.293 -5.418 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -13.364 -2.073 -4.445 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -15.083 -2.292 -4.707 1.00 0.00 H new ATOM 0 HG LEU A 4 -14.998 -3.075 -2.149 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -13.418 -1.671 -0.886 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -12.574 -2.831 -1.940 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -12.692 -1.120 -2.415 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -15.623 -0.773 -1.533 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -14.981 -0.188 -3.087 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -16.387 -1.279 -3.059 1.00 0.00 H new ATOM 83 N GLN A 5 -11.674 -4.722 -4.572 1.00 0.00 N ATOM 84 CA GLN A 5 -10.362 -5.157 -4.109 1.00 0.00 C ATOM 85 C GLN A 5 -9.371 -4.006 -4.034 1.00 0.00 C ATOM 86 O GLN A 5 -9.435 -3.053 -4.811 1.00 0.00 O ATOM 87 CB GLN A 5 -9.808 -6.237 -5.030 1.00 0.00 C ATOM 88 CG GLN A 5 -10.800 -7.345 -5.302 1.00 0.00 C ATOM 89 CD GLN A 5 -10.167 -8.553 -5.965 1.00 0.00 C ATOM 90 OE1 GLN A 5 -8.996 -8.857 -5.737 1.00 0.00 O ATOM 91 NE2 GLN A 5 -10.940 -9.249 -6.791 1.00 0.00 N ATOM 0 H GLN A 5 -11.736 -4.563 -5.578 1.00 0.00 H new ATOM 0 HA GLN A 5 -10.495 -5.556 -3.103 1.00 0.00 H new ATOM 0 HB2 GLN A 5 -9.510 -5.783 -5.975 1.00 0.00 H new ATOM 0 HB3 GLN A 5 -8.909 -6.662 -4.583 1.00 0.00 H new ATOM 0 HG2 GLN A 5 -11.261 -7.652 -4.363 1.00 0.00 H new ATOM 0 HG3 GLN A 5 -11.598 -6.963 -5.939 1.00 0.00 H new ATOM 0 HE21 GLN A 5 -11.905 -8.961 -6.951 1.00 0.00 H new ATOM 0 HE22 GLN A 5 -10.568 -10.072 -7.266 1.00 0.00 H new ATOM 100 N ILE A 6 -8.448 -4.123 -3.094 1.00 0.00 N ATOM 101 CA ILE A 6 -7.415 -3.129 -2.886 1.00 0.00 C ATOM 102 C ILE A 6 -6.130 -3.806 -2.429 1.00 0.00 C ATOM 103 O ILE A 6 -6.108 -4.473 -1.395 1.00 0.00 O ATOM 104 CB ILE A 6 -7.840 -2.095 -1.834 1.00 0.00 C ATOM 105 CG1 ILE A 6 -9.265 -1.617 -2.102 1.00 0.00 C ATOM 106 CG2 ILE A 6 -6.876 -0.928 -1.834 1.00 0.00 C ATOM 107 CD1 ILE A 6 -10.325 -2.495 -1.476 1.00 0.00 C ATOM 0 H ILE A 6 -8.396 -4.914 -2.452 1.00 0.00 H new ATOM 0 HA ILE A 6 -7.251 -2.615 -3.833 1.00 0.00 H new ATOM 0 HB ILE A 6 -7.818 -2.564 -0.850 1.00 0.00 H new ATOM 0 HG12 ILE A 6 -9.376 -0.601 -1.723 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -9.429 -1.575 -3.179 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -7.186 -0.200 -1.084 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -5.873 -1.285 -1.600 1.00 0.00 H new ATOM 0 HG23 ILE A 6 -6.874 -0.458 -2.817 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -11.312 -2.095 -1.708 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -10.241 -3.506 -1.873 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -10.187 -2.517 -0.395 1.00 0.00 H new ATOM 119 N ALA A 7 -5.060 -3.640 -3.196 1.00 0.00 N ATOM 120 CA ALA A 7 -3.786 -4.247 -2.846 1.00 0.00 C ATOM 121 C ALA A 7 -2.705 -3.193 -2.773 1.00 0.00 C ATOM 122 O ALA A 7 -2.706 -2.248 -3.551 1.00 0.00 O ATOM 123 CB ALA A 7 -3.413 -5.327 -3.849 1.00 0.00 C ATOM 0 H ALA A 7 -5.050 -3.094 -4.058 1.00 0.00 H new ATOM 0 HA ALA A 7 -3.883 -4.712 -1.865 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -2.457 -5.769 -3.569 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -4.182 -6.100 -3.854 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -3.333 -4.888 -4.843 1.00 0.00 H new ATOM 129 N VAL A 8 -1.788 -3.346 -1.836 1.00 0.00 N ATOM 130 CA VAL A 8 -0.715 -2.380 -1.689 1.00 0.00 C ATOM 131 C VAL A 8 0.586 -3.051 -1.272 1.00 0.00 C ATOM 132 O VAL A 8 0.591 -4.182 -0.785 1.00 0.00 O ATOM 133 CB VAL A 8 -1.079 -1.260 -0.684 1.00 0.00 C ATOM 134 CG1 VAL A 8 -2.575 -1.247 -0.396 1.00 0.00 C ATOM 135 CG2 VAL A 8 -0.286 -1.402 0.611 1.00 0.00 C ATOM 0 H VAL A 8 -1.763 -4.120 -1.172 1.00 0.00 H new ATOM 0 HA VAL A 8 -0.572 -1.923 -2.668 1.00 0.00 H new ATOM 0 HB VAL A 8 -0.812 -0.308 -1.142 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -2.802 -0.451 0.313 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -3.122 -1.075 -1.323 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -2.872 -2.206 0.028 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -0.563 -0.602 1.297 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -0.508 -2.366 1.070 1.00 0.00 H new ATOM 0 HG23 VAL A 8 0.780 -1.340 0.393 1.00 0.00 H new ATOM 145 N GLY A 9 1.682 -2.334 -1.460 1.00 0.00 N ATOM 146 CA GLY A 9 2.979 -2.852 -1.094 1.00 0.00 C ATOM 147 C GLY A 9 3.892 -1.770 -0.557 1.00 0.00 C ATOM 148 O GLY A 9 4.148 -0.775 -1.233 1.00 0.00 O ATOM 0 H GLY A 9 1.694 -1.397 -1.862 1.00 0.00 H new ATOM 0 HA2 GLY A 9 2.859 -3.631 -0.341 1.00 0.00 H new ATOM 0 HA3 GLY A 9 3.442 -3.318 -1.964 1.00 0.00 H new ATOM 152 N ILE A 10 4.394 -1.966 0.657 1.00 0.00 N ATOM 153 CA ILE A 10 5.295 -0.990 1.265 1.00 0.00 C ATOM 154 C ILE A 10 6.634 -1.028 0.542 1.00 0.00 C ATOM 155 O ILE A 10 7.373 -2.002 0.657 1.00 0.00 O ATOM 156 CB ILE A 10 5.523 -1.235 2.785 1.00 0.00 C ATOM 157 CG1 ILE A 10 4.530 -2.258 3.352 1.00 0.00 C ATOM 158 CG2 ILE A 10 5.414 0.075 3.554 1.00 0.00 C ATOM 159 CD1 ILE A 10 3.080 -1.867 3.157 1.00 0.00 C ATOM 0 H ILE A 10 4.196 -2.782 1.236 1.00 0.00 H new ATOM 0 HA ILE A 10 4.824 -0.012 1.167 1.00 0.00 H new ATOM 0 HB ILE A 10 6.527 -1.642 2.904 1.00 0.00 H new ATOM 0 HG12 ILE A 10 4.704 -3.223 2.877 1.00 0.00 H new ATOM 0 HG13 ILE A 10 4.723 -2.387 4.417 1.00 0.00 H new ATOM 0 HG21 ILE A 10 5.576 -0.112 4.616 1.00 0.00 H new ATOM 0 HG22 ILE A 10 6.167 0.774 3.190 1.00 0.00 H new ATOM 0 HG23 ILE A 10 4.422 0.501 3.408 1.00 0.00 H new ATOM 0 HD11 ILE A 10 2.435 -2.636 3.582 1.00 0.00 H new ATOM 0 HD12 ILE A 10 2.889 -0.917 3.656 1.00 0.00 H new ATOM 0 HD13 ILE A 10 2.870 -1.766 2.092 1.00 0.00 H new ATOM 171 N ILE A 11 6.927 0.021 -0.228 1.00 0.00 N ATOM 172 CA ILE A 11 8.167 0.079 -1.004 1.00 0.00 C ATOM 173 C ILE A 11 9.392 0.268 -0.120 1.00 0.00 C ATOM 174 O ILE A 11 9.508 1.253 0.606 1.00 0.00 O ATOM 175 CB ILE A 11 8.144 1.204 -2.058 1.00 0.00 C ATOM 176 CG1 ILE A 11 6.724 1.433 -2.587 1.00 0.00 C ATOM 177 CG2 ILE A 11 9.091 0.858 -3.199 1.00 0.00 C ATOM 178 CD1 ILE A 11 6.683 2.181 -3.902 1.00 0.00 C ATOM 0 H ILE A 11 6.326 0.839 -0.331 1.00 0.00 H new ATOM 0 HA ILE A 11 8.235 -0.884 -1.509 1.00 0.00 H new ATOM 0 HB ILE A 11 8.476 2.129 -1.587 1.00 0.00 H new ATOM 0 HG12 ILE A 11 6.231 0.469 -2.711 1.00 0.00 H new ATOM 0 HG13 ILE A 11 6.153 1.989 -1.844 1.00 0.00 H new ATOM 0 HG21 ILE A 11 9.072 1.655 -3.942 1.00 0.00 H new ATOM 0 HG22 ILE A 11 10.104 0.748 -2.811 1.00 0.00 H new ATOM 0 HG23 ILE A 11 8.776 -0.077 -3.662 1.00 0.00 H new ATOM 0 HD11 ILE A 11 5.647 2.307 -4.217 1.00 0.00 H new ATOM 0 HD12 ILE A 11 7.147 3.160 -3.778 1.00 0.00 H new ATOM 0 HD13 ILE A 11 7.226 1.615 -4.659 1.00 0.00 H new ATOM 190 N ARG A 12 10.307 -0.692 -0.196 1.00 0.00 N ATOM 191 CA ARG A 12 11.533 -0.653 0.590 1.00 0.00 C ATOM 192 C ARG A 12 12.597 0.207 -0.074 1.00 0.00 C ATOM 193 O ARG A 12 12.989 -0.040 -1.219 1.00 0.00 O ATOM 194 CB ARG A 12 12.074 -2.064 0.809 1.00 0.00 C ATOM 195 CG ARG A 12 11.924 -2.544 2.241 1.00 0.00 C ATOM 196 CD ARG A 12 13.274 -2.772 2.903 1.00 0.00 C ATOM 197 NE ARG A 12 13.197 -3.754 3.982 1.00 0.00 N ATOM 198 CZ ARG A 12 12.736 -3.481 5.200 1.00 0.00 C ATOM 199 NH1 ARG A 12 12.310 -2.259 5.498 1.00 0.00 N ATOM 200 NH2 ARG A 12 12.699 -4.432 6.123 1.00 0.00 N ATOM 0 H ARG A 12 10.221 -1.511 -0.798 1.00 0.00 H new ATOM 0 HA ARG A 12 11.287 -0.207 1.554 1.00 0.00 H new ATOM 0 HB2 ARG A 12 11.553 -2.753 0.145 1.00 0.00 H new ATOM 0 HB3 ARG A 12 13.128 -2.090 0.532 1.00 0.00 H new ATOM 0 HG2 ARG A 12 11.358 -1.809 2.813 1.00 0.00 H new ATOM 0 HG3 ARG A 12 11.350 -3.471 2.256 1.00 0.00 H new ATOM 0 HD2 ARG A 12 13.991 -3.111 2.156 1.00 0.00 H new ATOM 0 HD3 ARG A 12 13.648 -1.828 3.299 1.00 0.00 H new ATOM 0 HE ARG A 12 13.515 -4.704 3.791 1.00 0.00 H new ATOM 0 HH11 ARG A 12 12.335 -1.524 4.791 1.00 0.00 H new ATOM 0 HH12 ARG A 12 11.958 -2.056 6.433 1.00 0.00 H new ATOM 0 HH21 ARG A 12 13.024 -5.373 5.899 1.00 0.00 H new ATOM 0 HH22 ARG A 12 12.346 -4.223 7.057 1.00 0.00 H new ATOM 214 N ASN A 13 13.053 1.210 0.670 1.00 0.00 N ATOM 215 CA ASN A 13 14.077 2.139 0.203 1.00 0.00 C ATOM 216 C ASN A 13 15.477 1.565 0.359 1.00 0.00 C ATOM 217 O ASN A 13 15.663 0.393 0.690 1.00 0.00 O ATOM 218 CB ASN A 13 13.990 3.460 0.958 1.00 0.00 C ATOM 219 CG ASN A 13 14.649 4.630 0.242 1.00 0.00 C ATOM 220 OD1 ASN A 13 14.621 4.624 -1.087 1.00 0.00 O flip ATOM 221 ND2 ASN A 13 15.181 5.536 0.883 1.00 0.00 N flip ATOM 0 H ASN A 13 12.722 1.402 1.616 1.00 0.00 H new ATOM 0 HA ASN A 13 13.890 2.309 -0.857 1.00 0.00 H new ATOM 0 HB2 ASN A 13 12.941 3.699 1.131 1.00 0.00 H new ATOM 0 HB3 ASN A 13 14.455 3.338 1.936 1.00 0.00 H new ATOM 0 HD21 ASN A 13 15.183 5.506 1.903 1.00 0.00 H new ATOM 0 HD22 ASN A 13 15.620 6.316 0.395 1.00 0.00 H new ATOM 228 N GLU A 14 16.449 2.419 0.097 1.00 0.00 N ATOM 229 CA GLU A 14 17.860 2.065 0.174 1.00 0.00 C ATOM 230 C GLU A 14 18.396 2.138 1.609 1.00 0.00 C ATOM 231 O GLU A 14 19.570 1.858 1.851 1.00 0.00 O ATOM 232 CB GLU A 14 18.654 3.010 -0.732 1.00 0.00 C ATOM 233 CG GLU A 14 20.164 2.912 -0.566 1.00 0.00 C ATOM 234 CD GLU A 14 20.708 3.914 0.433 1.00 0.00 C ATOM 235 OE1 GLU A 14 19.919 4.411 1.263 1.00 0.00 O ATOM 236 OE2 GLU A 14 21.922 4.202 0.384 1.00 0.00 O ATOM 0 H GLU A 14 16.283 3.387 -0.178 1.00 0.00 H new ATOM 0 HA GLU A 14 17.974 1.033 -0.157 1.00 0.00 H new ATOM 0 HB2 GLU A 14 18.400 2.799 -1.771 1.00 0.00 H new ATOM 0 HB3 GLU A 14 18.343 4.035 -0.530 1.00 0.00 H new ATOM 0 HG2 GLU A 14 20.425 1.904 -0.243 1.00 0.00 H new ATOM 0 HG3 GLU A 14 20.643 3.071 -1.532 1.00 0.00 H new ATOM 243 N ASN A 15 17.544 2.519 2.557 1.00 0.00 N ATOM 244 CA ASN A 15 17.967 2.628 3.952 1.00 0.00 C ATOM 245 C ASN A 15 16.934 2.016 4.895 1.00 0.00 C ATOM 246 O ASN A 15 16.530 2.638 5.878 1.00 0.00 O ATOM 247 CB ASN A 15 18.206 4.094 4.319 1.00 0.00 C ATOM 248 CG ASN A 15 18.754 4.256 5.723 1.00 0.00 C ATOM 249 OD1 ASN A 15 19.276 3.309 6.311 1.00 0.00 O ATOM 250 ND2 ASN A 15 18.637 5.461 6.268 1.00 0.00 N ATOM 0 H ASN A 15 16.566 2.755 2.389 1.00 0.00 H new ATOM 0 HA ASN A 15 18.898 2.073 4.063 1.00 0.00 H new ATOM 0 HB2 ASN A 15 18.903 4.535 3.607 1.00 0.00 H new ATOM 0 HB3 ASN A 15 17.270 4.645 4.232 1.00 0.00 H new ATOM 0 HD21 ASN A 15 18.987 5.630 7.211 1.00 0.00 H new ATOM 0 HD22 ASN A 15 18.197 6.217 5.744 1.00 0.00 H new ATOM 257 N ASN A 16 16.509 0.792 4.588 1.00 0.00 N ATOM 258 CA ASN A 16 15.519 0.088 5.408 1.00 0.00 C ATOM 259 C ASN A 16 14.321 0.985 5.719 1.00 0.00 C ATOM 260 O ASN A 16 13.602 0.761 6.694 1.00 0.00 O ATOM 261 CB ASN A 16 16.140 -0.429 6.714 1.00 0.00 C ATOM 262 CG ASN A 16 17.595 -0.030 6.889 1.00 0.00 C ATOM 263 OD1 ASN A 16 18.472 -0.502 6.166 1.00 0.00 O ATOM 264 ND2 ASN A 16 17.857 0.844 7.855 1.00 0.00 N ATOM 0 H ASN A 16 16.834 0.265 3.777 1.00 0.00 H new ATOM 0 HA ASN A 16 15.172 -0.768 4.829 1.00 0.00 H new ATOM 0 HB2 ASN A 16 15.563 -0.050 7.557 1.00 0.00 H new ATOM 0 HB3 ASN A 16 16.063 -1.516 6.739 1.00 0.00 H new ATOM 0 HD21 ASN A 16 18.816 1.149 8.020 1.00 0.00 H new ATOM 0 HD22 ASN A 16 17.099 1.210 8.431 1.00 0.00 H new ATOM 271 N GLU A 17 14.101 1.985 4.873 1.00 0.00 N ATOM 272 CA GLU A 17 12.981 2.901 5.038 1.00 0.00 C ATOM 273 C GLU A 17 12.017 2.721 3.879 1.00 0.00 C ATOM 274 O GLU A 17 12.416 2.280 2.808 1.00 0.00 O ATOM 275 CB GLU A 17 13.474 4.349 5.105 1.00 0.00 C ATOM 276 CG GLU A 17 14.343 4.755 3.927 1.00 0.00 C ATOM 277 CD GLU A 17 15.004 6.104 4.127 1.00 0.00 C ATOM 278 OE1 GLU A 17 15.368 6.421 5.279 1.00 0.00 O ATOM 279 OE2 GLU A 17 15.160 6.843 3.132 1.00 0.00 O ATOM 0 H GLU A 17 14.688 2.182 4.062 1.00 0.00 H new ATOM 0 HA GLU A 17 12.468 2.678 5.974 1.00 0.00 H new ATOM 0 HB2 GLU A 17 12.612 5.015 5.155 1.00 0.00 H new ATOM 0 HB3 GLU A 17 14.039 4.489 6.027 1.00 0.00 H new ATOM 0 HG2 GLU A 17 15.111 3.998 3.769 1.00 0.00 H new ATOM 0 HG3 GLU A 17 13.734 4.784 3.024 1.00 0.00 H new ATOM 286 N ILE A 18 10.748 3.035 4.086 1.00 0.00 N ATOM 287 CA ILE A 18 9.759 2.866 3.030 1.00 0.00 C ATOM 288 C ILE A 18 8.942 4.135 2.802 1.00 0.00 C ATOM 289 O ILE A 18 8.608 4.854 3.743 1.00 0.00 O ATOM 290 CB ILE A 18 8.815 1.688 3.350 1.00 0.00 C ATOM 291 CG1 ILE A 18 9.569 0.360 3.240 1.00 0.00 C ATOM 292 CG2 ILE A 18 7.598 1.689 2.433 1.00 0.00 C ATOM 293 CD1 ILE A 18 9.285 -0.592 4.381 1.00 0.00 C ATOM 0 H ILE A 18 10.380 3.404 4.963 1.00 0.00 H new ATOM 0 HA ILE A 18 10.307 2.650 2.113 1.00 0.00 H new ATOM 0 HB ILE A 18 8.460 1.808 4.374 1.00 0.00 H new ATOM 0 HG12 ILE A 18 9.303 -0.123 2.300 1.00 0.00 H new ATOM 0 HG13 ILE A 18 10.640 0.561 3.203 1.00 0.00 H new ATOM 0 HG21 ILE A 18 6.953 0.847 2.684 1.00 0.00 H new ATOM 0 HG22 ILE A 18 7.046 2.620 2.562 1.00 0.00 H new ATOM 0 HG23 ILE A 18 7.923 1.601 1.396 1.00 0.00 H new ATOM 0 HD11 ILE A 18 9.853 -1.511 4.238 1.00 0.00 H new ATOM 0 HD12 ILE A 18 9.577 -0.128 5.323 1.00 0.00 H new ATOM 0 HD13 ILE A 18 8.220 -0.823 4.406 1.00 0.00 H new ATOM 305 N PHE A 19 8.619 4.388 1.538 1.00 0.00 N ATOM 306 CA PHE A 19 7.835 5.553 1.159 1.00 0.00 C ATOM 307 C PHE A 19 6.346 5.210 1.148 1.00 0.00 C ATOM 308 O PHE A 19 5.916 4.296 0.444 1.00 0.00 O ATOM 309 CB PHE A 19 8.292 6.067 -0.217 1.00 0.00 C ATOM 310 CG PHE A 19 7.193 6.186 -1.242 1.00 0.00 C ATOM 311 CD1 PHE A 19 6.800 5.086 -1.987 1.00 0.00 C ATOM 312 CD2 PHE A 19 6.559 7.397 -1.456 1.00 0.00 C ATOM 313 CE1 PHE A 19 5.793 5.193 -2.927 1.00 0.00 C ATOM 314 CE2 PHE A 19 5.551 7.512 -2.395 1.00 0.00 C ATOM 315 CZ PHE A 19 5.168 6.409 -3.132 1.00 0.00 C ATOM 0 H PHE A 19 8.892 3.795 0.754 1.00 0.00 H new ATOM 0 HA PHE A 19 7.993 6.344 1.892 1.00 0.00 H new ATOM 0 HB2 PHE A 19 8.758 7.044 -0.088 1.00 0.00 H new ATOM 0 HB3 PHE A 19 9.060 5.397 -0.603 1.00 0.00 H new ATOM 0 HD1 PHE A 19 7.286 4.134 -1.831 1.00 0.00 H new ATOM 0 HD2 PHE A 19 6.855 8.263 -0.883 1.00 0.00 H new ATOM 0 HE1 PHE A 19 5.495 4.328 -3.501 1.00 0.00 H new ATOM 0 HE2 PHE A 19 5.064 8.463 -2.552 1.00 0.00 H new ATOM 0 HZ PHE A 19 4.382 6.496 -3.867 1.00 0.00 H new ATOM 325 N ILE A 20 5.566 5.947 1.928 1.00 0.00 N ATOM 326 CA ILE A 20 4.130 5.721 2.001 1.00 0.00 C ATOM 327 C ILE A 20 3.376 6.962 1.539 1.00 0.00 C ATOM 328 O ILE A 20 3.695 8.080 1.944 1.00 0.00 O ATOM 329 CB ILE A 20 3.674 5.347 3.431 1.00 0.00 C ATOM 330 CG1 ILE A 20 4.842 5.426 4.421 1.00 0.00 C ATOM 331 CG2 ILE A 20 3.061 3.955 3.446 1.00 0.00 C ATOM 332 CD1 ILE A 20 4.409 5.417 5.869 1.00 0.00 C ATOM 0 H ILE A 20 5.904 6.706 2.519 1.00 0.00 H new ATOM 0 HA ILE A 20 3.903 4.882 1.343 1.00 0.00 H new ATOM 0 HB ILE A 20 2.917 6.067 3.742 1.00 0.00 H new ATOM 0 HG12 ILE A 20 5.513 4.585 4.246 1.00 0.00 H new ATOM 0 HG13 ILE A 20 5.412 6.335 4.226 1.00 0.00 H new ATOM 0 HG21 ILE A 20 2.745 3.707 4.459 1.00 0.00 H new ATOM 0 HG22 ILE A 20 2.198 3.930 2.781 1.00 0.00 H new ATOM 0 HG23 ILE A 20 3.800 3.228 3.108 1.00 0.00 H new ATOM 0 HD11 ILE A 20 5.287 5.475 6.512 1.00 0.00 H new ATOM 0 HD12 ILE A 20 3.762 6.273 6.061 1.00 0.00 H new ATOM 0 HD13 ILE A 20 3.865 4.496 6.080 1.00 0.00 H new ATOM 344 N THR A 21 2.382 6.762 0.685 1.00 0.00 N ATOM 345 CA THR A 21 1.592 7.869 0.164 1.00 0.00 C ATOM 346 C THR A 21 0.694 8.458 1.245 1.00 0.00 C ATOM 347 O THR A 21 -0.205 7.789 1.752 1.00 0.00 O ATOM 348 CB THR A 21 0.746 7.405 -1.021 1.00 0.00 C ATOM 349 OG1 THR A 21 -0.327 6.592 -0.582 1.00 0.00 O ATOM 350 CG2 THR A 21 1.532 6.616 -2.045 1.00 0.00 C ATOM 0 H THR A 21 2.103 5.844 0.338 1.00 0.00 H new ATOM 0 HA THR A 21 2.280 8.645 -0.170 1.00 0.00 H new ATOM 0 HB THR A 21 0.382 8.318 -1.492 1.00 0.00 H new ATOM 0 HG1 THR A 21 -0.605 5.997 -1.309 1.00 0.00 H new ATOM 0 HG21 THR A 21 0.872 6.317 -2.859 1.00 0.00 H new ATOM 0 HG22 THR A 21 2.338 7.234 -2.440 1.00 0.00 H new ATOM 0 HG23 THR A 21 1.953 5.727 -1.575 1.00 0.00 H new ATOM 358 N ARG A 22 0.945 9.717 1.590 1.00 0.00 N ATOM 359 CA ARG A 22 0.160 10.402 2.610 1.00 0.00 C ATOM 360 C ARG A 22 -0.625 11.554 2.001 1.00 0.00 C ATOM 361 O ARG A 22 -0.439 11.895 0.832 1.00 0.00 O ATOM 362 CB ARG A 22 1.063 10.922 3.732 1.00 0.00 C ATOM 363 CG ARG A 22 2.414 11.430 3.251 1.00 0.00 C ATOM 364 CD ARG A 22 3.339 11.738 4.418 1.00 0.00 C ATOM 365 NE ARG A 22 4.636 12.241 3.972 1.00 0.00 N ATOM 366 CZ ARG A 22 4.861 13.504 3.619 1.00 0.00 C ATOM 367 NH1 ARG A 22 3.879 14.395 3.650 1.00 0.00 N ATOM 368 NH2 ARG A 22 6.073 13.877 3.231 1.00 0.00 N ATOM 0 H ARG A 22 1.686 10.283 1.178 1.00 0.00 H new ATOM 0 HA ARG A 22 -0.542 9.683 3.031 1.00 0.00 H new ATOM 0 HB2 ARG A 22 0.548 11.728 4.255 1.00 0.00 H new ATOM 0 HB3 ARG A 22 1.223 10.123 4.456 1.00 0.00 H new ATOM 0 HG2 ARG A 22 2.876 10.683 2.606 1.00 0.00 H new ATOM 0 HG3 ARG A 22 2.273 12.328 2.649 1.00 0.00 H new ATOM 0 HD2 ARG A 22 2.869 12.476 5.068 1.00 0.00 H new ATOM 0 HD3 ARG A 22 3.485 10.836 5.012 1.00 0.00 H new ATOM 0 HE ARG A 22 5.416 11.585 3.929 1.00 0.00 H new ATOM 0 HH11 ARG A 22 2.944 14.114 3.946 1.00 0.00 H new ATOM 0 HH12 ARG A 22 4.059 15.362 3.378 1.00 0.00 H new ATOM 0 HH21 ARG A 22 6.832 13.196 3.203 1.00 0.00 H new ATOM 0 HH22 ARG A 22 6.246 14.845 2.960 1.00 0.00 H new ATOM 382 N ARG A 23 -1.502 12.151 2.797 1.00 0.00 N ATOM 383 CA ARG A 23 -2.316 13.269 2.332 1.00 0.00 C ATOM 384 C ARG A 23 -1.462 14.522 2.140 1.00 0.00 C ATOM 385 O ARG A 23 -1.697 15.547 2.778 1.00 0.00 O ATOM 386 CB ARG A 23 -3.443 13.554 3.324 1.00 0.00 C ATOM 387 CG ARG A 23 -4.631 12.615 3.178 1.00 0.00 C ATOM 388 CD ARG A 23 -5.868 13.344 2.674 1.00 0.00 C ATOM 389 NE ARG A 23 -6.205 12.968 1.303 1.00 0.00 N ATOM 390 CZ ARG A 23 -5.594 13.460 0.227 1.00 0.00 C ATOM 391 NH1 ARG A 23 -4.616 14.348 0.358 1.00 0.00 N ATOM 392 NH2 ARG A 23 -5.962 13.063 -0.984 1.00 0.00 N ATOM 0 H ARG A 23 -1.669 11.881 3.766 1.00 0.00 H new ATOM 0 HA ARG A 23 -2.749 12.995 1.370 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -3.052 13.477 4.338 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -3.783 14.581 3.190 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -4.376 11.811 2.488 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -4.849 12.152 4.140 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -6.711 13.122 3.328 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -5.700 14.420 2.724 1.00 0.00 H new ATOM 0 HE ARG A 23 -6.952 12.288 1.162 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -4.329 14.657 1.287 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -4.152 14.721 -0.470 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -6.713 12.381 -1.091 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -5.494 13.440 -1.808 1.00 0.00 H new ATOM 406 N ALA A 24 -0.474 14.430 1.252 1.00 0.00 N ATOM 407 CA ALA A 24 0.420 15.549 0.964 1.00 0.00 C ATOM 408 C ALA A 24 0.890 16.239 2.248 1.00 0.00 C ATOM 409 O ALA A 24 1.892 15.841 2.842 1.00 0.00 O ATOM 410 CB ALA A 24 -0.263 16.538 0.031 1.00 0.00 C ATOM 0 H ALA A 24 -0.272 13.586 0.716 1.00 0.00 H new ATOM 0 HA ALA A 24 1.307 15.155 0.467 1.00 0.00 H new ATOM 0 HB1 ALA A 24 0.412 17.368 -0.177 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -0.522 16.038 -0.902 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -1.169 16.917 0.503 1.00 0.00 H new ATOM 416 N ALA A 25 0.163 17.273 2.672 1.00 0.00 N ATOM 417 CA ALA A 25 0.514 18.006 3.885 1.00 0.00 C ATOM 418 C ALA A 25 -0.499 19.110 4.172 1.00 0.00 C ATOM 419 O ALA A 25 -0.144 20.175 4.677 1.00 0.00 O ATOM 420 CB ALA A 25 1.913 18.592 3.762 1.00 0.00 C ATOM 0 H ALA A 25 -0.669 17.620 2.195 1.00 0.00 H new ATOM 0 HA ALA A 25 0.497 17.306 4.720 1.00 0.00 H new ATOM 0 HB1 ALA A 25 2.161 19.136 4.674 1.00 0.00 H new ATOM 0 HB2 ALA A 25 2.633 17.787 3.612 1.00 0.00 H new ATOM 0 HB3 ALA A 25 1.949 19.273 2.912 1.00 0.00 H new ATOM 426 N ASP A 26 -1.764 18.849 3.847 1.00 0.00 N ATOM 427 CA ASP A 26 -2.832 19.821 4.069 1.00 0.00 C ATOM 428 C ASP A 26 -4.139 19.338 3.449 1.00 0.00 C ATOM 429 O ASP A 26 -4.401 19.573 2.269 1.00 0.00 O ATOM 430 CB ASP A 26 -2.453 21.184 3.483 1.00 0.00 C ATOM 431 CG ASP A 26 -1.868 21.072 2.088 1.00 0.00 C ATOM 432 OD1 ASP A 26 -0.665 20.760 1.972 1.00 0.00 O ATOM 433 OD2 ASP A 26 -2.614 21.297 1.112 1.00 0.00 O ATOM 0 H ASP A 26 -2.074 17.972 3.429 1.00 0.00 H new ATOM 0 HA ASP A 26 -2.971 19.926 5.145 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -3.336 21.822 3.453 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -1.731 21.670 4.139 1.00 0.00 H new ATOM 438 N ALA A 27 -4.957 18.664 4.250 1.00 0.00 N ATOM 439 CA ALA A 27 -6.236 18.149 3.776 1.00 0.00 C ATOM 440 C ALA A 27 -7.155 17.801 4.942 1.00 0.00 C ATOM 441 O ALA A 27 -6.740 17.823 6.101 1.00 0.00 O ATOM 442 CB ALA A 27 -6.019 16.932 2.892 1.00 0.00 C ATOM 0 H ALA A 27 -4.757 18.462 5.230 1.00 0.00 H new ATOM 0 HA ALA A 27 -6.718 18.930 3.189 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -6.982 16.558 2.545 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -5.407 17.210 2.034 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -5.512 16.154 3.462 1.00 0.00 H new ATOM 448 N HIS A 28 -8.406 17.481 4.627 1.00 0.00 N ATOM 449 CA HIS A 28 -9.385 17.127 5.648 1.00 0.00 C ATOM 450 C HIS A 28 -8.937 15.896 6.427 1.00 0.00 C ATOM 451 O HIS A 28 -8.602 15.984 7.608 1.00 0.00 O ATOM 452 CB HIS A 28 -10.751 16.870 5.008 1.00 0.00 C ATOM 453 CG HIS A 28 -11.261 18.025 4.203 1.00 0.00 C ATOM 454 ND1 HIS A 28 -12.009 19.049 4.747 1.00 0.00 N ATOM 455 CD2 HIS A 28 -11.129 18.317 2.888 1.00 0.00 C ATOM 456 CE1 HIS A 28 -12.315 19.920 3.801 1.00 0.00 C ATOM 457 NE2 HIS A 28 -11.791 19.499 2.664 1.00 0.00 N ATOM 0 H HIS A 28 -8.766 17.460 3.673 1.00 0.00 H new ATOM 0 HA HIS A 28 -9.468 17.964 6.341 1.00 0.00 H new ATOM 0 HB2 HIS A 28 -10.683 15.992 4.366 1.00 0.00 H new ATOM 0 HB3 HIS A 28 -11.472 16.637 5.791 1.00 0.00 H new ATOM 0 HD2 HIS A 28 -10.601 17.729 2.152 1.00 0.00 H new ATOM 0 HE1 HIS A 28 -12.894 20.822 3.935 1.00 0.00 H new ATOM 0 HE2 HIS A 28 -11.866 19.975 1.765 1.00 0.00 H new ATOM 466 N MET A 29 -8.931 14.747 5.757 1.00 0.00 N ATOM 467 CA MET A 29 -8.522 13.498 6.387 1.00 0.00 C ATOM 468 C MET A 29 -7.038 13.231 6.152 1.00 0.00 C ATOM 469 O MET A 29 -6.668 12.310 5.425 1.00 0.00 O ATOM 470 CB MET A 29 -9.356 12.333 5.848 1.00 0.00 C ATOM 471 CG MET A 29 -10.618 12.067 6.650 1.00 0.00 C ATOM 472 SD MET A 29 -11.277 10.411 6.378 1.00 0.00 S ATOM 473 CE MET A 29 -12.873 10.795 5.660 1.00 0.00 C ATOM 0 H MET A 29 -9.205 14.656 4.779 1.00 0.00 H new ATOM 0 HA MET A 29 -8.690 13.588 7.460 1.00 0.00 H new ATOM 0 HB2 MET A 29 -9.630 12.541 4.814 1.00 0.00 H new ATOM 0 HB3 MET A 29 -8.743 11.431 5.840 1.00 0.00 H new ATOM 0 HG2 MET A 29 -10.404 12.199 7.711 1.00 0.00 H new ATOM 0 HG3 MET A 29 -11.376 12.804 6.383 1.00 0.00 H new ATOM 0 HE1 MET A 29 -13.403 9.869 5.436 1.00 0.00 H new ATOM 0 HE2 MET A 29 -13.457 11.386 6.366 1.00 0.00 H new ATOM 0 HE3 MET A 29 -12.731 11.364 4.741 1.00 0.00 H new ATOM 483 N ALA A 30 -6.192 14.047 6.774 1.00 0.00 N ATOM 484 CA ALA A 30 -4.747 13.903 6.634 1.00 0.00 C ATOM 485 C ALA A 30 -4.228 12.680 7.387 1.00 0.00 C ATOM 486 O ALA A 30 -3.060 12.312 7.255 1.00 0.00 O ATOM 487 CB ALA A 30 -4.043 15.159 7.123 1.00 0.00 C ATOM 0 H ALA A 30 -6.482 14.815 7.380 1.00 0.00 H new ATOM 0 HA ALA A 30 -4.529 13.759 5.576 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -2.965 15.038 7.013 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -4.374 16.014 6.534 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -4.284 15.326 8.173 1.00 0.00 H new ATOM 493 N ASN A 31 -5.093 12.056 8.183 1.00 0.00 N ATOM 494 CA ASN A 31 -4.708 10.882 8.957 1.00 0.00 C ATOM 495 C ASN A 31 -4.999 9.591 8.192 1.00 0.00 C ATOM 496 O ASN A 31 -5.288 8.558 8.795 1.00 0.00 O ATOM 497 CB ASN A 31 -5.442 10.873 10.301 1.00 0.00 C ATOM 498 CG ASN A 31 -4.508 11.105 11.471 1.00 0.00 C ATOM 499 OD1 ASN A 31 -3.389 11.588 11.301 1.00 0.00 O ATOM 500 ND2 ASN A 31 -4.964 10.760 12.670 1.00 0.00 N ATOM 0 H ASN A 31 -6.063 12.344 8.308 1.00 0.00 H new ATOM 0 HA ASN A 31 -3.634 10.934 9.134 1.00 0.00 H new ATOM 0 HB2 ASN A 31 -6.212 11.644 10.296 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -5.949 9.917 10.429 1.00 0.00 H new ATOM 0 HD21 ASN A 31 -4.380 10.892 13.495 1.00 0.00 H new ATOM 0 HD22 ASN A 31 -5.899 10.363 12.765 1.00 0.00 H new ATOM 507 N LYS A 32 -4.914 9.651 6.866 1.00 0.00 N ATOM 508 CA LYS A 32 -5.165 8.476 6.036 1.00 0.00 C ATOM 509 C LYS A 32 -3.901 8.032 5.309 1.00 0.00 C ATOM 510 O LYS A 32 -3.965 7.397 4.255 1.00 0.00 O ATOM 511 CB LYS A 32 -6.294 8.753 5.037 1.00 0.00 C ATOM 512 CG LYS A 32 -5.810 9.289 3.699 1.00 0.00 C ATOM 513 CD LYS A 32 -6.882 10.113 3.005 1.00 0.00 C ATOM 514 CE LYS A 32 -7.956 9.229 2.392 1.00 0.00 C ATOM 515 NZ LYS A 32 -7.445 8.464 1.222 1.00 0.00 N ATOM 0 H LYS A 32 -4.675 10.495 6.345 1.00 0.00 H new ATOM 0 HA LYS A 32 -5.475 7.663 6.692 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -6.852 7.832 4.869 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -6.988 9.470 5.476 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -4.922 9.902 3.852 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -5.517 8.458 3.058 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -7.337 10.797 3.722 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -6.425 10.725 2.227 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -8.328 8.535 3.145 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -8.800 9.845 2.082 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -8.247 8.092 0.674 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -6.875 9.091 0.620 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -6.856 7.674 1.554 1.00 0.00 H new ATOM 529 N LEU A 33 -2.758 8.363 5.886 1.00 0.00 N ATOM 530 CA LEU A 33 -1.465 7.997 5.310 1.00 0.00 C ATOM 531 C LEU A 33 -1.468 6.529 4.886 1.00 0.00 C ATOM 532 O LEU A 33 -1.280 5.638 5.710 1.00 0.00 O ATOM 533 CB LEU A 33 -0.355 8.266 6.332 1.00 0.00 C ATOM 534 CG LEU A 33 1.095 8.051 5.860 1.00 0.00 C ATOM 535 CD1 LEU A 33 1.780 6.996 6.715 1.00 0.00 C ATOM 536 CD2 LEU A 33 1.168 7.663 4.387 1.00 0.00 C ATOM 0 H LEU A 33 -2.694 8.888 6.758 1.00 0.00 H new ATOM 0 HA LEU A 33 -1.281 8.603 4.423 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -0.451 9.297 6.673 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -0.528 7.626 7.197 1.00 0.00 H new ATOM 0 HG LEU A 33 1.616 9.001 5.974 1.00 0.00 H new ATOM 0 HD11 LEU A 33 2.804 6.856 6.369 1.00 0.00 H new ATOM 0 HD12 LEU A 33 1.790 7.321 7.755 1.00 0.00 H new ATOM 0 HD13 LEU A 33 1.237 6.054 6.635 1.00 0.00 H new ATOM 0 HD21 LEU A 33 2.210 7.522 4.099 1.00 0.00 H new ATOM 0 HD22 LEU A 33 0.619 6.735 4.227 1.00 0.00 H new ATOM 0 HD23 LEU A 33 0.728 8.454 3.780 1.00 0.00 H new ATOM 548 N GLU A 34 -1.705 6.282 3.601 1.00 0.00 N ATOM 549 CA GLU A 34 -1.759 4.916 3.086 1.00 0.00 C ATOM 550 C GLU A 34 -0.530 4.563 2.256 1.00 0.00 C ATOM 551 O GLU A 34 0.455 5.302 2.229 1.00 0.00 O ATOM 552 CB GLU A 34 -3.028 4.721 2.252 1.00 0.00 C ATOM 553 CG GLU A 34 -3.871 3.536 2.690 1.00 0.00 C ATOM 554 CD GLU A 34 -5.323 3.673 2.271 1.00 0.00 C ATOM 555 OE1 GLU A 34 -5.663 3.222 1.157 1.00 0.00 O ATOM 556 OE2 GLU A 34 -6.117 4.233 3.055 1.00 0.00 O ATOM 0 H GLU A 34 -1.862 7.006 2.899 1.00 0.00 H new ATOM 0 HA GLU A 34 -1.776 4.245 3.944 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -3.632 5.626 2.309 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -2.748 4.590 1.207 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -3.457 2.622 2.264 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -3.816 3.436 3.774 1.00 0.00 H new ATOM 563 N PHE A 35 -0.599 3.411 1.590 1.00 0.00 N ATOM 564 CA PHE A 35 0.502 2.928 0.763 1.00 0.00 C ATOM 565 C PHE A 35 0.078 2.774 -0.701 1.00 0.00 C ATOM 566 O PHE A 35 -1.106 2.851 -1.029 1.00 0.00 O ATOM 567 CB PHE A 35 1.033 1.588 1.294 1.00 0.00 C ATOM 568 CG PHE A 35 0.689 1.307 2.733 1.00 0.00 C ATOM 569 CD1 PHE A 35 -0.617 1.039 3.111 1.00 0.00 C ATOM 570 CD2 PHE A 35 1.676 1.310 3.706 1.00 0.00 C ATOM 571 CE1 PHE A 35 -0.933 0.780 4.431 1.00 0.00 C ATOM 572 CE2 PHE A 35 1.366 1.052 5.028 1.00 0.00 C ATOM 573 CZ PHE A 35 0.060 0.786 5.390 1.00 0.00 C ATOM 0 H PHE A 35 -1.411 2.794 1.609 1.00 0.00 H new ATOM 0 HA PHE A 35 1.297 3.672 0.813 1.00 0.00 H new ATOM 0 HB2 PHE A 35 0.636 0.783 0.675 1.00 0.00 H new ATOM 0 HB3 PHE A 35 2.117 1.571 1.183 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -1.398 1.032 2.365 1.00 0.00 H new ATOM 0 HD2 PHE A 35 2.699 1.516 3.428 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -1.955 0.573 4.712 1.00 0.00 H new ATOM 0 HE2 PHE A 35 2.144 1.058 5.777 1.00 0.00 H new ATOM 0 HZ PHE A 35 -0.184 0.583 6.422 1.00 0.00 H new ATOM 583 N PRO A 36 1.059 2.565 -1.598 1.00 0.00 N ATOM 584 CA PRO A 36 0.825 2.409 -3.040 1.00 0.00 C ATOM 585 C PRO A 36 0.337 1.015 -3.440 1.00 0.00 C ATOM 586 O PRO A 36 0.400 0.069 -2.659 1.00 0.00 O ATOM 587 CB PRO A 36 2.202 2.676 -3.642 1.00 0.00 C ATOM 588 CG PRO A 36 3.161 2.220 -2.600 1.00 0.00 C ATOM 589 CD PRO A 36 2.498 2.475 -1.271 1.00 0.00 C ATOM 0 HA PRO A 36 0.037 3.078 -3.386 1.00 0.00 H new ATOM 0 HB2 PRO A 36 2.340 2.129 -4.575 1.00 0.00 H new ATOM 0 HB3 PRO A 36 2.337 3.733 -3.870 1.00 0.00 H new ATOM 0 HG2 PRO A 36 3.393 1.162 -2.722 1.00 0.00 H new ATOM 0 HG3 PRO A 36 4.103 2.763 -2.675 1.00 0.00 H new ATOM 0 HD2 PRO A 36 2.697 1.669 -0.565 1.00 0.00 H new ATOM 0 HD3 PRO A 36 2.861 3.395 -0.814 1.00 0.00 H new ATOM 597 N GLY A 37 -0.128 0.910 -4.681 1.00 0.00 N ATOM 598 CA GLY A 37 -0.615 -0.353 -5.221 1.00 0.00 C ATOM 599 C GLY A 37 -2.132 -0.480 -5.286 1.00 0.00 C ATOM 600 O GLY A 37 -2.645 -1.452 -5.829 1.00 0.00 O ATOM 0 H GLY A 37 -0.177 1.691 -5.335 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -0.211 -0.482 -6.225 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -0.222 -1.167 -4.612 1.00 0.00 H new ATOM 604 N GLY A 38 -2.849 0.497 -4.760 1.00 0.00 N ATOM 605 CA GLY A 38 -4.303 0.467 -4.790 1.00 0.00 C ATOM 606 C GLY A 38 -4.877 0.421 -6.202 1.00 0.00 C ATOM 607 O GLY A 38 -4.205 0.797 -7.166 1.00 0.00 O ATOM 0 H GLY A 38 -2.451 1.320 -4.308 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -4.653 -0.403 -4.235 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -4.688 1.348 -4.277 1.00 0.00 H new ATOM 611 N LYS A 39 -6.133 -0.036 -6.312 1.00 0.00 N ATOM 612 CA LYS A 39 -6.837 -0.136 -7.591 1.00 0.00 C ATOM 613 C LYS A 39 -6.524 -1.442 -8.315 1.00 0.00 C ATOM 614 O LYS A 39 -6.958 -1.646 -9.449 1.00 0.00 O ATOM 615 CB LYS A 39 -6.528 1.053 -8.502 1.00 0.00 C ATOM 616 CG LYS A 39 -7.352 1.052 -9.779 1.00 0.00 C ATOM 617 CD LYS A 39 -8.066 2.379 -9.996 1.00 0.00 C ATOM 618 CE LYS A 39 -9.553 2.182 -10.247 1.00 0.00 C ATOM 619 NZ LYS A 39 -10.374 2.607 -9.080 1.00 0.00 N ATOM 0 H LYS A 39 -6.687 -0.346 -5.513 1.00 0.00 H new ATOM 0 HA LYS A 39 -7.901 -0.124 -7.356 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -6.713 1.979 -7.957 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -5.469 1.041 -8.759 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -6.702 0.846 -10.630 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -8.086 0.248 -9.736 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -7.925 3.015 -9.122 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -7.619 2.898 -10.844 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -9.851 2.751 -11.127 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -9.748 1.132 -10.465 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -11.381 2.457 -9.291 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -10.108 2.046 -8.246 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -10.207 3.615 -8.887 1.00 0.00 H new ATOM 633 N ILE A 40 -5.792 -2.339 -7.657 1.00 0.00 N ATOM 634 CA ILE A 40 -5.462 -3.628 -8.257 1.00 0.00 C ATOM 635 C ILE A 40 -6.730 -4.336 -8.709 1.00 0.00 C ATOM 636 O ILE A 40 -6.722 -5.145 -9.637 1.00 0.00 O ATOM 637 CB ILE A 40 -4.681 -4.530 -7.284 1.00 0.00 C ATOM 638 CG1 ILE A 40 -5.610 -5.149 -6.227 1.00 0.00 C ATOM 639 CG2 ILE A 40 -3.570 -3.722 -6.634 1.00 0.00 C ATOM 640 CD1 ILE A 40 -5.262 -6.579 -5.874 1.00 0.00 C ATOM 0 H ILE A 40 -5.420 -2.199 -6.718 1.00 0.00 H new ATOM 0 HA ILE A 40 -4.824 -3.434 -9.119 1.00 0.00 H new ATOM 0 HB ILE A 40 -4.241 -5.356 -7.843 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -5.573 -4.541 -5.323 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -6.636 -5.114 -6.593 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -3.014 -4.357 -5.944 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -2.896 -3.345 -7.403 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -4.002 -2.883 -6.088 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -5.960 -6.949 -5.123 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -5.327 -7.200 -6.767 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -4.247 -6.619 -5.477 1.00 0.00 H new ATOM 652 N GLU A 41 -7.818 -4.004 -8.027 1.00 0.00 N ATOM 653 CA GLU A 41 -9.130 -4.566 -8.306 1.00 0.00 C ATOM 654 C GLU A 41 -9.389 -4.631 -9.804 1.00 0.00 C ATOM 655 O GLU A 41 -9.474 -5.717 -10.374 1.00 0.00 O ATOM 656 CB GLU A 41 -10.210 -3.723 -7.621 1.00 0.00 C ATOM 657 CG GLU A 41 -9.925 -2.223 -7.627 1.00 0.00 C ATOM 658 CD GLU A 41 -10.954 -1.434 -8.413 1.00 0.00 C ATOM 659 OE1 GLU A 41 -12.058 -1.199 -7.878 1.00 0.00 O ATOM 660 OE2 GLU A 41 -10.656 -1.050 -9.564 1.00 0.00 O ATOM 0 H GLU A 41 -7.813 -3.332 -7.259 1.00 0.00 H new ATOM 0 HA GLU A 41 -9.161 -5.582 -7.913 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -11.165 -3.903 -8.116 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -10.317 -4.058 -6.589 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -9.900 -1.858 -6.600 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -8.937 -2.047 -8.052 1.00 0.00 H new ATOM 667 N MET A 42 -9.504 -3.454 -10.424 1.00 0.00 N ATOM 668 CA MET A 42 -9.746 -3.326 -11.868 1.00 0.00 C ATOM 669 C MET A 42 -10.202 -4.644 -12.503 1.00 0.00 C ATOM 670 O MET A 42 -11.397 -4.869 -12.695 1.00 0.00 O ATOM 671 CB MET A 42 -8.480 -2.824 -12.567 1.00 0.00 C ATOM 672 CG MET A 42 -8.134 -1.383 -12.234 1.00 0.00 C ATOM 673 SD MET A 42 -8.777 -0.215 -13.446 1.00 0.00 S ATOM 674 CE MET A 42 -10.440 0.032 -12.830 1.00 0.00 C ATOM 0 H MET A 42 -9.432 -2.559 -9.940 1.00 0.00 H new ATOM 0 HA MET A 42 -10.554 -2.606 -11.998 1.00 0.00 H new ATOM 0 HB2 MET A 42 -7.643 -3.464 -12.288 1.00 0.00 H new ATOM 0 HB3 MET A 42 -8.608 -2.919 -13.645 1.00 0.00 H new ATOM 0 HG2 MET A 42 -8.533 -1.136 -11.250 1.00 0.00 H new ATOM 0 HG3 MET A 42 -7.051 -1.278 -12.174 1.00 0.00 H new ATOM 0 HE1 MET A 42 -11.149 -0.476 -13.484 1.00 0.00 H new ATOM 0 HE2 MET A 42 -10.519 -0.376 -11.822 1.00 0.00 H new ATOM 0 HE3 MET A 42 -10.665 1.098 -12.808 1.00 0.00 H new ATOM 684 N GLY A 43 -9.241 -5.507 -12.822 1.00 0.00 N ATOM 685 CA GLY A 43 -9.564 -6.785 -13.426 1.00 0.00 C ATOM 686 C GLY A 43 -8.341 -7.644 -13.657 1.00 0.00 C ATOM 687 O GLY A 43 -8.268 -8.391 -14.632 1.00 0.00 O ATOM 0 H GLY A 43 -8.245 -5.343 -12.672 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -10.263 -7.320 -12.784 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -10.070 -6.616 -14.377 1.00 0.00 H new ATOM 691 N GLU A 44 -7.382 -7.528 -12.759 1.00 0.00 N ATOM 692 CA GLU A 44 -6.142 -8.291 -12.859 1.00 0.00 C ATOM 693 C GLU A 44 -6.269 -9.643 -12.162 1.00 0.00 C ATOM 694 O GLU A 44 -7.352 -10.027 -11.722 1.00 0.00 O ATOM 695 CB GLU A 44 -4.982 -7.495 -12.260 1.00 0.00 C ATOM 696 CG GLU A 44 -4.171 -6.730 -13.293 1.00 0.00 C ATOM 697 CD GLU A 44 -5.034 -5.852 -14.178 1.00 0.00 C ATOM 698 OE1 GLU A 44 -5.742 -4.976 -13.637 1.00 0.00 O ATOM 699 OE2 GLU A 44 -5.004 -6.041 -15.412 1.00 0.00 O ATOM 0 H GLU A 44 -7.433 -6.912 -11.948 1.00 0.00 H new ATOM 0 HA GLU A 44 -5.941 -8.473 -13.915 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -5.376 -6.792 -11.526 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -4.322 -8.178 -11.725 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -3.432 -6.111 -12.784 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -3.621 -7.437 -13.914 1.00 0.00 H new ATOM 706 N THR A 45 -5.152 -10.361 -12.066 1.00 0.00 N ATOM 707 CA THR A 45 -5.134 -11.670 -11.426 1.00 0.00 C ATOM 708 C THR A 45 -4.581 -11.560 -10.007 1.00 0.00 C ATOM 709 O THR A 45 -3.824 -10.642 -9.702 1.00 0.00 O ATOM 710 CB THR A 45 -4.285 -12.649 -12.246 1.00 0.00 C ATOM 711 OG1 THR A 45 -3.854 -12.051 -13.455 1.00 0.00 O ATOM 712 CG2 THR A 45 -5.017 -13.925 -12.604 1.00 0.00 C ATOM 0 H THR A 45 -4.247 -10.056 -12.425 1.00 0.00 H new ATOM 0 HA THR A 45 -6.156 -12.046 -11.376 1.00 0.00 H new ATOM 0 HB THR A 45 -3.440 -12.900 -11.605 1.00 0.00 H new ATOM 0 HG1 THR A 45 -3.313 -12.692 -13.962 1.00 0.00 H new ATOM 0 HG21 THR A 45 -4.358 -14.572 -13.184 1.00 0.00 H new ATOM 0 HG22 THR A 45 -5.320 -14.439 -11.692 1.00 0.00 H new ATOM 0 HG23 THR A 45 -5.901 -13.684 -13.195 1.00 0.00 H new ATOM 720 N PRO A 46 -4.943 -12.502 -9.118 1.00 0.00 N ATOM 721 CA PRO A 46 -4.473 -12.507 -7.732 1.00 0.00 C ATOM 722 C PRO A 46 -2.980 -12.208 -7.616 1.00 0.00 C ATOM 723 O PRO A 46 -2.515 -11.723 -6.585 1.00 0.00 O ATOM 724 CB PRO A 46 -4.780 -13.937 -7.249 1.00 0.00 C ATOM 725 CG PRO A 46 -5.284 -14.677 -8.446 1.00 0.00 C ATOM 726 CD PRO A 46 -5.829 -13.637 -9.377 1.00 0.00 C ATOM 0 HA PRO A 46 -4.959 -11.732 -7.139 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -3.887 -14.412 -6.844 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -5.525 -13.929 -6.453 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -4.482 -15.243 -8.920 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -6.057 -15.392 -8.165 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -5.786 -13.959 -10.418 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -6.870 -13.400 -9.159 1.00 0.00 H new ATOM 734 N GLU A 47 -2.232 -12.500 -8.677 1.00 0.00 N ATOM 735 CA GLU A 47 -0.794 -12.261 -8.684 1.00 0.00 C ATOM 736 C GLU A 47 -0.440 -11.017 -9.497 1.00 0.00 C ATOM 737 O GLU A 47 0.414 -10.227 -9.094 1.00 0.00 O ATOM 738 CB GLU A 47 -0.057 -13.478 -9.248 1.00 0.00 C ATOM 739 CG GLU A 47 0.393 -14.464 -8.183 1.00 0.00 C ATOM 740 CD GLU A 47 -0.494 -15.692 -8.111 1.00 0.00 C ATOM 741 OE1 GLU A 47 -1.724 -15.527 -7.969 1.00 0.00 O ATOM 742 OE2 GLU A 47 0.041 -16.817 -8.197 1.00 0.00 O ATOM 0 H GLU A 47 -2.598 -12.901 -9.540 1.00 0.00 H new ATOM 0 HA GLU A 47 -0.480 -12.094 -7.654 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -0.709 -13.992 -9.955 1.00 0.00 H new ATOM 0 HB3 GLU A 47 0.814 -13.138 -9.807 1.00 0.00 H new ATOM 0 HG2 GLU A 47 1.418 -14.773 -8.389 1.00 0.00 H new ATOM 0 HG3 GLU A 47 0.399 -13.967 -7.213 1.00 0.00 H new ATOM 749 N GLN A 48 -1.093 -10.850 -10.643 1.00 0.00 N ATOM 750 CA GLN A 48 -0.835 -9.704 -11.510 1.00 0.00 C ATOM 751 C GLN A 48 -1.560 -8.450 -11.021 1.00 0.00 C ATOM 752 O GLN A 48 -1.385 -7.369 -11.582 1.00 0.00 O ATOM 753 CB GLN A 48 -1.259 -10.020 -12.945 1.00 0.00 C ATOM 754 CG GLN A 48 -0.446 -11.130 -13.590 1.00 0.00 C ATOM 755 CD GLN A 48 0.563 -10.607 -14.593 1.00 0.00 C ATOM 756 OE1 GLN A 48 1.757 -10.527 -14.307 1.00 0.00 O ATOM 757 NE2 GLN A 48 0.085 -10.249 -15.780 1.00 0.00 N ATOM 0 H GLN A 48 -1.804 -11.492 -10.993 1.00 0.00 H new ATOM 0 HA GLN A 48 0.237 -9.506 -11.482 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -2.312 -10.302 -12.950 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -1.168 -9.117 -13.549 1.00 0.00 H new ATOM 0 HG2 GLN A 48 0.076 -11.691 -12.814 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -1.120 -11.827 -14.088 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -0.913 -10.332 -15.974 1.00 0.00 H new ATOM 0 HE22 GLN A 48 0.716 -9.891 -16.497 1.00 0.00 H new ATOM 766 N ALA A 49 -2.372 -8.593 -9.979 1.00 0.00 N ATOM 767 CA ALA A 49 -3.111 -7.462 -9.436 1.00 0.00 C ATOM 768 C ALA A 49 -2.163 -6.378 -8.950 1.00 0.00 C ATOM 769 O ALA A 49 -2.254 -5.226 -9.370 1.00 0.00 O ATOM 770 CB ALA A 49 -4.022 -7.915 -8.307 1.00 0.00 C ATOM 0 H ALA A 49 -2.534 -9.477 -9.496 1.00 0.00 H new ATOM 0 HA ALA A 49 -3.726 -7.044 -10.233 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -4.567 -7.057 -7.913 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -4.730 -8.652 -8.685 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -3.423 -8.361 -7.513 1.00 0.00 H new ATOM 776 N VAL A 50 -1.252 -6.752 -8.063 1.00 0.00 N ATOM 777 CA VAL A 50 -0.286 -5.804 -7.522 1.00 0.00 C ATOM 778 C VAL A 50 0.844 -5.539 -8.511 1.00 0.00 C ATOM 779 O VAL A 50 1.230 -4.395 -8.731 1.00 0.00 O ATOM 780 CB VAL A 50 0.315 -6.297 -6.187 1.00 0.00 C ATOM 781 CG1 VAL A 50 -0.769 -6.881 -5.293 1.00 0.00 C ATOM 782 CG2 VAL A 50 1.423 -7.314 -6.430 1.00 0.00 C ATOM 0 H VAL A 50 -1.161 -7.702 -7.703 1.00 0.00 H new ATOM 0 HA VAL A 50 -0.830 -4.877 -7.341 1.00 0.00 H new ATOM 0 HB VAL A 50 0.753 -5.440 -5.676 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -0.325 -7.222 -4.358 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -1.517 -6.117 -5.082 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -1.243 -7.723 -5.798 1.00 0.00 H new ATOM 0 HG21 VAL A 50 1.829 -7.645 -5.474 1.00 0.00 H new ATOM 0 HG22 VAL A 50 1.019 -8.171 -6.969 1.00 0.00 H new ATOM 0 HG23 VAL A 50 2.215 -6.855 -7.021 1.00 0.00 H new ATOM 792 N VAL A 51 1.377 -6.611 -9.093 1.00 0.00 N ATOM 793 CA VAL A 51 2.475 -6.504 -10.044 1.00 0.00 C ATOM 794 C VAL A 51 2.125 -5.571 -11.191 1.00 0.00 C ATOM 795 O VAL A 51 2.954 -4.775 -11.630 1.00 0.00 O ATOM 796 CB VAL A 51 2.862 -7.884 -10.612 1.00 0.00 C ATOM 797 CG1 VAL A 51 4.104 -7.778 -11.484 1.00 0.00 C ATOM 798 CG2 VAL A 51 3.075 -8.886 -9.486 1.00 0.00 C ATOM 0 H VAL A 51 1.063 -7.566 -8.920 1.00 0.00 H new ATOM 0 HA VAL A 51 3.325 -6.093 -9.499 1.00 0.00 H new ATOM 0 HB VAL A 51 2.041 -8.241 -11.234 1.00 0.00 H new ATOM 0 HG11 VAL A 51 4.360 -8.763 -11.875 1.00 0.00 H new ATOM 0 HG12 VAL A 51 3.909 -7.098 -12.313 1.00 0.00 H new ATOM 0 HG13 VAL A 51 4.934 -7.397 -10.890 1.00 0.00 H new ATOM 0 HG21 VAL A 51 3.347 -9.854 -9.907 1.00 0.00 H new ATOM 0 HG22 VAL A 51 3.875 -8.536 -8.834 1.00 0.00 H new ATOM 0 HG23 VAL A 51 2.155 -8.987 -8.910 1.00 0.00 H new ATOM 808 N ARG A 52 0.894 -5.668 -11.676 1.00 0.00 N ATOM 809 CA ARG A 52 0.457 -4.820 -12.771 1.00 0.00 C ATOM 810 C ARG A 52 0.128 -3.422 -12.263 1.00 0.00 C ATOM 811 O ARG A 52 0.593 -2.423 -12.810 1.00 0.00 O ATOM 812 CB ARG A 52 -0.754 -5.429 -13.480 1.00 0.00 C ATOM 813 CG ARG A 52 -0.888 -5.003 -14.933 1.00 0.00 C ATOM 814 CD ARG A 52 -1.138 -3.509 -15.059 1.00 0.00 C ATOM 815 NE ARG A 52 -2.228 -3.060 -14.196 1.00 0.00 N ATOM 816 CZ ARG A 52 -3.517 -3.169 -14.512 1.00 0.00 C ATOM 817 NH1 ARG A 52 -3.882 -3.716 -15.665 1.00 0.00 N ATOM 818 NH2 ARG A 52 -4.445 -2.732 -13.671 1.00 0.00 N ATOM 0 H ARG A 52 0.189 -6.319 -11.331 1.00 0.00 H new ATOM 0 HA ARG A 52 1.272 -4.746 -13.491 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -0.682 -6.516 -13.434 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -1.659 -5.146 -12.942 1.00 0.00 H new ATOM 0 HG2 ARG A 52 0.020 -5.267 -15.475 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -1.708 -5.550 -15.399 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -0.227 -2.967 -14.804 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -1.374 -3.267 -16.095 1.00 0.00 H new ATOM 0 HE ARG A 52 -1.988 -2.638 -13.299 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -3.173 -4.056 -16.315 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -4.871 -3.796 -15.901 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -4.171 -2.313 -12.782 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -5.432 -2.815 -13.913 1.00 0.00 H new ATOM 832 N GLU A 53 -0.667 -3.363 -11.202 1.00 0.00 N ATOM 833 CA GLU A 53 -1.050 -2.096 -10.602 1.00 0.00 C ATOM 834 C GLU A 53 0.177 -1.372 -10.052 1.00 0.00 C ATOM 835 O GLU A 53 0.155 -0.160 -9.846 1.00 0.00 O ATOM 836 CB GLU A 53 -2.071 -2.330 -9.486 1.00 0.00 C ATOM 837 CG GLU A 53 -2.974 -1.138 -9.220 1.00 0.00 C ATOM 838 CD GLU A 53 -3.692 -0.659 -10.467 1.00 0.00 C ATOM 839 OE1 GLU A 53 -3.727 -1.416 -11.461 1.00 0.00 O ATOM 840 OE2 GLU A 53 -4.220 0.471 -10.450 1.00 0.00 O ATOM 0 H GLU A 53 -1.059 -4.183 -10.739 1.00 0.00 H new ATOM 0 HA GLU A 53 -1.504 -1.470 -11.370 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -2.688 -3.190 -9.746 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -1.540 -2.584 -8.568 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -3.710 -1.407 -8.462 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -2.380 -0.321 -8.811 1.00 0.00 H new ATOM 847 N LEU A 54 1.252 -2.128 -9.824 1.00 0.00 N ATOM 848 CA LEU A 54 2.490 -1.557 -9.308 1.00 0.00 C ATOM 849 C LEU A 54 3.018 -0.497 -10.259 1.00 0.00 C ATOM 850 O LEU A 54 3.421 0.585 -9.839 1.00 0.00 O ATOM 851 CB LEU A 54 3.543 -2.649 -9.118 1.00 0.00 C ATOM 852 CG LEU A 54 4.224 -2.656 -7.751 1.00 0.00 C ATOM 853 CD1 LEU A 54 3.246 -3.086 -6.668 1.00 0.00 C ATOM 854 CD2 LEU A 54 5.441 -3.564 -7.773 1.00 0.00 C ATOM 0 H LEU A 54 1.287 -3.134 -9.989 1.00 0.00 H new ATOM 0 HA LEU A 54 2.279 -1.097 -8.343 1.00 0.00 H new ATOM 0 HB2 LEU A 54 3.072 -3.619 -9.278 1.00 0.00 H new ATOM 0 HB3 LEU A 54 4.307 -2.535 -9.887 1.00 0.00 H new ATOM 0 HG LEU A 54 4.556 -1.643 -7.523 1.00 0.00 H new ATOM 0 HD11 LEU A 54 3.750 -3.085 -5.701 1.00 0.00 H new ATOM 0 HD12 LEU A 54 2.406 -2.392 -6.640 1.00 0.00 H new ATOM 0 HD13 LEU A 54 2.881 -4.090 -6.885 1.00 0.00 H new ATOM 0 HD21 LEU A 54 5.916 -3.559 -6.792 1.00 0.00 H new ATOM 0 HD22 LEU A 54 5.133 -4.579 -8.022 1.00 0.00 H new ATOM 0 HD23 LEU A 54 6.149 -3.206 -8.521 1.00 0.00 H new ATOM 866 N GLN A 55 2.997 -0.811 -11.548 1.00 0.00 N ATOM 867 CA GLN A 55 3.459 0.125 -12.560 1.00 0.00 C ATOM 868 C GLN A 55 2.598 1.382 -12.533 1.00 0.00 C ATOM 869 O GLN A 55 3.064 2.477 -12.847 1.00 0.00 O ATOM 870 CB GLN A 55 3.412 -0.521 -13.948 1.00 0.00 C ATOM 871 CG GLN A 55 4.781 -0.689 -14.588 1.00 0.00 C ATOM 872 CD GLN A 55 4.749 -0.498 -16.091 1.00 0.00 C ATOM 873 OE1 GLN A 55 4.317 -1.381 -16.832 1.00 0.00 O ATOM 874 NE2 GLN A 55 5.208 0.660 -16.550 1.00 0.00 N ATOM 0 H GLN A 55 2.666 -1.703 -11.915 1.00 0.00 H new ATOM 0 HA GLN A 55 4.492 0.397 -12.342 1.00 0.00 H new ATOM 0 HB2 GLN A 55 2.935 -1.498 -13.869 1.00 0.00 H new ATOM 0 HB3 GLN A 55 2.787 0.087 -14.602 1.00 0.00 H new ATOM 0 HG2 GLN A 55 5.474 0.029 -14.149 1.00 0.00 H new ATOM 0 HG3 GLN A 55 5.165 -1.683 -14.360 1.00 0.00 H new ATOM 0 HE21 GLN A 55 5.557 1.364 -15.900 1.00 0.00 H new ATOM 0 HE22 GLN A 55 5.212 0.846 -17.553 1.00 0.00 H new ATOM 883 N GLU A 56 1.336 1.209 -12.150 1.00 0.00 N ATOM 884 CA GLU A 56 0.400 2.322 -12.071 1.00 0.00 C ATOM 885 C GLU A 56 0.636 3.159 -10.822 1.00 0.00 C ATOM 886 O GLU A 56 0.388 4.362 -10.820 1.00 0.00 O ATOM 887 CB GLU A 56 -1.039 1.804 -12.066 1.00 0.00 C ATOM 888 CG GLU A 56 -2.033 2.750 -12.720 1.00 0.00 C ATOM 889 CD GLU A 56 -2.634 3.739 -11.736 1.00 0.00 C ATOM 890 OE1 GLU A 56 -3.465 3.318 -10.902 1.00 0.00 O ATOM 891 OE2 GLU A 56 -2.272 4.932 -11.799 1.00 0.00 O ATOM 0 H GLU A 56 0.939 0.306 -11.889 1.00 0.00 H new ATOM 0 HA GLU A 56 0.563 2.951 -12.946 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -1.072 0.844 -12.581 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -1.347 1.623 -11.036 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -1.535 3.297 -13.521 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -2.833 2.169 -13.180 1.00 0.00 H new ATOM 898 N GLU A 57 1.085 2.514 -9.749 1.00 0.00 N ATOM 899 CA GLU A 57 1.319 3.211 -8.488 1.00 0.00 C ATOM 900 C GLU A 57 2.804 3.359 -8.163 1.00 0.00 C ATOM 901 O GLU A 57 3.165 3.833 -7.085 1.00 0.00 O ATOM 902 CB GLU A 57 0.600 2.493 -7.350 1.00 0.00 C ATOM 903 CG GLU A 57 -0.854 2.912 -7.205 1.00 0.00 C ATOM 904 CD GLU A 57 -1.608 2.844 -8.515 1.00 0.00 C ATOM 905 OE1 GLU A 57 -1.972 1.725 -8.926 1.00 0.00 O ATOM 906 OE2 GLU A 57 -1.834 3.908 -9.127 1.00 0.00 O ATOM 0 H GLU A 57 1.293 1.516 -9.727 1.00 0.00 H new ATOM 0 HA GLU A 57 0.916 4.218 -8.600 1.00 0.00 H new ATOM 0 HB2 GLU A 57 0.647 1.417 -7.520 1.00 0.00 H new ATOM 0 HB3 GLU A 57 1.124 2.691 -6.415 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -1.343 2.269 -6.474 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -0.899 3.929 -6.816 1.00 0.00 H new ATOM 913 N VAL A 58 3.662 2.966 -9.095 1.00 0.00 N ATOM 914 CA VAL A 58 5.101 3.069 -8.900 1.00 0.00 C ATOM 915 C VAL A 58 5.752 3.663 -10.136 1.00 0.00 C ATOM 916 O VAL A 58 6.601 4.549 -10.045 1.00 0.00 O ATOM 917 CB VAL A 58 5.733 1.694 -8.600 1.00 0.00 C ATOM 918 CG1 VAL A 58 7.216 1.832 -8.301 1.00 0.00 C ATOM 919 CG2 VAL A 58 5.022 1.020 -7.441 1.00 0.00 C ATOM 0 H VAL A 58 3.385 2.573 -9.995 1.00 0.00 H new ATOM 0 HA VAL A 58 5.272 3.719 -8.042 1.00 0.00 H new ATOM 0 HB VAL A 58 5.619 1.071 -9.487 1.00 0.00 H new ATOM 0 HG11 VAL A 58 7.638 0.849 -8.093 1.00 0.00 H new ATOM 0 HG12 VAL A 58 7.722 2.269 -9.162 1.00 0.00 H new ATOM 0 HG13 VAL A 58 7.354 2.477 -7.433 1.00 0.00 H new ATOM 0 HG21 VAL A 58 5.483 0.052 -7.245 1.00 0.00 H new ATOM 0 HG22 VAL A 58 5.101 1.646 -6.552 1.00 0.00 H new ATOM 0 HG23 VAL A 58 3.971 0.878 -7.692 1.00 0.00 H new ATOM 929 N GLY A 59 5.326 3.177 -11.297 1.00 0.00 N ATOM 930 CA GLY A 59 5.847 3.669 -12.556 1.00 0.00 C ATOM 931 C GLY A 59 7.295 3.308 -12.805 1.00 0.00 C ATOM 932 O GLY A 59 7.678 2.979 -13.927 1.00 0.00 O ATOM 0 H GLY A 59 4.622 2.444 -11.387 1.00 0.00 H new ATOM 0 HA2 GLY A 59 5.239 3.272 -13.369 1.00 0.00 H new ATOM 0 HA3 GLY A 59 5.744 4.754 -12.581 1.00 0.00 H new ATOM 936 N ILE A 60 8.097 3.376 -11.763 1.00 0.00 N ATOM 937 CA ILE A 60 9.512 3.063 -11.863 1.00 0.00 C ATOM 938 C ILE A 60 9.732 1.558 -11.903 1.00 0.00 C ATOM 939 O ILE A 60 8.779 0.779 -11.934 1.00 0.00 O ATOM 940 CB ILE A 60 10.342 3.651 -10.695 1.00 0.00 C ATOM 941 CG1 ILE A 60 9.494 3.946 -9.458 1.00 0.00 C ATOM 942 CG2 ILE A 60 11.078 4.905 -11.142 1.00 0.00 C ATOM 943 CD1 ILE A 60 10.259 3.764 -8.163 1.00 0.00 C ATOM 0 H ILE A 60 7.792 3.647 -10.828 1.00 0.00 H new ATOM 0 HA ILE A 60 9.854 3.522 -12.791 1.00 0.00 H new ATOM 0 HB ILE A 60 11.067 2.889 -10.410 1.00 0.00 H new ATOM 0 HG12 ILE A 60 9.122 4.969 -9.514 1.00 0.00 H new ATOM 0 HG13 ILE A 60 8.623 3.290 -9.455 1.00 0.00 H new ATOM 0 HG21 ILE A 60 11.656 5.304 -10.308 1.00 0.00 H new ATOM 0 HG22 ILE A 60 11.750 4.659 -11.964 1.00 0.00 H new ATOM 0 HG23 ILE A 60 10.356 5.652 -11.474 1.00 0.00 H new ATOM 0 HD11 ILE A 60 9.605 3.988 -7.320 1.00 0.00 H new ATOM 0 HD12 ILE A 60 10.608 2.734 -8.088 1.00 0.00 H new ATOM 0 HD13 ILE A 60 11.115 4.439 -8.148 1.00 0.00 H new ATOM 955 N THR A 61 10.999 1.160 -11.917 1.00 0.00 N ATOM 956 CA THR A 61 11.369 -0.234 -11.963 1.00 0.00 C ATOM 957 C THR A 61 12.029 -0.654 -10.654 1.00 0.00 C ATOM 958 O THR A 61 13.245 -0.536 -10.502 1.00 0.00 O ATOM 959 CB THR A 61 12.341 -0.424 -13.109 1.00 0.00 C ATOM 960 OG1 THR A 61 13.154 0.727 -13.267 1.00 0.00 O ATOM 961 CG2 THR A 61 11.659 -0.685 -14.431 1.00 0.00 C ATOM 0 H THR A 61 11.792 1.801 -11.897 1.00 0.00 H new ATOM 0 HA THR A 61 10.480 -0.848 -12.108 1.00 0.00 H new ATOM 0 HB THR A 61 12.936 -1.299 -12.846 1.00 0.00 H new ATOM 0 HG1 THR A 61 14.045 0.551 -12.899 1.00 0.00 H new ATOM 0 HG21 THR A 61 12.411 -0.812 -15.210 1.00 0.00 H new ATOM 0 HG22 THR A 61 11.057 -1.590 -14.357 1.00 0.00 H new ATOM 0 HG23 THR A 61 11.016 0.159 -14.682 1.00 0.00 H new ATOM 969 N PRO A 62 11.237 -1.105 -9.671 1.00 0.00 N ATOM 970 CA PRO A 62 11.731 -1.488 -8.367 1.00 0.00 C ATOM 971 C PRO A 62 11.686 -2.983 -8.097 1.00 0.00 C ATOM 972 O PRO A 62 10.717 -3.651 -8.456 1.00 0.00 O ATOM 973 CB PRO A 62 10.681 -0.804 -7.507 1.00 0.00 C ATOM 974 CG PRO A 62 9.401 -1.080 -8.235 1.00 0.00 C ATOM 975 CD PRO A 62 9.771 -1.226 -9.698 1.00 0.00 C ATOM 0 HA PRO A 62 12.777 -1.223 -8.211 1.00 0.00 H new ATOM 0 HB2 PRO A 62 10.663 -1.210 -6.496 1.00 0.00 H new ATOM 0 HB3 PRO A 62 10.870 0.266 -7.418 1.00 0.00 H new ATOM 0 HG2 PRO A 62 8.928 -1.988 -7.860 1.00 0.00 H new ATOM 0 HG3 PRO A 62 8.689 -0.267 -8.093 1.00 0.00 H new ATOM 0 HD2 PRO A 62 9.451 -2.186 -10.103 1.00 0.00 H new ATOM 0 HD3 PRO A 62 9.311 -0.451 -10.312 1.00 0.00 H new ATOM 983 N GLN A 63 12.691 -3.499 -7.391 1.00 0.00 N ATOM 984 CA GLN A 63 12.665 -4.900 -7.014 1.00 0.00 C ATOM 985 C GLN A 63 11.652 -4.997 -5.894 1.00 0.00 C ATOM 986 O GLN A 63 11.989 -4.966 -4.711 1.00 0.00 O ATOM 987 CB GLN A 63 14.042 -5.383 -6.557 1.00 0.00 C ATOM 988 CG GLN A 63 15.175 -4.896 -7.441 1.00 0.00 C ATOM 989 CD GLN A 63 16.542 -5.220 -6.871 1.00 0.00 C ATOM 990 OE1 GLN A 63 16.868 -4.833 -5.749 1.00 0.00 O ATOM 991 NE2 GLN A 63 17.350 -5.936 -7.644 1.00 0.00 N ATOM 0 H GLN A 63 13.511 -2.979 -7.078 1.00 0.00 H new ATOM 0 HA GLN A 63 12.395 -5.534 -7.858 1.00 0.00 H new ATOM 0 HB2 GLN A 63 14.217 -5.045 -5.536 1.00 0.00 H new ATOM 0 HB3 GLN A 63 14.049 -6.473 -6.538 1.00 0.00 H new ATOM 0 HG2 GLN A 63 15.081 -5.349 -8.428 1.00 0.00 H new ATOM 0 HG3 GLN A 63 15.088 -3.818 -7.575 1.00 0.00 H new ATOM 0 HE21 GLN A 63 17.039 -6.236 -8.568 1.00 0.00 H new ATOM 0 HE22 GLN A 63 18.282 -6.186 -7.314 1.00 0.00 H new ATOM 1000 N HIS A 64 10.397 -5.024 -6.303 1.00 0.00 N ATOM 1001 CA HIS A 64 9.276 -5.022 -5.383 1.00 0.00 C ATOM 1002 C HIS A 64 8.404 -6.253 -5.568 1.00 0.00 C ATOM 1003 O HIS A 64 8.075 -6.634 -6.691 1.00 0.00 O ATOM 1004 CB HIS A 64 8.491 -3.729 -5.647 1.00 0.00 C ATOM 1005 CG HIS A 64 7.082 -3.659 -5.110 1.00 0.00 C ATOM 1006 ND1 HIS A 64 6.197 -4.724 -5.094 1.00 0.00 N ATOM 1007 CD2 HIS A 64 6.399 -2.610 -4.592 1.00 0.00 C ATOM 1008 CE1 HIS A 64 5.043 -4.329 -4.590 1.00 0.00 C ATOM 1009 NE2 HIS A 64 5.139 -3.053 -4.278 1.00 0.00 N ATOM 0 H HIS A 64 10.126 -5.048 -7.286 1.00 0.00 H new ATOM 0 HA HIS A 64 9.623 -5.056 -4.350 1.00 0.00 H new ATOM 0 HB2 HIS A 64 9.056 -2.898 -5.225 1.00 0.00 H new ATOM 0 HB3 HIS A 64 8.451 -3.572 -6.725 1.00 0.00 H new ATOM 0 HD2 HIS A 64 6.777 -1.608 -4.452 1.00 0.00 H new ATOM 0 HE1 HIS A 64 4.168 -4.948 -4.456 1.00 0.00 H new ATOM 0 HE2 HIS A 64 4.396 -2.486 -3.869 1.00 0.00 H new ATOM 1018 N PHE A 65 8.036 -6.872 -4.450 1.00 0.00 N ATOM 1019 CA PHE A 65 7.208 -8.065 -4.469 1.00 0.00 C ATOM 1020 C PHE A 65 6.972 -8.566 -3.037 1.00 0.00 C ATOM 1021 O PHE A 65 6.778 -7.770 -2.124 1.00 0.00 O ATOM 1022 CB PHE A 65 7.906 -9.134 -5.310 1.00 0.00 C ATOM 1023 CG PHE A 65 6.975 -10.058 -6.053 1.00 0.00 C ATOM 1024 CD1 PHE A 65 5.625 -10.123 -5.736 1.00 0.00 C ATOM 1025 CD2 PHE A 65 7.456 -10.858 -7.076 1.00 0.00 C ATOM 1026 CE1 PHE A 65 4.778 -10.969 -6.425 1.00 0.00 C ATOM 1027 CE2 PHE A 65 6.613 -11.705 -7.768 1.00 0.00 C ATOM 1028 CZ PHE A 65 5.272 -11.761 -7.443 1.00 0.00 C ATOM 0 H PHE A 65 8.302 -6.561 -3.516 1.00 0.00 H new ATOM 0 HA PHE A 65 6.237 -7.838 -4.909 1.00 0.00 H new ATOM 0 HB2 PHE A 65 8.558 -8.641 -6.031 1.00 0.00 H new ATOM 0 HB3 PHE A 65 8.544 -9.730 -4.658 1.00 0.00 H new ATOM 0 HD1 PHE A 65 5.233 -9.505 -4.942 1.00 0.00 H new ATOM 0 HD2 PHE A 65 8.504 -10.819 -7.336 1.00 0.00 H new ATOM 0 HE1 PHE A 65 3.730 -11.011 -6.168 1.00 0.00 H new ATOM 0 HE2 PHE A 65 7.002 -12.323 -8.563 1.00 0.00 H new ATOM 0 HZ PHE A 65 4.611 -12.422 -7.984 1.00 0.00 H new ATOM 1038 N SER A 66 7.008 -9.884 -2.854 1.00 0.00 N ATOM 1039 CA SER A 66 6.828 -10.511 -1.547 1.00 0.00 C ATOM 1040 C SER A 66 5.512 -10.115 -0.892 1.00 0.00 C ATOM 1041 O SER A 66 4.945 -9.065 -1.186 1.00 0.00 O ATOM 1042 CB SER A 66 7.997 -10.151 -0.628 1.00 0.00 C ATOM 1043 OG SER A 66 8.467 -11.291 0.070 1.00 0.00 O ATOM 0 H SER A 66 7.163 -10.550 -3.611 1.00 0.00 H new ATOM 0 HA SER A 66 6.801 -11.589 -1.706 1.00 0.00 H new ATOM 0 HB2 SER A 66 8.808 -9.722 -1.217 1.00 0.00 H new ATOM 0 HB3 SER A 66 7.682 -9.389 0.085 1.00 0.00 H new ATOM 0 HG SER A 66 9.215 -11.035 0.649 1.00 0.00 H new ATOM 1049 N LEU A 67 5.038 -10.970 0.010 1.00 0.00 N ATOM 1050 CA LEU A 67 3.793 -10.722 0.725 1.00 0.00 C ATOM 1051 C LEU A 67 4.042 -10.660 2.229 1.00 0.00 C ATOM 1052 O LEU A 67 4.331 -11.675 2.862 1.00 0.00 O ATOM 1053 CB LEU A 67 2.771 -11.815 0.404 1.00 0.00 C ATOM 1054 CG LEU A 67 1.458 -11.724 1.184 1.00 0.00 C ATOM 1055 CD1 LEU A 67 0.283 -12.118 0.302 1.00 0.00 C ATOM 1056 CD2 LEU A 67 1.516 -12.602 2.426 1.00 0.00 C ATOM 0 H LEU A 67 5.500 -11.843 0.263 1.00 0.00 H new ATOM 0 HA LEU A 67 3.394 -9.761 0.400 1.00 0.00 H new ATOM 0 HB2 LEU A 67 2.546 -11.779 -0.662 1.00 0.00 H new ATOM 0 HB3 LEU A 67 3.226 -12.786 0.601 1.00 0.00 H new ATOM 0 HG LEU A 67 1.315 -10.691 1.500 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -0.642 -12.047 0.875 1.00 0.00 H new ATOM 0 HD12 LEU A 67 0.231 -11.448 -0.556 1.00 0.00 H new ATOM 0 HD13 LEU A 67 0.417 -13.142 -0.046 1.00 0.00 H new ATOM 0 HD21 LEU A 67 0.574 -12.526 2.970 1.00 0.00 H new ATOM 0 HD22 LEU A 67 1.682 -13.638 2.132 1.00 0.00 H new ATOM 0 HD23 LEU A 67 2.333 -12.271 3.067 1.00 0.00 H new ATOM 1068 N PHE A 68 3.929 -9.462 2.795 1.00 0.00 N ATOM 1069 CA PHE A 68 4.142 -9.270 4.225 1.00 0.00 C ATOM 1070 C PHE A 68 2.928 -9.759 5.014 1.00 0.00 C ATOM 1071 O PHE A 68 3.065 -10.431 6.036 1.00 0.00 O ATOM 1072 CB PHE A 68 4.434 -7.787 4.519 1.00 0.00 C ATOM 1073 CG PHE A 68 3.674 -7.210 5.684 1.00 0.00 C ATOM 1074 CD1 PHE A 68 2.327 -6.905 5.569 1.00 0.00 C ATOM 1075 CD2 PHE A 68 4.309 -6.968 6.892 1.00 0.00 C ATOM 1076 CE1 PHE A 68 1.627 -6.372 6.633 1.00 0.00 C ATOM 1077 CE2 PHE A 68 3.615 -6.435 7.961 1.00 0.00 C ATOM 1078 CZ PHE A 68 2.272 -6.135 7.832 1.00 0.00 C ATOM 0 H PHE A 68 3.691 -8.611 2.286 1.00 0.00 H new ATOM 0 HA PHE A 68 5.005 -9.858 4.539 1.00 0.00 H new ATOM 0 HB2 PHE A 68 5.501 -7.672 4.708 1.00 0.00 H new ATOM 0 HB3 PHE A 68 4.203 -7.203 3.628 1.00 0.00 H new ATOM 0 HD1 PHE A 68 1.818 -7.087 4.634 1.00 0.00 H new ATOM 0 HD2 PHE A 68 5.359 -7.199 6.999 1.00 0.00 H new ATOM 0 HE1 PHE A 68 0.577 -6.141 6.528 1.00 0.00 H new ATOM 0 HE2 PHE A 68 4.122 -6.253 8.897 1.00 0.00 H new ATOM 0 HZ PHE A 68 1.728 -5.717 8.666 1.00 0.00 H new ATOM 1088 N GLU A 69 1.743 -9.414 4.525 1.00 0.00 N ATOM 1089 CA GLU A 69 0.498 -9.808 5.170 1.00 0.00 C ATOM 1090 C GLU A 69 -0.690 -9.462 4.282 1.00 0.00 C ATOM 1091 O GLU A 69 -0.569 -8.670 3.349 1.00 0.00 O ATOM 1092 CB GLU A 69 0.358 -9.118 6.527 1.00 0.00 C ATOM 1093 CG GLU A 69 -0.302 -9.986 7.586 1.00 0.00 C ATOM 1094 CD GLU A 69 -1.101 -9.176 8.587 1.00 0.00 C ATOM 1095 OE1 GLU A 69 -0.689 -8.038 8.896 1.00 0.00 O ATOM 1096 OE2 GLU A 69 -2.140 -9.680 9.064 1.00 0.00 O ATOM 0 H GLU A 69 1.619 -8.859 3.678 1.00 0.00 H new ATOM 0 HA GLU A 69 0.517 -10.886 5.327 1.00 0.00 H new ATOM 0 HB2 GLU A 69 1.346 -8.820 6.877 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -0.225 -8.205 6.403 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -0.959 -10.708 7.101 1.00 0.00 H new ATOM 0 HG3 GLU A 69 0.464 -10.555 8.113 1.00 0.00 H new ATOM 1103 N LYS A 70 -1.839 -10.056 4.570 1.00 0.00 N ATOM 1104 CA LYS A 70 -3.038 -9.799 3.785 1.00 0.00 C ATOM 1105 C LYS A 70 -4.278 -9.776 4.673 1.00 0.00 C ATOM 1106 O LYS A 70 -4.483 -10.671 5.493 1.00 0.00 O ATOM 1107 CB LYS A 70 -3.193 -10.862 2.695 1.00 0.00 C ATOM 1108 CG LYS A 70 -3.426 -10.286 1.308 1.00 0.00 C ATOM 1109 CD LYS A 70 -3.467 -11.379 0.252 1.00 0.00 C ATOM 1110 CE LYS A 70 -4.884 -11.875 0.019 1.00 0.00 C ATOM 1111 NZ LYS A 70 -5.243 -12.992 0.938 1.00 0.00 N ATOM 0 H LYS A 70 -1.967 -10.716 5.337 1.00 0.00 H new ATOM 0 HA LYS A 70 -2.934 -8.820 3.317 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -2.297 -11.483 2.675 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -4.027 -11.515 2.952 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -4.364 -9.731 1.296 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -2.633 -9.577 1.069 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -3.055 -10.999 -0.683 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -2.836 -12.211 0.563 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -5.584 -11.051 0.159 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -4.986 -12.208 -1.014 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -5.449 -13.846 0.382 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -4.448 -13.181 1.581 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -6.082 -12.729 1.493 1.00 0.00 H new ATOM 1125 N LEU A 71 -5.105 -8.750 4.499 1.00 0.00 N ATOM 1126 CA LEU A 71 -6.326 -8.612 5.280 1.00 0.00 C ATOM 1127 C LEU A 71 -7.550 -8.719 4.377 1.00 0.00 C ATOM 1128 O LEU A 71 -7.717 -7.934 3.444 1.00 0.00 O ATOM 1129 CB LEU A 71 -6.328 -7.274 6.020 1.00 0.00 C ATOM 1130 CG LEU A 71 -7.638 -6.916 6.721 1.00 0.00 C ATOM 1131 CD1 LEU A 71 -7.630 -7.417 8.156 1.00 0.00 C ATOM 1132 CD2 LEU A 71 -7.870 -5.413 6.681 1.00 0.00 C ATOM 0 H LEU A 71 -4.950 -8.002 3.823 1.00 0.00 H new ATOM 0 HA LEU A 71 -6.365 -9.419 6.012 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -5.530 -7.287 6.762 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -6.088 -6.484 5.308 1.00 0.00 H new ATOM 0 HG LEU A 71 -8.456 -7.405 6.192 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -8.571 -7.153 8.639 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -7.511 -8.500 8.162 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -6.803 -6.958 8.697 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -8.807 -5.176 7.185 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -7.048 -4.904 7.185 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -7.921 -5.080 5.644 1.00 0.00 H new ATOM 1144 N GLU A 72 -8.400 -9.700 4.656 1.00 0.00 N ATOM 1145 CA GLU A 72 -9.605 -9.915 3.867 1.00 0.00 C ATOM 1146 C GLU A 72 -10.856 -9.759 4.729 1.00 0.00 C ATOM 1147 O GLU A 72 -11.142 -10.596 5.585 1.00 0.00 O ATOM 1148 CB GLU A 72 -9.564 -11.308 3.228 1.00 0.00 C ATOM 1149 CG GLU A 72 -10.921 -11.817 2.770 1.00 0.00 C ATOM 1150 CD GLU A 72 -10.814 -12.853 1.667 1.00 0.00 C ATOM 1151 OE1 GLU A 72 -10.064 -13.835 1.846 1.00 0.00 O ATOM 1152 OE2 GLU A 72 -11.481 -12.681 0.626 1.00 0.00 O ATOM 0 H GLU A 72 -8.276 -10.360 5.424 1.00 0.00 H new ATOM 0 HA GLU A 72 -9.645 -9.162 3.079 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -8.888 -11.285 2.373 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -9.146 -12.014 3.946 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -11.448 -12.250 3.620 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -11.520 -10.977 2.418 1.00 0.00 H new ATOM 1159 N TYR A 73 -11.599 -8.685 4.489 1.00 0.00 N ATOM 1160 CA TYR A 73 -12.824 -8.417 5.232 1.00 0.00 C ATOM 1161 C TYR A 73 -13.895 -7.849 4.307 1.00 0.00 C ATOM 1162 O TYR A 73 -13.583 -7.204 3.305 1.00 0.00 O ATOM 1163 CB TYR A 73 -12.551 -7.446 6.382 1.00 0.00 C ATOM 1164 CG TYR A 73 -11.982 -6.117 5.939 1.00 0.00 C ATOM 1165 CD1 TYR A 73 -10.743 -6.043 5.315 1.00 0.00 C ATOM 1166 CD2 TYR A 73 -12.683 -4.936 6.146 1.00 0.00 C ATOM 1167 CE1 TYR A 73 -10.219 -4.830 4.911 1.00 0.00 C ATOM 1168 CE2 TYR A 73 -12.166 -3.719 5.745 1.00 0.00 C ATOM 1169 CZ TYR A 73 -10.934 -3.671 5.128 1.00 0.00 C ATOM 1170 OH TYR A 73 -10.416 -2.460 4.728 1.00 0.00 O ATOM 0 H TYR A 73 -11.373 -7.984 3.783 1.00 0.00 H new ATOM 0 HA TYR A 73 -13.186 -9.357 5.648 1.00 0.00 H new ATOM 0 HB2 TYR A 73 -13.480 -7.270 6.924 1.00 0.00 H new ATOM 0 HB3 TYR A 73 -11.857 -7.912 7.081 1.00 0.00 H new ATOM 0 HD1 TYR A 73 -10.180 -6.948 5.143 1.00 0.00 H new ATOM 0 HD2 TYR A 73 -13.649 -4.969 6.629 1.00 0.00 H new ATOM 0 HE1 TYR A 73 -9.254 -4.790 4.428 1.00 0.00 H new ATOM 0 HE2 TYR A 73 -12.724 -2.810 5.914 1.00 0.00 H new ATOM 0 HH TYR A 73 -11.046 -1.744 4.954 1.00 0.00 H new ATOM 1180 N GLU A 74 -15.158 -8.091 4.642 1.00 0.00 N ATOM 1181 CA GLU A 74 -16.265 -7.599 3.829 1.00 0.00 C ATOM 1182 C GLU A 74 -17.187 -6.694 4.637 1.00 0.00 C ATOM 1183 O GLU A 74 -17.757 -7.104 5.646 1.00 0.00 O ATOM 1184 CB GLU A 74 -17.068 -8.762 3.237 1.00 0.00 C ATOM 1185 CG GLU A 74 -17.334 -9.887 4.223 1.00 0.00 C ATOM 1186 CD GLU A 74 -17.562 -11.220 3.537 1.00 0.00 C ATOM 1187 OE1 GLU A 74 -16.566 -11.906 3.228 1.00 0.00 O ATOM 1188 OE2 GLU A 74 -18.738 -11.577 3.310 1.00 0.00 O ATOM 0 H GLU A 74 -15.440 -8.622 5.466 1.00 0.00 H new ATOM 0 HA GLU A 74 -15.835 -7.016 3.015 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -18.021 -8.383 2.867 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -16.530 -9.163 2.378 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -16.489 -9.974 4.906 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -18.207 -9.638 4.826 1.00 0.00 H new ATOM 1195 N PHE A 75 -17.332 -5.462 4.169 1.00 0.00 N ATOM 1196 CA PHE A 75 -18.186 -4.481 4.819 1.00 0.00 C ATOM 1197 C PHE A 75 -19.647 -4.722 4.447 1.00 0.00 C ATOM 1198 O PHE A 75 -19.935 -5.419 3.476 1.00 0.00 O ATOM 1199 CB PHE A 75 -17.765 -3.067 4.415 1.00 0.00 C ATOM 1200 CG PHE A 75 -17.094 -2.300 5.518 1.00 0.00 C ATOM 1201 CD1 PHE A 75 -15.962 -2.804 6.140 1.00 0.00 C ATOM 1202 CD2 PHE A 75 -17.593 -1.076 5.933 1.00 0.00 C ATOM 1203 CE1 PHE A 75 -15.341 -2.102 7.155 1.00 0.00 C ATOM 1204 CE2 PHE A 75 -16.976 -0.369 6.949 1.00 0.00 C ATOM 1205 CZ PHE A 75 -15.849 -0.883 7.559 1.00 0.00 C ATOM 0 H PHE A 75 -16.863 -5.117 3.332 1.00 0.00 H new ATOM 0 HA PHE A 75 -18.079 -4.585 5.899 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -17.088 -3.128 3.563 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -18.645 -2.516 4.084 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -15.561 -3.757 5.827 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -18.474 -0.669 5.458 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -14.460 -2.506 7.632 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -17.375 0.584 7.265 1.00 0.00 H new ATOM 0 HZ PHE A 75 -15.365 -0.332 8.352 1.00 0.00 H new ATOM 1215 N PRO A 76 -20.589 -4.148 5.217 1.00 0.00 N ATOM 1216 CA PRO A 76 -22.026 -4.297 4.966 1.00 0.00 C ATOM 1217 C PRO A 76 -22.392 -3.977 3.521 1.00 0.00 C ATOM 1218 O PRO A 76 -22.839 -2.873 3.210 1.00 0.00 O ATOM 1219 CB PRO A 76 -22.680 -3.290 5.924 1.00 0.00 C ATOM 1220 CG PRO A 76 -21.563 -2.447 6.448 1.00 0.00 C ATOM 1221 CD PRO A 76 -20.332 -3.302 6.381 1.00 0.00 C ATOM 0 HA PRO A 76 -22.359 -5.322 5.128 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -23.421 -2.681 5.406 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -23.199 -3.801 6.735 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -21.443 -1.543 5.851 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -21.762 -2.129 7.471 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -19.430 -2.703 6.255 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -20.199 -3.891 7.288 1.00 0.00 H new ATOM 1229 N ASP A 77 -22.186 -4.960 2.647 1.00 0.00 N ATOM 1230 CA ASP A 77 -22.475 -4.829 1.216 1.00 0.00 C ATOM 1231 C ASP A 77 -21.271 -4.275 0.454 1.00 0.00 C ATOM 1232 O ASP A 77 -21.397 -3.859 -0.698 1.00 0.00 O ATOM 1233 CB ASP A 77 -23.700 -3.939 0.976 1.00 0.00 C ATOM 1234 CG ASP A 77 -24.456 -4.322 -0.282 1.00 0.00 C ATOM 1235 OD1 ASP A 77 -24.990 -5.450 -0.334 1.00 0.00 O ATOM 1236 OD2 ASP A 77 -24.513 -3.494 -1.215 1.00 0.00 O ATOM 0 H ASP A 77 -21.813 -5.873 2.909 1.00 0.00 H new ATOM 0 HA ASP A 77 -22.692 -5.829 0.840 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -24.369 -4.008 1.834 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -23.381 -2.899 0.903 1.00 0.00 H new ATOM 1241 N ARG A 78 -20.106 -4.279 1.097 1.00 0.00 N ATOM 1242 CA ARG A 78 -18.885 -3.782 0.471 1.00 0.00 C ATOM 1243 C ARG A 78 -17.707 -4.704 0.773 1.00 0.00 C ATOM 1244 O ARG A 78 -17.046 -4.563 1.800 1.00 0.00 O ATOM 1245 CB ARG A 78 -18.576 -2.365 0.962 1.00 0.00 C ATOM 1246 CG ARG A 78 -17.322 -1.765 0.343 1.00 0.00 C ATOM 1247 CD ARG A 78 -16.474 -1.047 1.383 1.00 0.00 C ATOM 1248 NE ARG A 78 -15.532 -0.111 0.772 1.00 0.00 N ATOM 1249 CZ ARG A 78 -14.655 0.615 1.464 1.00 0.00 C ATOM 1250 NH1 ARG A 78 -14.595 0.513 2.786 1.00 0.00 N ATOM 1251 NH2 ARG A 78 -13.833 1.444 0.833 1.00 0.00 N ATOM 0 H ARG A 78 -19.982 -4.621 2.050 1.00 0.00 H new ATOM 0 HA ARG A 78 -19.041 -3.760 -0.608 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -19.425 -1.719 0.740 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -18.464 -2.382 2.046 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -16.734 -2.554 -0.126 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -17.603 -1.066 -0.445 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -17.125 -0.508 2.072 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -15.925 -1.781 1.972 1.00 0.00 H new ATOM 0 HE ARG A 78 -15.547 -0.008 -0.243 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -15.222 -0.124 3.277 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -13.922 1.071 3.311 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -13.872 1.526 -0.183 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -13.162 1.999 1.364 1.00 0.00 H new ATOM 1265 N HIS A 79 -17.443 -5.646 -0.129 1.00 0.00 N ATOM 1266 CA HIS A 79 -16.340 -6.583 0.048 1.00 0.00 C ATOM 1267 C HIS A 79 -15.010 -5.901 -0.244 1.00 0.00 C ATOM 1268 O HIS A 79 -14.607 -5.770 -1.400 1.00 0.00 O ATOM 1269 CB HIS A 79 -16.520 -7.799 -0.864 1.00 0.00 C ATOM 1270 CG HIS A 79 -17.128 -8.979 -0.173 1.00 0.00 C ATOM 1271 ND1 HIS A 79 -18.361 -8.939 0.442 1.00 0.00 N ATOM 1272 CD2 HIS A 79 -16.667 -10.241 -0.002 1.00 0.00 C ATOM 1273 CE1 HIS A 79 -18.632 -10.123 0.962 1.00 0.00 C ATOM 1274 NE2 HIS A 79 -17.621 -10.931 0.706 1.00 0.00 N ATOM 0 H HIS A 79 -17.977 -5.780 -0.988 1.00 0.00 H new ATOM 0 HA HIS A 79 -16.339 -6.921 1.084 1.00 0.00 H new ATOM 0 HB2 HIS A 79 -17.149 -7.519 -1.709 1.00 0.00 H new ATOM 0 HB3 HIS A 79 -15.550 -8.086 -1.270 1.00 0.00 H new ATOM 0 HD2 HIS A 79 -15.725 -10.632 -0.356 1.00 0.00 H new ATOM 0 HE1 HIS A 79 -19.529 -10.385 1.504 1.00 0.00 H new ATOM 0 HE2 HIS A 79 -17.558 -11.909 0.988 1.00 0.00 H new ATOM 1283 N ILE A 80 -14.334 -5.455 0.809 1.00 0.00 N ATOM 1284 CA ILE A 80 -13.059 -4.777 0.665 1.00 0.00 C ATOM 1285 C ILE A 80 -11.892 -5.714 0.969 1.00 0.00 C ATOM 1286 O ILE A 80 -11.701 -6.137 2.110 1.00 0.00 O ATOM 1287 CB ILE A 80 -12.983 -3.536 1.585 1.00 0.00 C ATOM 1288 CG1 ILE A 80 -11.551 -3.013 1.667 1.00 0.00 C ATOM 1289 CG2 ILE A 80 -13.508 -3.865 2.975 1.00 0.00 C ATOM 1290 CD1 ILE A 80 -11.461 -1.510 1.812 1.00 0.00 C ATOM 0 H ILE A 80 -14.652 -5.553 1.773 1.00 0.00 H new ATOM 0 HA ILE A 80 -12.983 -4.453 -0.373 1.00 0.00 H new ATOM 0 HB ILE A 80 -13.611 -2.756 1.155 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -11.050 -3.482 2.514 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -11.011 -3.316 0.770 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -13.446 -2.979 3.607 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -14.547 -4.188 2.905 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -12.908 -4.664 3.411 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -10.414 -1.212 1.864 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -11.932 -1.033 0.953 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -11.972 -1.201 2.724 1.00 0.00 H new ATOM 1302 N THR A 81 -11.109 -6.023 -0.060 1.00 0.00 N ATOM 1303 CA THR A 81 -9.953 -6.898 0.091 1.00 0.00 C ATOM 1304 C THR A 81 -8.675 -6.072 0.197 1.00 0.00 C ATOM 1305 O THR A 81 -8.338 -5.316 -0.714 1.00 0.00 O ATOM 1306 CB THR A 81 -9.859 -7.866 -1.094 1.00 0.00 C ATOM 1307 OG1 THR A 81 -10.795 -7.523 -2.100 1.00 0.00 O ATOM 1308 CG2 THR A 81 -10.108 -9.307 -0.709 1.00 0.00 C ATOM 0 H THR A 81 -11.255 -5.679 -1.009 1.00 0.00 H new ATOM 0 HA THR A 81 -10.073 -7.477 1.007 1.00 0.00 H new ATOM 0 HB THR A 81 -8.836 -7.775 -1.460 1.00 0.00 H new ATOM 0 HG1 THR A 81 -11.408 -8.274 -2.246 1.00 0.00 H new ATOM 0 HG21 THR A 81 -10.027 -9.939 -1.593 1.00 0.00 H new ATOM 0 HG22 THR A 81 -9.369 -9.619 0.029 1.00 0.00 H new ATOM 0 HG23 THR A 81 -11.108 -9.403 -0.285 1.00 0.00 H new ATOM 1316 N LEU A 82 -7.971 -6.211 1.316 1.00 0.00 N ATOM 1317 CA LEU A 82 -6.738 -5.464 1.537 1.00 0.00 C ATOM 1318 C LEU A 82 -5.519 -6.381 1.499 1.00 0.00 C ATOM 1319 O LEU A 82 -5.356 -7.252 2.355 1.00 0.00 O ATOM 1320 CB LEU A 82 -6.804 -4.741 2.883 1.00 0.00 C ATOM 1321 CG LEU A 82 -5.645 -3.789 3.168 1.00 0.00 C ATOM 1322 CD1 LEU A 82 -5.872 -2.449 2.483 1.00 0.00 C ATOM 1323 CD2 LEU A 82 -5.474 -3.603 4.668 1.00 0.00 C ATOM 0 H LEU A 82 -8.232 -6.832 2.082 1.00 0.00 H new ATOM 0 HA LEU A 82 -6.636 -4.734 0.734 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -7.736 -4.177 2.929 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -6.843 -5.487 3.676 1.00 0.00 H new ATOM 0 HG LEU A 82 -4.730 -4.225 2.766 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -5.035 -1.784 2.698 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -5.949 -2.599 1.406 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -6.795 -2.003 2.854 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -4.644 -2.922 4.858 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -6.389 -3.187 5.090 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -5.266 -4.567 5.133 1.00 0.00 H new ATOM 1335 N TRP A 83 -4.665 -6.181 0.498 1.00 0.00 N ATOM 1336 CA TRP A 83 -3.458 -6.990 0.343 1.00 0.00 C ATOM 1337 C TRP A 83 -2.207 -6.177 0.652 1.00 0.00 C ATOM 1338 O TRP A 83 -1.957 -5.145 0.031 1.00 0.00 O ATOM 1339 CB TRP A 83 -3.358 -7.547 -1.079 1.00 0.00 C ATOM 1340 CG TRP A 83 -4.468 -8.483 -1.440 1.00 0.00 C ATOM 1341 CD1 TRP A 83 -5.759 -8.420 -1.012 1.00 0.00 C ATOM 1342 CD2 TRP A 83 -4.386 -9.621 -2.305 1.00 0.00 C ATOM 1343 NE1 TRP A 83 -6.488 -9.446 -1.556 1.00 0.00 N ATOM 1344 CE2 TRP A 83 -5.668 -10.199 -2.354 1.00 0.00 C ATOM 1345 CE3 TRP A 83 -3.353 -10.207 -3.043 1.00 0.00 C ATOM 1346 CZ2 TRP A 83 -5.945 -11.335 -3.112 1.00 0.00 C ATOM 1347 CZ3 TRP A 83 -3.629 -11.334 -3.795 1.00 0.00 C ATOM 1348 CH2 TRP A 83 -4.916 -11.887 -3.825 1.00 0.00 C ATOM 0 H TRP A 83 -4.786 -5.465 -0.219 1.00 0.00 H new ATOM 0 HA TRP A 83 -3.527 -7.816 1.051 1.00 0.00 H new ATOM 0 HB2 TRP A 83 -3.351 -6.717 -1.785 1.00 0.00 H new ATOM 0 HB3 TRP A 83 -2.406 -8.067 -1.190 1.00 0.00 H new ATOM 0 HD1 TRP A 83 -6.152 -7.670 -0.341 1.00 0.00 H new ATOM 0 HE1 TRP A 83 -7.480 -9.620 -1.393 1.00 0.00 H new ATOM 0 HE3 TRP A 83 -2.358 -9.787 -3.026 1.00 0.00 H new ATOM 0 HZ2 TRP A 83 -6.936 -11.764 -3.136 1.00 0.00 H new ATOM 0 HZ3 TRP A 83 -2.839 -11.796 -4.369 1.00 0.00 H new ATOM 0 HH2 TRP A 83 -5.100 -12.767 -4.423 1.00 0.00 H new ATOM 1359 N PHE A 84 -1.418 -6.655 1.607 1.00 0.00 N ATOM 1360 CA PHE A 84 -0.180 -5.974 1.985 1.00 0.00 C ATOM 1361 C PHE A 84 1.039 -6.785 1.538 1.00 0.00 C ATOM 1362 O PHE A 84 1.317 -7.857 2.075 1.00 0.00 O ATOM 1363 CB PHE A 84 -0.136 -5.724 3.501 1.00 0.00 C ATOM 1364 CG PHE A 84 -0.865 -4.476 3.944 1.00 0.00 C ATOM 1365 CD1 PHE A 84 -1.788 -3.858 3.113 1.00 0.00 C ATOM 1366 CD2 PHE A 84 -0.629 -3.923 5.198 1.00 0.00 C ATOM 1367 CE1 PHE A 84 -2.457 -2.719 3.520 1.00 0.00 C ATOM 1368 CE2 PHE A 84 -1.298 -2.786 5.607 1.00 0.00 C ATOM 1369 CZ PHE A 84 -2.212 -2.183 4.767 1.00 0.00 C ATOM 0 H PHE A 84 -1.610 -7.507 2.133 1.00 0.00 H new ATOM 0 HA PHE A 84 -0.155 -5.009 1.480 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -0.568 -6.584 4.013 1.00 0.00 H new ATOM 0 HB3 PHE A 84 0.905 -5.655 3.817 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -1.986 -4.272 2.135 1.00 0.00 H new ATOM 0 HD2 PHE A 84 0.086 -4.388 5.860 1.00 0.00 H new ATOM 0 HE1 PHE A 84 -3.172 -2.249 2.861 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -1.106 -2.369 6.584 1.00 0.00 H new ATOM 0 HZ PHE A 84 -2.734 -1.293 5.085 1.00 0.00 H new ATOM 1379 N TRP A 85 1.754 -6.272 0.538 1.00 0.00 N ATOM 1380 CA TRP A 85 2.935 -6.951 -0.002 1.00 0.00 C ATOM 1381 C TRP A 85 4.228 -6.363 0.565 1.00 0.00 C ATOM 1382 O TRP A 85 4.287 -5.178 0.891 1.00 0.00 O ATOM 1383 CB TRP A 85 2.931 -6.868 -1.530 1.00 0.00 C ATOM 1384 CG TRP A 85 1.765 -7.581 -2.146 1.00 0.00 C ATOM 1385 CD1 TRP A 85 0.456 -7.198 -2.099 1.00 0.00 C ATOM 1386 CD2 TRP A 85 1.799 -8.805 -2.891 1.00 0.00 C ATOM 1387 NE1 TRP A 85 -0.327 -8.107 -2.768 1.00 0.00 N ATOM 1388 CE2 TRP A 85 0.475 -9.101 -3.266 1.00 0.00 C ATOM 1389 CE3 TRP A 85 2.819 -9.678 -3.281 1.00 0.00 C ATOM 1390 CZ2 TRP A 85 0.145 -10.232 -4.008 1.00 0.00 C ATOM 1391 CZ3 TRP A 85 2.490 -10.800 -4.017 1.00 0.00 C ATOM 1392 CH2 TRP A 85 1.164 -11.069 -4.375 1.00 0.00 C ATOM 0 H TRP A 85 1.537 -5.385 0.083 1.00 0.00 H new ATOM 0 HA TRP A 85 2.892 -7.998 0.299 1.00 0.00 H new ATOM 0 HB2 TRP A 85 2.912 -5.821 -1.833 1.00 0.00 H new ATOM 0 HB3 TRP A 85 3.857 -7.295 -1.915 1.00 0.00 H new ATOM 0 HD1 TRP A 85 0.089 -6.309 -1.607 1.00 0.00 H new ATOM 0 HE1 TRP A 85 -1.340 -8.051 -2.876 1.00 0.00 H new ATOM 0 HE3 TRP A 85 3.846 -9.479 -3.012 1.00 0.00 H new ATOM 0 HZ2 TRP A 85 -0.878 -10.441 -4.284 1.00 0.00 H new ATOM 0 HZ3 TRP A 85 3.270 -11.482 -4.322 1.00 0.00 H new ATOM 0 HH2 TRP A 85 0.940 -11.954 -4.952 1.00 0.00 H new ATOM 1403 N LEU A 86 5.259 -7.203 0.696 1.00 0.00 N ATOM 1404 CA LEU A 86 6.538 -6.752 1.244 1.00 0.00 C ATOM 1405 C LEU A 86 7.548 -6.437 0.139 1.00 0.00 C ATOM 1406 O LEU A 86 8.162 -7.330 -0.442 1.00 0.00 O ATOM 1407 CB LEU A 86 7.104 -7.810 2.197 1.00 0.00 C ATOM 1408 CG LEU A 86 8.560 -7.598 2.621 1.00 0.00 C ATOM 1409 CD1 LEU A 86 8.723 -6.260 3.322 1.00 0.00 C ATOM 1410 CD2 LEU A 86 9.022 -8.734 3.520 1.00 0.00 C ATOM 0 H LEU A 86 5.233 -8.188 0.433 1.00 0.00 H new ATOM 0 HA LEU A 86 6.358 -5.830 1.796 1.00 0.00 H new ATOM 0 HB2 LEU A 86 6.483 -7.838 3.092 1.00 0.00 H new ATOM 0 HB3 LEU A 86 7.020 -8.787 1.720 1.00 0.00 H new ATOM 0 HG LEU A 86 9.183 -7.592 1.726 1.00 0.00 H new ATOM 0 HD11 LEU A 86 9.764 -6.128 3.616 1.00 0.00 H new ATOM 0 HD12 LEU A 86 8.432 -5.457 2.645 1.00 0.00 H new ATOM 0 HD13 LEU A 86 8.090 -6.234 4.209 1.00 0.00 H new ATOM 0 HD21 LEU A 86 10.059 -8.568 3.812 1.00 0.00 H new ATOM 0 HD22 LEU A 86 8.395 -8.771 4.411 1.00 0.00 H new ATOM 0 HD23 LEU A 86 8.944 -9.679 2.982 1.00 0.00 H new ATOM 1422 N VAL A 87 7.722 -5.147 -0.112 1.00 0.00 N ATOM 1423 CA VAL A 87 8.655 -4.645 -1.121 1.00 0.00 C ATOM 1424 C VAL A 87 10.065 -4.613 -0.588 1.00 0.00 C ATOM 1425 O VAL A 87 10.271 -4.398 0.606 1.00 0.00 O ATOM 1426 CB VAL A 87 8.292 -3.237 -1.557 1.00 0.00 C ATOM 1427 CG1 VAL A 87 9.076 -2.834 -2.793 1.00 0.00 C ATOM 1428 CG2 VAL A 87 6.794 -3.142 -1.786 1.00 0.00 C ATOM 0 H VAL A 87 7.217 -4.410 0.381 1.00 0.00 H new ATOM 0 HA VAL A 87 8.589 -5.325 -1.970 1.00 0.00 H new ATOM 0 HB VAL A 87 8.562 -2.537 -0.766 1.00 0.00 H new ATOM 0 HG11 VAL A 87 8.798 -1.821 -3.086 1.00 0.00 H new ATOM 0 HG12 VAL A 87 10.143 -2.869 -2.574 1.00 0.00 H new ATOM 0 HG13 VAL A 87 8.850 -3.522 -3.608 1.00 0.00 H new ATOM 0 HG21 VAL A 87 6.537 -2.130 -2.099 1.00 0.00 H new ATOM 0 HG22 VAL A 87 6.499 -3.848 -2.563 1.00 0.00 H new ATOM 0 HG23 VAL A 87 6.269 -3.380 -0.861 1.00 0.00 H new ATOM 1438 N GLU A 88 11.041 -4.855 -1.453 1.00 0.00 N ATOM 1439 CA GLU A 88 12.420 -4.865 -0.994 1.00 0.00 C ATOM 1440 C GLU A 88 13.286 -3.737 -1.573 1.00 0.00 C ATOM 1441 O GLU A 88 14.281 -3.357 -0.956 1.00 0.00 O ATOM 1442 CB GLU A 88 13.062 -6.222 -1.296 1.00 0.00 C ATOM 1443 CG GLU A 88 14.528 -6.306 -0.903 1.00 0.00 C ATOM 1444 CD GLU A 88 15.130 -7.670 -1.183 1.00 0.00 C ATOM 1445 OE1 GLU A 88 14.954 -8.175 -2.312 1.00 0.00 O ATOM 1446 OE2 GLU A 88 15.776 -8.231 -0.275 1.00 0.00 O ATOM 0 H GLU A 88 10.909 -5.042 -2.447 1.00 0.00 H new ATOM 0 HA GLU A 88 12.378 -4.690 0.081 1.00 0.00 H new ATOM 0 HB2 GLU A 88 12.509 -7.001 -0.770 1.00 0.00 H new ATOM 0 HB3 GLU A 88 12.968 -6.429 -2.362 1.00 0.00 H new ATOM 0 HG2 GLU A 88 15.090 -5.546 -1.446 1.00 0.00 H new ATOM 0 HG3 GLU A 88 14.629 -6.079 0.158 1.00 0.00 H new ATOM 1453 N ARG A 89 12.945 -3.209 -2.747 1.00 0.00 N ATOM 1454 CA ARG A 89 13.760 -2.150 -3.341 1.00 0.00 C ATOM 1455 C ARG A 89 12.999 -1.400 -4.429 1.00 0.00 C ATOM 1456 O ARG A 89 12.011 -1.900 -4.962 1.00 0.00 O ATOM 1457 CB ARG A 89 15.053 -2.763 -3.903 1.00 0.00 C ATOM 1458 CG ARG A 89 15.796 -1.889 -4.905 1.00 0.00 C ATOM 1459 CD ARG A 89 16.547 -0.762 -4.215 1.00 0.00 C ATOM 1460 NE ARG A 89 16.820 0.351 -5.121 1.00 0.00 N ATOM 1461 CZ ARG A 89 17.688 1.326 -4.857 1.00 0.00 C ATOM 1462 NH1 ARG A 89 18.367 1.329 -3.716 1.00 0.00 N ATOM 1463 NH2 ARG A 89 17.878 2.300 -5.736 1.00 0.00 N ATOM 0 H ARG A 89 12.131 -3.488 -3.295 1.00 0.00 H new ATOM 0 HA ARG A 89 14.008 -1.424 -2.567 1.00 0.00 H new ATOM 0 HB2 ARG A 89 15.722 -2.987 -3.072 1.00 0.00 H new ATOM 0 HB3 ARG A 89 14.810 -3.712 -4.381 1.00 0.00 H new ATOM 0 HG2 ARG A 89 16.497 -2.501 -5.472 1.00 0.00 H new ATOM 0 HG3 ARG A 89 15.087 -1.471 -5.620 1.00 0.00 H new ATOM 0 HD2 ARG A 89 15.963 -0.404 -3.367 1.00 0.00 H new ATOM 0 HD3 ARG A 89 17.487 -1.144 -3.817 1.00 0.00 H new ATOM 0 HE ARG A 89 16.316 0.383 -6.007 1.00 0.00 H new ATOM 0 HH11 ARG A 89 18.225 0.582 -3.036 1.00 0.00 H new ATOM 0 HH12 ARG A 89 19.030 2.078 -3.519 1.00 0.00 H new ATOM 0 HH21 ARG A 89 17.359 2.303 -6.614 1.00 0.00 H new ATOM 0 HH22 ARG A 89 18.543 3.047 -5.534 1.00 0.00 H new ATOM 1477 N TRP A 90 13.485 -0.207 -4.769 1.00 0.00 N ATOM 1478 CA TRP A 90 12.863 0.595 -5.812 1.00 0.00 C ATOM 1479 C TRP A 90 13.862 1.570 -6.433 1.00 0.00 C ATOM 1480 O TRP A 90 14.479 2.374 -5.734 1.00 0.00 O ATOM 1481 CB TRP A 90 11.624 1.321 -5.267 1.00 0.00 C ATOM 1482 CG TRP A 90 11.884 2.681 -4.694 1.00 0.00 C ATOM 1483 CD1 TRP A 90 12.227 3.810 -5.380 1.00 0.00 C ATOM 1484 CD2 TRP A 90 11.794 3.059 -3.318 1.00 0.00 C ATOM 1485 NE1 TRP A 90 12.362 4.865 -4.513 1.00 0.00 N ATOM 1486 CE2 TRP A 90 12.098 4.430 -3.241 1.00 0.00 C ATOM 1487 CE3 TRP A 90 11.486 2.369 -2.141 1.00 0.00 C ATOM 1488 CZ2 TRP A 90 12.099 5.125 -2.037 1.00 0.00 C ATOM 1489 CZ3 TRP A 90 11.489 3.061 -0.945 1.00 0.00 C ATOM 1490 CH2 TRP A 90 11.793 4.428 -0.901 1.00 0.00 C ATOM 0 H TRP A 90 14.304 0.221 -4.337 1.00 0.00 H new ATOM 0 HA TRP A 90 12.535 -0.074 -6.607 1.00 0.00 H new ATOM 0 HB2 TRP A 90 10.895 1.416 -6.072 1.00 0.00 H new ATOM 0 HB3 TRP A 90 11.168 0.700 -4.496 1.00 0.00 H new ATOM 0 HD1 TRP A 90 12.371 3.865 -6.449 1.00 0.00 H new ATOM 0 HE1 TRP A 90 12.617 5.818 -4.773 1.00 0.00 H new ATOM 0 HE3 TRP A 90 11.250 1.315 -2.166 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 12.333 6.179 -2.000 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 11.253 2.540 -0.029 1.00 0.00 H new ATOM 0 HH2 TRP A 90 11.786 4.941 0.049 1.00 0.00 H new ATOM 1501 N GLU A 91 14.025 1.482 -7.755 1.00 0.00 N ATOM 1502 CA GLU A 91 14.956 2.349 -8.469 1.00 0.00 C ATOM 1503 C GLU A 91 14.427 3.779 -8.541 1.00 0.00 C ATOM 1504 O GLU A 91 13.224 4.000 -8.676 1.00 0.00 O ATOM 1505 CB GLU A 91 15.203 1.814 -9.880 1.00 0.00 C ATOM 1506 CG GLU A 91 16.368 2.486 -10.591 1.00 0.00 C ATOM 1507 CD GLU A 91 16.878 1.676 -11.766 1.00 0.00 C ATOM 1508 OE1 GLU A 91 16.049 1.056 -12.464 1.00 0.00 O ATOM 1509 OE2 GLU A 91 18.107 1.662 -11.989 1.00 0.00 O ATOM 0 H GLU A 91 13.525 0.820 -8.348 1.00 0.00 H new ATOM 0 HA GLU A 91 15.897 2.357 -7.920 1.00 0.00 H new ATOM 0 HB2 GLU A 91 15.391 0.742 -9.825 1.00 0.00 H new ATOM 0 HB3 GLU A 91 14.299 1.949 -10.474 1.00 0.00 H new ATOM 0 HG2 GLU A 91 16.057 3.470 -10.941 1.00 0.00 H new ATOM 0 HG3 GLU A 91 17.181 2.642 -9.882 1.00 0.00 H new ATOM 1516 N GLY A 92 15.336 4.744 -8.452 1.00 0.00 N ATOM 1517 CA GLY A 92 14.947 6.141 -8.510 1.00 0.00 C ATOM 1518 C GLY A 92 13.901 6.497 -7.472 1.00 0.00 C ATOM 1519 O GLY A 92 14.060 6.190 -6.291 1.00 0.00 O ATOM 0 H GLY A 92 16.337 4.583 -8.341 1.00 0.00 H new ATOM 0 HA2 GLY A 92 15.828 6.766 -8.363 1.00 0.00 H new ATOM 0 HA3 GLY A 92 14.559 6.366 -9.504 1.00 0.00 H new ATOM 1523 N GLU A 93 12.828 7.144 -7.914 1.00 0.00 N ATOM 1524 CA GLU A 93 11.750 7.541 -7.015 1.00 0.00 C ATOM 1525 C GLU A 93 10.426 6.917 -7.449 1.00 0.00 C ATOM 1526 O GLU A 93 10.158 6.783 -8.643 1.00 0.00 O ATOM 1527 CB GLU A 93 11.622 9.065 -6.982 1.00 0.00 C ATOM 1528 CG GLU A 93 12.677 9.747 -6.127 1.00 0.00 C ATOM 1529 CD GLU A 93 12.241 11.115 -5.643 1.00 0.00 C ATOM 1530 OE1 GLU A 93 12.143 12.037 -6.480 1.00 0.00 O ATOM 1531 OE2 GLU A 93 11.998 11.265 -4.427 1.00 0.00 O ATOM 0 H GLU A 93 12.681 7.405 -8.889 1.00 0.00 H new ATOM 0 HA GLU A 93 11.991 7.182 -6.014 1.00 0.00 H new ATOM 0 HB2 GLU A 93 11.688 9.449 -8.000 1.00 0.00 H new ATOM 0 HB3 GLU A 93 10.634 9.330 -6.605 1.00 0.00 H new ATOM 0 HG2 GLU A 93 12.905 9.117 -5.267 1.00 0.00 H new ATOM 0 HG3 GLU A 93 13.597 9.846 -6.703 1.00 0.00 H new ATOM 1538 N PRO A 94 9.568 6.533 -6.485 1.00 0.00 N ATOM 1539 CA PRO A 94 8.267 5.935 -6.776 1.00 0.00 C ATOM 1540 C PRO A 94 7.271 6.989 -7.224 1.00 0.00 C ATOM 1541 O PRO A 94 7.106 8.013 -6.560 1.00 0.00 O ATOM 1542 CB PRO A 94 7.832 5.318 -5.433 1.00 0.00 C ATOM 1543 CG PRO A 94 8.987 5.510 -4.500 1.00 0.00 C ATOM 1544 CD PRO A 94 9.776 6.664 -5.042 1.00 0.00 C ATOM 0 HA PRO A 94 8.317 5.204 -7.583 1.00 0.00 H new ATOM 0 HB2 PRO A 94 6.936 5.807 -5.051 1.00 0.00 H new ATOM 0 HB3 PRO A 94 7.594 4.260 -5.548 1.00 0.00 H new ATOM 0 HG2 PRO A 94 8.639 5.717 -3.488 1.00 0.00 H new ATOM 0 HG3 PRO A 94 9.599 4.610 -4.448 1.00 0.00 H new ATOM 0 HD2 PRO A 94 9.412 7.619 -4.664 1.00 0.00 H new ATOM 0 HD3 PRO A 94 10.831 6.597 -4.775 1.00 0.00 H new ATOM 1552 N TRP A 95 6.609 6.755 -8.351 1.00 0.00 N ATOM 1553 CA TRP A 95 5.647 7.723 -8.852 1.00 0.00 C ATOM 1554 C TRP A 95 4.329 7.080 -9.251 1.00 0.00 C ATOM 1555 O TRP A 95 3.282 7.385 -8.678 1.00 0.00 O ATOM 1556 CB TRP A 95 6.219 8.502 -10.040 1.00 0.00 C ATOM 1557 CG TRP A 95 6.870 7.658 -11.107 1.00 0.00 C ATOM 1558 CD1 TRP A 95 8.169 7.246 -11.143 1.00 0.00 C ATOM 1559 CD2 TRP A 95 6.259 7.145 -12.302 1.00 0.00 C ATOM 1560 NE1 TRP A 95 8.414 6.531 -12.294 1.00 0.00 N ATOM 1561 CE2 TRP A 95 7.258 6.457 -13.022 1.00 0.00 C ATOM 1562 CE3 TRP A 95 4.968 7.203 -12.836 1.00 0.00 C ATOM 1563 CZ2 TRP A 95 7.005 5.843 -14.247 1.00 0.00 C ATOM 1564 CZ3 TRP A 95 4.718 6.588 -14.048 1.00 0.00 C ATOM 1565 CH2 TRP A 95 5.733 5.921 -14.745 1.00 0.00 C ATOM 0 H TRP A 95 6.719 5.919 -8.925 1.00 0.00 H new ATOM 0 HA TRP A 95 5.448 8.411 -8.030 1.00 0.00 H new ATOM 0 HB2 TRP A 95 5.415 9.080 -10.496 1.00 0.00 H new ATOM 0 HB3 TRP A 95 6.953 9.216 -9.666 1.00 0.00 H new ATOM 0 HD1 TRP A 95 8.902 7.451 -10.377 1.00 0.00 H new ATOM 0 HE1 TRP A 95 9.310 6.123 -12.560 1.00 0.00 H new ATOM 0 HE3 TRP A 95 4.179 7.720 -12.310 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 7.785 5.324 -14.784 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 3.722 6.622 -14.465 1.00 0.00 H new ATOM 0 HH2 TRP A 95 5.507 5.459 -15.695 1.00 0.00 H new ATOM 1576 N GLY A 96 4.380 6.211 -10.247 1.00 0.00 N ATOM 1577 CA GLY A 96 3.171 5.560 -10.724 1.00 0.00 C ATOM 1578 C GLY A 96 2.024 6.537 -10.924 1.00 0.00 C ATOM 1579 O GLY A 96 1.964 7.234 -11.937 1.00 0.00 O ATOM 0 H GLY A 96 5.234 5.942 -10.736 1.00 0.00 H new ATOM 0 HA2 GLY A 96 3.382 5.055 -11.666 1.00 0.00 H new ATOM 0 HA3 GLY A 96 2.870 4.792 -10.011 1.00 0.00 H new ATOM 1583 N LYS A 97 1.113 6.586 -9.949 1.00 0.00 N ATOM 1584 CA LYS A 97 -0.045 7.480 -10.005 1.00 0.00 C ATOM 1585 C LYS A 97 -1.100 7.072 -8.972 1.00 0.00 C ATOM 1586 O LYS A 97 -2.297 7.063 -9.262 1.00 0.00 O ATOM 1587 CB LYS A 97 -0.664 7.482 -11.409 1.00 0.00 C ATOM 1588 CG LYS A 97 -0.479 8.796 -12.152 1.00 0.00 C ATOM 1589 CD LYS A 97 -1.310 8.837 -13.424 1.00 0.00 C ATOM 1590 CE LYS A 97 -2.610 9.599 -13.215 1.00 0.00 C ATOM 1591 NZ LYS A 97 -2.405 11.073 -13.268 1.00 0.00 N ATOM 0 H LYS A 97 1.156 6.013 -9.106 1.00 0.00 H new ATOM 0 HA LYS A 97 0.301 8.487 -9.772 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -0.220 6.677 -11.994 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -1.729 7.266 -11.328 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -0.763 9.625 -11.504 1.00 0.00 H new ATOM 0 HG3 LYS A 97 0.574 8.931 -12.399 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -0.735 9.308 -14.221 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -1.531 7.820 -13.749 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -3.330 9.305 -13.979 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -3.039 9.327 -12.251 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -3.315 11.555 -13.121 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -1.738 11.358 -12.523 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -2.019 11.337 -14.197 1.00 0.00 H new ATOM 1605 N GLU A 98 -0.651 6.735 -7.765 1.00 0.00 N ATOM 1606 CA GLU A 98 -1.562 6.328 -6.697 1.00 0.00 C ATOM 1607 C GLU A 98 -2.578 7.430 -6.396 1.00 0.00 C ATOM 1608 O GLU A 98 -3.719 7.150 -6.027 1.00 0.00 O ATOM 1609 CB GLU A 98 -0.775 5.956 -5.434 1.00 0.00 C ATOM 1610 CG GLU A 98 -0.351 7.146 -4.586 1.00 0.00 C ATOM 1611 CD GLU A 98 -1.156 7.257 -3.305 1.00 0.00 C ATOM 1612 OE1 GLU A 98 -1.510 6.205 -2.735 1.00 0.00 O ATOM 1613 OE2 GLU A 98 -1.430 8.396 -2.874 1.00 0.00 O ATOM 0 H GLU A 98 0.335 6.735 -7.502 1.00 0.00 H new ATOM 0 HA GLU A 98 -2.110 5.448 -7.034 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -1.384 5.289 -4.824 1.00 0.00 H new ATOM 0 HB3 GLU A 98 0.114 5.398 -5.726 1.00 0.00 H new ATOM 0 HG2 GLU A 98 0.707 7.056 -4.341 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -0.467 8.062 -5.166 1.00 0.00 H new ATOM 1620 N GLY A 99 -2.162 8.684 -6.565 1.00 0.00 N ATOM 1621 CA GLY A 99 -3.058 9.800 -6.316 1.00 0.00 C ATOM 1622 C GLY A 99 -2.457 10.866 -5.416 1.00 0.00 C ATOM 1623 O GLY A 99 -2.690 12.057 -5.620 1.00 0.00 O ATOM 0 H GLY A 99 -1.224 8.945 -6.869 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -3.336 10.253 -7.268 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -3.975 9.426 -5.861 1.00 0.00 H new ATOM 1627 N GLN A 100 -1.695 10.444 -4.411 1.00 0.00 N ATOM 1628 CA GLN A 100 -1.079 11.382 -3.477 1.00 0.00 C ATOM 1629 C GLN A 100 0.414 11.120 -3.311 1.00 0.00 C ATOM 1630 O GLN A 100 0.820 10.166 -2.648 1.00 0.00 O ATOM 1631 CB GLN A 100 -1.772 11.305 -2.116 1.00 0.00 C ATOM 1632 CG GLN A 100 -3.255 11.638 -2.169 1.00 0.00 C ATOM 1633 CD GLN A 100 -4.095 10.696 -1.329 1.00 0.00 C ATOM 1634 OE1 GLN A 100 -3.745 10.382 -0.190 1.00 0.00 O ATOM 1635 NE2 GLN A 100 -5.210 10.240 -1.887 1.00 0.00 N ATOM 0 H GLN A 100 -1.490 9.463 -4.223 1.00 0.00 H new ATOM 0 HA GLN A 100 -1.199 12.382 -3.893 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -1.648 10.301 -1.711 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -1.279 11.990 -1.427 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -3.406 12.660 -1.823 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -3.596 11.598 -3.204 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -5.461 10.527 -2.833 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -5.816 9.603 -1.369 1.00 0.00 H new ATOM 1644 N PRO A 101 1.252 11.985 -3.908 1.00 0.00 N ATOM 1645 CA PRO A 101 2.711 11.872 -3.825 1.00 0.00 C ATOM 1646 C PRO A 101 3.197 11.549 -2.413 1.00 0.00 C ATOM 1647 O PRO A 101 2.602 11.985 -1.428 1.00 0.00 O ATOM 1648 CB PRO A 101 3.165 13.268 -4.235 1.00 0.00 C ATOM 1649 CG PRO A 101 2.142 13.709 -5.217 1.00 0.00 C ATOM 1650 CD PRO A 101 0.840 13.158 -4.711 1.00 0.00 C ATOM 0 HA PRO A 101 3.103 11.065 -4.443 1.00 0.00 H new ATOM 0 HB2 PRO A 101 3.210 13.940 -3.378 1.00 0.00 H new ATOM 0 HB3 PRO A 101 4.161 13.249 -4.678 1.00 0.00 H new ATOM 0 HG2 PRO A 101 2.108 14.796 -5.287 1.00 0.00 H new ATOM 0 HG3 PRO A 101 2.367 13.332 -6.215 1.00 0.00 H new ATOM 0 HD2 PRO A 101 0.302 13.889 -4.107 1.00 0.00 H new ATOM 0 HD3 PRO A 101 0.179 12.872 -5.530 1.00 0.00 H new ATOM 1658 N GLY A 102 4.280 10.783 -2.322 1.00 0.00 N ATOM 1659 CA GLY A 102 4.823 10.416 -1.026 1.00 0.00 C ATOM 1660 C GLY A 102 6.322 10.642 -0.932 1.00 0.00 C ATOM 1661 O GLY A 102 6.960 11.041 -1.906 1.00 0.00 O ATOM 0 H GLY A 102 4.791 10.410 -3.122 1.00 0.00 H new ATOM 0 HA2 GLY A 102 4.323 10.996 -0.250 1.00 0.00 H new ATOM 0 HA3 GLY A 102 4.605 9.366 -0.830 1.00 0.00 H new ATOM 1665 N GLU A 103 6.883 10.383 0.247 1.00 0.00 N ATOM 1666 CA GLU A 103 8.315 10.555 0.474 1.00 0.00 C ATOM 1667 C GLU A 103 8.903 9.321 1.154 1.00 0.00 C ATOM 1668 O GLU A 103 8.182 8.559 1.797 1.00 0.00 O ATOM 1669 CB GLU A 103 8.574 11.796 1.330 1.00 0.00 C ATOM 1670 CG GLU A 103 8.669 13.082 0.525 1.00 0.00 C ATOM 1671 CD GLU A 103 8.092 14.275 1.260 1.00 0.00 C ATOM 1672 OE1 GLU A 103 8.771 14.799 2.168 1.00 0.00 O ATOM 1673 OE2 GLU A 103 6.959 14.686 0.929 1.00 0.00 O ATOM 0 H GLU A 103 6.366 10.052 1.062 1.00 0.00 H new ATOM 0 HA GLU A 103 8.800 10.686 -0.493 1.00 0.00 H new ATOM 0 HB2 GLU A 103 7.774 11.895 2.063 1.00 0.00 H new ATOM 0 HB3 GLU A 103 9.501 11.656 1.886 1.00 0.00 H new ATOM 0 HG2 GLU A 103 9.714 13.279 0.284 1.00 0.00 H new ATOM 0 HG3 GLU A 103 8.143 12.954 -0.421 1.00 0.00 H new ATOM 1680 N TRP A 104 10.212 9.124 1.010 1.00 0.00 N ATOM 1681 CA TRP A 104 10.870 7.969 1.620 1.00 0.00 C ATOM 1682 C TRP A 104 11.038 8.190 3.122 1.00 0.00 C ATOM 1683 O TRP A 104 11.880 8.976 3.554 1.00 0.00 O ATOM 1684 CB TRP A 104 12.246 7.705 0.976 1.00 0.00 C ATOM 1685 CG TRP A 104 12.406 8.295 -0.396 1.00 0.00 C ATOM 1686 CD1 TRP A 104 11.464 8.353 -1.384 1.00 0.00 C ATOM 1687 CD2 TRP A 104 13.584 8.910 -0.930 1.00 0.00 C ATOM 1688 NE1 TRP A 104 11.985 8.968 -2.497 1.00 0.00 N ATOM 1689 CE2 TRP A 104 13.285 9.319 -2.243 1.00 0.00 C ATOM 1690 CE3 TRP A 104 14.864 9.157 -0.423 1.00 0.00 C ATOM 1691 CZ2 TRP A 104 14.218 9.959 -3.055 1.00 0.00 C ATOM 1692 CZ3 TRP A 104 15.789 9.793 -1.230 1.00 0.00 C ATOM 1693 CH2 TRP A 104 15.461 10.187 -2.534 1.00 0.00 C ATOM 0 H TRP A 104 10.832 9.740 0.484 1.00 0.00 H new ATOM 0 HA TRP A 104 10.239 7.097 1.450 1.00 0.00 H new ATOM 0 HB2 TRP A 104 13.022 8.109 1.626 1.00 0.00 H new ATOM 0 HB3 TRP A 104 12.407 6.629 0.918 1.00 0.00 H new ATOM 0 HD1 TRP A 104 10.457 7.971 -1.302 1.00 0.00 H new ATOM 0 HE1 TRP A 104 11.485 9.136 -3.370 1.00 0.00 H new ATOM 0 HE3 TRP A 104 15.125 8.856 0.581 1.00 0.00 H new ATOM 0 HZ2 TRP A 104 13.968 10.264 -4.060 1.00 0.00 H new ATOM 0 HZ3 TRP A 104 16.780 9.989 -0.849 1.00 0.00 H new ATOM 0 HH2 TRP A 104 16.206 10.681 -3.140 1.00 0.00 H new ATOM 1704 N MET A 105 10.230 7.487 3.909 1.00 0.00 N ATOM 1705 CA MET A 105 10.286 7.599 5.364 1.00 0.00 C ATOM 1706 C MET A 105 10.607 6.253 6.003 1.00 0.00 C ATOM 1707 O MET A 105 10.441 5.206 5.380 1.00 0.00 O ATOM 1708 CB MET A 105 8.962 8.136 5.913 1.00 0.00 C ATOM 1709 CG MET A 105 7.734 7.560 5.228 1.00 0.00 C ATOM 1710 SD MET A 105 6.219 8.431 5.677 1.00 0.00 S ATOM 1711 CE MET A 105 6.213 8.206 7.454 1.00 0.00 C ATOM 0 H MET A 105 9.528 6.833 3.564 1.00 0.00 H new ATOM 0 HA MET A 105 11.083 8.299 5.615 1.00 0.00 H new ATOM 0 HB2 MET A 105 8.907 7.918 6.980 1.00 0.00 H new ATOM 0 HB3 MET A 105 8.949 9.221 5.808 1.00 0.00 H new ATOM 0 HG2 MET A 105 7.869 7.607 4.147 1.00 0.00 H new ATOM 0 HG3 MET A 105 7.635 6.507 5.492 1.00 0.00 H new ATOM 0 HE1 MET A 105 5.231 8.464 7.850 1.00 0.00 H new ATOM 0 HE2 MET A 105 6.438 7.166 7.690 1.00 0.00 H new ATOM 0 HE3 MET A 105 6.967 8.851 7.905 1.00 0.00 H new ATOM 1721 N SER A 106 11.059 6.286 7.252 1.00 0.00 N ATOM 1722 CA SER A 106 11.394 5.062 7.973 1.00 0.00 C ATOM 1723 C SER A 106 10.130 4.356 8.454 1.00 0.00 C ATOM 1724 O SER A 106 9.393 4.880 9.289 1.00 0.00 O ATOM 1725 CB SER A 106 12.300 5.379 9.165 1.00 0.00 C ATOM 1726 OG SER A 106 11.546 5.854 10.267 1.00 0.00 O ATOM 0 H SER A 106 11.202 7.144 7.785 1.00 0.00 H new ATOM 0 HA SER A 106 11.924 4.399 7.290 1.00 0.00 H new ATOM 0 HB2 SER A 106 12.850 4.484 9.456 1.00 0.00 H new ATOM 0 HB3 SER A 106 13.038 6.127 8.876 1.00 0.00 H new ATOM 0 HG SER A 106 10.606 5.944 10.005 1.00 0.00 H new ATOM 1732 N LEU A 107 9.883 3.163 7.919 1.00 0.00 N ATOM 1733 CA LEU A 107 8.706 2.386 8.293 1.00 0.00 C ATOM 1734 C LEU A 107 8.895 1.711 9.649 1.00 0.00 C ATOM 1735 O LEU A 107 7.925 1.312 10.292 1.00 0.00 O ATOM 1736 CB LEU A 107 8.404 1.332 7.229 1.00 0.00 C ATOM 1737 CG LEU A 107 6.938 0.905 7.138 1.00 0.00 C ATOM 1738 CD1 LEU A 107 6.173 1.815 6.190 1.00 0.00 C ATOM 1739 CD2 LEU A 107 6.832 -0.544 6.689 1.00 0.00 C ATOM 0 H LEU A 107 10.482 2.714 7.226 1.00 0.00 H new ATOM 0 HA LEU A 107 7.864 3.075 8.367 1.00 0.00 H new ATOM 0 HB2 LEU A 107 8.715 1.718 6.258 1.00 0.00 H new ATOM 0 HB3 LEU A 107 9.012 0.450 7.431 1.00 0.00 H new ATOM 0 HG LEU A 107 6.493 0.992 8.129 1.00 0.00 H new ATOM 0 HD11 LEU A 107 5.132 1.495 6.139 1.00 0.00 H new ATOM 0 HD12 LEU A 107 6.219 2.841 6.554 1.00 0.00 H new ATOM 0 HD13 LEU A 107 6.618 1.762 5.196 1.00 0.00 H new ATOM 0 HD21 LEU A 107 5.782 -0.831 6.630 1.00 0.00 H new ATOM 0 HD22 LEU A 107 7.295 -0.656 5.708 1.00 0.00 H new ATOM 0 HD23 LEU A 107 7.343 -1.186 7.407 1.00 0.00 H new ATOM 1751 N VAL A 108 10.149 1.588 10.081 1.00 0.00 N ATOM 1752 CA VAL A 108 10.458 0.962 11.361 1.00 0.00 C ATOM 1753 C VAL A 108 9.627 1.568 12.491 1.00 0.00 C ATOM 1754 O VAL A 108 9.392 0.926 13.514 1.00 0.00 O ATOM 1755 CB VAL A 108 11.955 1.097 11.704 1.00 0.00 C ATOM 1756 CG1 VAL A 108 12.348 2.561 11.829 1.00 0.00 C ATOM 1757 CG2 VAL A 108 12.284 0.337 12.981 1.00 0.00 C ATOM 0 H VAL A 108 10.965 1.914 9.563 1.00 0.00 H new ATOM 0 HA VAL A 108 10.209 -0.095 11.264 1.00 0.00 H new ATOM 0 HB VAL A 108 12.533 0.659 10.890 1.00 0.00 H new ATOM 0 HG11 VAL A 108 13.408 2.634 12.071 1.00 0.00 H new ATOM 0 HG12 VAL A 108 12.156 3.071 10.885 1.00 0.00 H new ATOM 0 HG13 VAL A 108 11.762 3.029 12.620 1.00 0.00 H new ATOM 0 HG21 VAL A 108 13.345 0.445 13.205 1.00 0.00 H new ATOM 0 HG22 VAL A 108 11.696 0.739 13.806 1.00 0.00 H new ATOM 0 HG23 VAL A 108 12.047 -0.719 12.848 1.00 0.00 H new ATOM 1767 N GLY A 109 9.187 2.809 12.298 1.00 0.00 N ATOM 1768 CA GLY A 109 8.390 3.476 13.308 1.00 0.00 C ATOM 1769 C GLY A 109 7.094 4.036 12.751 1.00 0.00 C ATOM 1770 O GLY A 109 6.717 5.166 13.059 1.00 0.00 O ATOM 0 H GLY A 109 9.369 3.362 11.461 1.00 0.00 H new ATOM 0 HA2 GLY A 109 8.163 2.773 14.110 1.00 0.00 H new ATOM 0 HA3 GLY A 109 8.972 4.285 13.749 1.00 0.00 H new ATOM 1774 N LEU A 110 6.410 3.241 11.933 1.00 0.00 N ATOM 1775 CA LEU A 110 5.147 3.666 11.339 1.00 0.00 C ATOM 1776 C LEU A 110 4.106 3.914 12.424 1.00 0.00 C ATOM 1777 O LEU A 110 4.153 3.299 13.489 1.00 0.00 O ATOM 1778 CB LEU A 110 4.636 2.613 10.354 1.00 0.00 C ATOM 1779 CG LEU A 110 3.476 3.070 9.471 1.00 0.00 C ATOM 1780 CD1 LEU A 110 3.516 2.359 8.127 1.00 0.00 C ATOM 1781 CD2 LEU A 110 2.148 2.823 10.172 1.00 0.00 C ATOM 0 H LEU A 110 6.708 2.302 11.667 1.00 0.00 H new ATOM 0 HA LEU A 110 5.319 4.596 10.798 1.00 0.00 H new ATOM 0 HB2 LEU A 110 5.462 2.304 9.713 1.00 0.00 H new ATOM 0 HB3 LEU A 110 4.322 1.733 10.915 1.00 0.00 H new ATOM 0 HG LEU A 110 3.576 4.141 9.292 1.00 0.00 H new ATOM 0 HD11 LEU A 110 2.682 2.697 7.512 1.00 0.00 H new ATOM 0 HD12 LEU A 110 4.455 2.587 7.623 1.00 0.00 H new ATOM 0 HD13 LEU A 110 3.439 1.283 8.282 1.00 0.00 H new ATOM 0 HD21 LEU A 110 1.331 3.154 9.531 1.00 0.00 H new ATOM 0 HD22 LEU A 110 2.039 1.759 10.379 1.00 0.00 H new ATOM 0 HD23 LEU A 110 2.122 3.380 11.109 1.00 0.00 H new ATOM 1793 N ASN A 111 3.179 4.831 12.162 1.00 0.00 N ATOM 1794 CA ASN A 111 2.150 5.162 13.138 1.00 0.00 C ATOM 1795 C ASN A 111 0.750 4.848 12.631 1.00 0.00 C ATOM 1796 O ASN A 111 0.363 5.252 11.533 1.00 0.00 O ATOM 1797 CB ASN A 111 2.247 6.640 13.519 1.00 0.00 C ATOM 1798 CG ASN A 111 2.611 6.840 14.978 1.00 0.00 C ATOM 1799 OD1 ASN A 111 1.855 6.471 15.875 1.00 0.00 O ATOM 1800 ND2 ASN A 111 3.777 7.427 15.221 1.00 0.00 N ATOM 0 H ASN A 111 3.120 5.354 11.288 1.00 0.00 H new ATOM 0 HA ASN A 111 2.325 4.541 14.017 1.00 0.00 H new ATOM 0 HB2 ASN A 111 2.994 7.126 12.891 1.00 0.00 H new ATOM 0 HB3 ASN A 111 1.294 7.128 13.315 1.00 0.00 H new ATOM 0 HD21 ASN A 111 4.076 7.588 16.183 1.00 0.00 H new ATOM 0 HD22 ASN A 111 4.373 7.717 14.446 1.00 0.00 H new ATOM 1807 N ALA A 112 -0.013 4.140 13.459 1.00 0.00 N ATOM 1808 CA ALA A 112 -1.383 3.781 13.128 1.00 0.00 C ATOM 1809 C ALA A 112 -2.294 5.011 13.201 1.00 0.00 C ATOM 1810 O ALA A 112 -3.426 4.989 12.721 1.00 0.00 O ATOM 1811 CB ALA A 112 -1.893 2.686 14.055 1.00 0.00 C ATOM 0 H ALA A 112 0.300 3.803 14.369 1.00 0.00 H new ATOM 0 HA ALA A 112 -1.397 3.399 12.107 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -2.919 2.433 13.789 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -1.264 1.802 13.954 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -1.861 3.038 15.086 1.00 0.00 H new ATOM 1817 N ASP A 113 -1.797 6.080 13.825 1.00 0.00 N ATOM 1818 CA ASP A 113 -2.568 7.311 13.970 1.00 0.00 C ATOM 1819 C ASP A 113 -2.566 8.129 12.677 1.00 0.00 C ATOM 1820 O ASP A 113 -3.618 8.569 12.212 1.00 0.00 O ATOM 1821 CB ASP A 113 -2.007 8.152 15.117 1.00 0.00 C ATOM 1822 CG ASP A 113 -2.879 9.352 15.434 1.00 0.00 C ATOM 1823 OD1 ASP A 113 -4.107 9.172 15.576 1.00 0.00 O ATOM 1824 OD2 ASP A 113 -2.334 10.470 15.540 1.00 0.00 O ATOM 0 H ASP A 113 -0.865 6.116 14.237 1.00 0.00 H new ATOM 0 HA ASP A 113 -3.598 7.034 14.193 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -1.912 7.530 16.007 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -1.005 8.493 14.858 1.00 0.00 H new ATOM 1829 N ASP A 114 -1.381 8.338 12.104 1.00 0.00 N ATOM 1830 CA ASP A 114 -1.253 9.113 10.869 1.00 0.00 C ATOM 1831 C ASP A 114 -1.887 8.379 9.694 1.00 0.00 C ATOM 1832 O ASP A 114 -2.451 9.000 8.794 1.00 0.00 O ATOM 1833 CB ASP A 114 0.216 9.433 10.547 1.00 0.00 C ATOM 1834 CG ASP A 114 1.210 8.782 11.492 1.00 0.00 C ATOM 1835 OD1 ASP A 114 1.318 9.242 12.649 1.00 0.00 O ATOM 1836 OD2 ASP A 114 1.878 7.813 11.075 1.00 0.00 O ATOM 0 H ASP A 114 -0.499 7.983 12.473 1.00 0.00 H new ATOM 0 HA ASP A 114 -1.782 10.053 11.029 1.00 0.00 H new ATOM 0 HB2 ASP A 114 0.433 9.110 9.529 1.00 0.00 H new ATOM 0 HB3 ASP A 114 0.357 10.513 10.576 1.00 0.00 H new ATOM 1841 N PHE A 115 -1.789 7.055 9.705 1.00 0.00 N ATOM 1842 CA PHE A 115 -2.356 6.237 8.641 1.00 0.00 C ATOM 1843 C PHE A 115 -3.851 6.011 8.888 1.00 0.00 C ATOM 1844 O PHE A 115 -4.373 6.406 9.930 1.00 0.00 O ATOM 1845 CB PHE A 115 -1.584 4.907 8.545 1.00 0.00 C ATOM 1846 CG PHE A 115 -2.305 3.720 9.119 1.00 0.00 C ATOM 1847 CD1 PHE A 115 -2.915 3.811 10.351 1.00 0.00 C ATOM 1848 CD2 PHE A 115 -2.365 2.519 8.431 1.00 0.00 C ATOM 1849 CE1 PHE A 115 -3.575 2.732 10.899 1.00 0.00 C ATOM 1850 CE2 PHE A 115 -3.025 1.433 8.972 1.00 0.00 C ATOM 1851 CZ PHE A 115 -3.631 1.542 10.208 1.00 0.00 C ATOM 0 H PHE A 115 -1.321 6.525 10.440 1.00 0.00 H new ATOM 0 HA PHE A 115 -2.257 6.754 7.687 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -1.360 4.707 7.497 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -0.629 5.019 9.059 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -2.875 4.743 10.896 1.00 0.00 H new ATOM 0 HD2 PHE A 115 -1.892 2.431 7.464 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -4.046 2.819 11.867 1.00 0.00 H new ATOM 0 HE2 PHE A 115 -3.067 0.500 8.429 1.00 0.00 H new ATOM 0 HZ PHE A 115 -4.149 0.695 10.633 1.00 0.00 H new ATOM 1861 N PRO A 116 -4.565 5.372 7.943 1.00 0.00 N ATOM 1862 CA PRO A 116 -6.000 5.111 8.099 1.00 0.00 C ATOM 1863 C PRO A 116 -6.279 4.101 9.213 1.00 0.00 C ATOM 1864 O PRO A 116 -5.703 3.015 9.232 1.00 0.00 O ATOM 1865 CB PRO A 116 -6.412 4.539 6.740 1.00 0.00 C ATOM 1866 CG PRO A 116 -5.158 3.982 6.162 1.00 0.00 C ATOM 1867 CD PRO A 116 -4.042 4.854 6.666 1.00 0.00 C ATOM 0 HA PRO A 116 -6.552 6.009 8.377 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -7.173 3.766 6.851 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -6.834 5.312 6.098 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -5.013 2.947 6.471 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -5.195 3.988 5.073 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -3.122 4.287 6.809 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -3.815 5.660 5.968 1.00 0.00 H new ATOM 1875 N PRO A 117 -7.171 4.444 10.163 1.00 0.00 N ATOM 1876 CA PRO A 117 -7.514 3.558 11.284 1.00 0.00 C ATOM 1877 C PRO A 117 -8.229 2.288 10.833 1.00 0.00 C ATOM 1878 O PRO A 117 -8.246 1.288 11.550 1.00 0.00 O ATOM 1879 CB PRO A 117 -8.442 4.414 12.151 1.00 0.00 C ATOM 1880 CG PRO A 117 -8.995 5.439 11.223 1.00 0.00 C ATOM 1881 CD PRO A 117 -7.908 5.719 10.225 1.00 0.00 C ATOM 0 HA PRO A 117 -6.623 3.209 11.806 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -9.236 3.812 12.593 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -7.898 4.878 12.973 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -9.895 5.073 10.728 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -9.273 6.345 11.762 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -8.316 5.996 9.253 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -7.267 6.539 10.547 1.00 0.00 H new ATOM 1889 N ALA A 118 -8.820 2.334 9.645 1.00 0.00 N ATOM 1890 CA ALA A 118 -9.540 1.185 9.102 1.00 0.00 C ATOM 1891 C ALA A 118 -8.589 0.068 8.687 1.00 0.00 C ATOM 1892 O ALA A 118 -9.024 -1.036 8.359 1.00 0.00 O ATOM 1893 CB ALA A 118 -10.404 1.612 7.926 1.00 0.00 C ATOM 0 H ALA A 118 -8.816 3.154 9.038 1.00 0.00 H new ATOM 0 HA ALA A 118 -10.182 0.793 9.891 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -10.935 0.746 7.531 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -11.125 2.360 8.257 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -9.772 2.037 7.146 1.00 0.00 H new ATOM 1899 N ASN A 119 -7.296 0.362 8.686 1.00 0.00 N ATOM 1900 CA ASN A 119 -6.293 -0.615 8.295 1.00 0.00 C ATOM 1901 C ASN A 119 -5.402 -1.006 9.474 1.00 0.00 C ATOM 1902 O ASN A 119 -4.272 -1.456 9.285 1.00 0.00 O ATOM 1903 CB ASN A 119 -5.448 -0.025 7.170 1.00 0.00 C ATOM 1904 CG ASN A 119 -5.881 -0.511 5.802 1.00 0.00 C ATOM 1905 OD1 ASN A 119 -5.057 -0.937 4.994 1.00 0.00 O ATOM 1906 ND2 ASN A 119 -7.180 -0.440 5.533 1.00 0.00 N ATOM 0 H ASN A 119 -6.918 1.271 8.952 1.00 0.00 H new ATOM 0 HA ASN A 119 -6.796 -1.520 7.954 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -5.514 1.063 7.203 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -4.402 -0.286 7.330 1.00 0.00 H new ATOM 0 HD21 ASN A 119 -7.530 -0.746 4.625 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -7.827 -0.080 6.234 1.00 0.00 H new ATOM 1913 N GLU A 120 -5.913 -0.825 10.690 1.00 0.00 N ATOM 1914 CA GLU A 120 -5.162 -1.150 11.896 1.00 0.00 C ATOM 1915 C GLU A 120 -4.912 -2.656 12.037 1.00 0.00 C ATOM 1916 O GLU A 120 -3.856 -3.062 12.511 1.00 0.00 O ATOM 1917 CB GLU A 120 -5.890 -0.592 13.129 1.00 0.00 C ATOM 1918 CG GLU A 120 -6.446 -1.648 14.076 1.00 0.00 C ATOM 1919 CD GLU A 120 -7.095 -1.043 15.307 1.00 0.00 C ATOM 1920 OE1 GLU A 120 -7.848 -0.058 15.157 1.00 0.00 O ATOM 1921 OE2 GLU A 120 -6.848 -1.554 16.419 1.00 0.00 O ATOM 0 H GLU A 120 -6.847 -0.454 10.864 1.00 0.00 H new ATOM 0 HA GLU A 120 -4.182 -0.680 11.817 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -5.201 0.045 13.683 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -6.710 0.042 12.793 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -7.178 -2.257 13.546 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -5.641 -2.314 14.385 1.00 0.00 H new ATOM 1928 N PRO A 121 -5.871 -3.512 11.640 1.00 0.00 N ATOM 1929 CA PRO A 121 -5.708 -4.966 11.750 1.00 0.00 C ATOM 1930 C PRO A 121 -4.399 -5.464 11.139 1.00 0.00 C ATOM 1931 O PRO A 121 -3.675 -6.246 11.755 1.00 0.00 O ATOM 1932 CB PRO A 121 -6.905 -5.516 10.972 1.00 0.00 C ATOM 1933 CG PRO A 121 -7.935 -4.445 11.060 1.00 0.00 C ATOM 1934 CD PRO A 121 -7.179 -3.145 11.066 1.00 0.00 C ATOM 0 HA PRO A 121 -5.669 -5.289 12.790 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -6.641 -5.728 9.936 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -7.265 -6.449 11.406 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -8.622 -4.493 10.215 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -8.534 -4.553 11.964 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -7.076 -2.736 10.061 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -7.684 -2.389 11.668 1.00 0.00 H new ATOM 1942 N VAL A 122 -4.103 -5.010 9.927 1.00 0.00 N ATOM 1943 CA VAL A 122 -2.883 -5.415 9.233 1.00 0.00 C ATOM 1944 C VAL A 122 -1.669 -4.671 9.774 1.00 0.00 C ATOM 1945 O VAL A 122 -0.656 -5.279 10.118 1.00 0.00 O ATOM 1946 CB VAL A 122 -2.967 -5.165 7.710 1.00 0.00 C ATOM 1947 CG1 VAL A 122 -2.151 -6.203 6.956 1.00 0.00 C ATOM 1948 CG2 VAL A 122 -4.410 -5.162 7.226 1.00 0.00 C ATOM 0 H VAL A 122 -4.690 -4.361 9.403 1.00 0.00 H new ATOM 0 HA VAL A 122 -2.776 -6.485 9.412 1.00 0.00 H new ATOM 0 HB VAL A 122 -2.549 -4.179 7.509 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -2.221 -6.013 5.885 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -1.108 -6.143 7.268 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -2.538 -7.198 7.174 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -4.433 -4.984 6.151 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -4.869 -6.127 7.444 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -4.963 -4.374 7.736 1.00 0.00 H new ATOM 1958 N ILE A 123 -1.780 -3.350 9.836 1.00 0.00 N ATOM 1959 CA ILE A 123 -0.693 -2.514 10.321 1.00 0.00 C ATOM 1960 C ILE A 123 -0.358 -2.832 11.777 1.00 0.00 C ATOM 1961 O ILE A 123 0.798 -2.741 12.185 1.00 0.00 O ATOM 1962 CB ILE A 123 -1.034 -1.013 10.162 1.00 0.00 C ATOM 1963 CG1 ILE A 123 -0.403 -0.469 8.878 1.00 0.00 C ATOM 1964 CG2 ILE A 123 -0.567 -0.204 11.366 1.00 0.00 C ATOM 1965 CD1 ILE A 123 1.089 -0.252 8.986 1.00 0.00 C ATOM 0 H ILE A 123 -2.615 -2.835 9.555 1.00 0.00 H new ATOM 0 HA ILE A 123 0.185 -2.734 9.714 1.00 0.00 H new ATOM 0 HB ILE A 123 -2.118 -0.916 10.100 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -0.603 -1.163 8.062 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -0.882 0.475 8.619 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -0.823 0.846 11.220 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -1.057 -0.575 12.266 1.00 0.00 H new ATOM 0 HG23 ILE A 123 0.513 -0.303 11.474 1.00 0.00 H new ATOM 0 HD11 ILE A 123 1.470 0.134 8.041 1.00 0.00 H new ATOM 0 HD12 ILE A 123 1.296 0.465 9.781 1.00 0.00 H new ATOM 0 HD13 ILE A 123 1.579 -1.199 9.215 1.00 0.00 H new ATOM 1977 N ALA A 124 -1.367 -3.210 12.552 1.00 0.00 N ATOM 1978 CA ALA A 124 -1.162 -3.546 13.957 1.00 0.00 C ATOM 1979 C ALA A 124 -0.096 -4.623 14.094 1.00 0.00 C ATOM 1980 O ALA A 124 0.707 -4.605 15.028 1.00 0.00 O ATOM 1981 CB ALA A 124 -2.464 -4.004 14.596 1.00 0.00 C ATOM 0 H ALA A 124 -2.333 -3.292 12.234 1.00 0.00 H new ATOM 0 HA ALA A 124 -0.822 -2.651 14.478 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -2.289 -4.250 15.643 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -3.203 -3.205 14.529 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -2.835 -4.886 14.074 1.00 0.00 H new ATOM 1987 N LYS A 125 -0.093 -5.556 13.150 1.00 0.00 N ATOM 1988 CA LYS A 125 0.881 -6.642 13.155 1.00 0.00 C ATOM 1989 C LYS A 125 2.296 -6.092 13.003 1.00 0.00 C ATOM 1990 O LYS A 125 3.207 -6.481 13.733 1.00 0.00 O ATOM 1991 CB LYS A 125 0.580 -7.632 12.028 1.00 0.00 C ATOM 1992 CG LYS A 125 -0.578 -8.567 12.334 1.00 0.00 C ATOM 1993 CD LYS A 125 -0.221 -9.553 13.435 1.00 0.00 C ATOM 1994 CE LYS A 125 -0.676 -9.057 14.798 1.00 0.00 C ATOM 1995 NZ LYS A 125 -1.226 -10.158 15.636 1.00 0.00 N ATOM 0 H LYS A 125 -0.752 -5.583 12.372 1.00 0.00 H new ATOM 0 HA LYS A 125 0.809 -7.163 14.110 1.00 0.00 H new ATOM 0 HB2 LYS A 125 0.357 -7.076 11.117 1.00 0.00 H new ATOM 0 HB3 LYS A 125 1.472 -8.225 11.829 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -1.448 -7.984 12.634 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -0.855 -9.112 11.432 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -0.684 -10.517 13.225 1.00 0.00 H new ATOM 0 HD3 LYS A 125 0.857 -9.712 13.446 1.00 0.00 H new ATOM 0 HE2 LYS A 125 0.165 -8.593 15.314 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -1.435 -8.286 14.668 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 -1.525 -9.778 16.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 -2.044 -10.584 15.156 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -0.494 -10.882 15.782 1.00 0.00 H new ATOM 2009 N LEU A 126 2.470 -5.181 12.049 1.00 0.00 N ATOM 2010 CA LEU A 126 3.772 -4.570 11.797 1.00 0.00 C ATOM 2011 C LEU A 126 4.079 -3.489 12.830 1.00 0.00 C ATOM 2012 O LEU A 126 5.240 -3.213 13.128 1.00 0.00 O ATOM 2013 CB LEU A 126 3.812 -3.970 10.391 1.00 0.00 C ATOM 2014 CG LEU A 126 5.211 -3.655 9.857 1.00 0.00 C ATOM 2015 CD1 LEU A 126 6.129 -4.861 10.008 1.00 0.00 C ATOM 2016 CD2 LEU A 126 5.138 -3.216 8.402 1.00 0.00 C ATOM 0 H LEU A 126 1.724 -4.849 11.437 1.00 0.00 H new ATOM 0 HA LEU A 126 4.530 -5.349 11.877 1.00 0.00 H new ATOM 0 HB2 LEU A 126 3.326 -4.662 9.704 1.00 0.00 H new ATOM 0 HB3 LEU A 126 3.224 -3.052 10.388 1.00 0.00 H new ATOM 0 HG LEU A 126 5.626 -2.836 10.444 1.00 0.00 H new ATOM 0 HD11 LEU A 126 7.118 -4.616 9.622 1.00 0.00 H new ATOM 0 HD12 LEU A 126 6.207 -5.130 11.062 1.00 0.00 H new ATOM 0 HD13 LEU A 126 5.720 -5.702 9.448 1.00 0.00 H new ATOM 0 HD21 LEU A 126 6.141 -2.996 8.038 1.00 0.00 H new ATOM 0 HD22 LEU A 126 4.701 -4.015 7.802 1.00 0.00 H new ATOM 0 HD23 LEU A 126 4.519 -2.323 8.322 1.00 0.00 H new ATOM 2028 N LYS A 127 3.028 -2.879 13.370 1.00 0.00 N ATOM 2029 CA LYS A 127 3.180 -1.825 14.367 1.00 0.00 C ATOM 2030 C LYS A 127 3.934 -2.332 15.583 1.00 0.00 C ATOM 2031 O LYS A 127 4.818 -1.655 16.109 1.00 0.00 O ATOM 2032 CB LYS A 127 1.810 -1.321 14.795 1.00 0.00 C ATOM 2033 CG LYS A 127 1.854 -0.013 15.562 1.00 0.00 C ATOM 2034 CD LYS A 127 0.566 0.777 15.395 1.00 0.00 C ATOM 2035 CE LYS A 127 0.220 1.552 16.656 1.00 0.00 C ATOM 2036 NZ LYS A 127 0.951 2.847 16.731 1.00 0.00 N ATOM 0 H LYS A 127 2.060 -3.097 13.133 1.00 0.00 H new ATOM 0 HA LYS A 127 3.750 -1.011 13.919 1.00 0.00 H new ATOM 0 HB2 LYS A 127 1.187 -1.192 13.910 1.00 0.00 H new ATOM 0 HB3 LYS A 127 1.331 -2.079 15.414 1.00 0.00 H new ATOM 0 HG2 LYS A 127 2.022 -0.216 16.620 1.00 0.00 H new ATOM 0 HG3 LYS A 127 2.696 0.585 15.214 1.00 0.00 H new ATOM 0 HD2 LYS A 127 0.668 1.468 14.558 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -0.250 0.097 15.149 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -0.853 1.739 16.684 1.00 0.00 H new ATOM 0 HE3 LYS A 127 0.461 0.948 17.531 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 1.202 3.047 17.720 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 1.817 2.790 16.158 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 0.345 3.610 16.367 1.00 0.00 H new ATOM 2050 N ARG A 128 3.591 -3.538 16.014 1.00 0.00 N ATOM 2051 CA ARG A 128 4.250 -4.149 17.157 1.00 0.00 C ATOM 2052 C ARG A 128 5.623 -4.676 16.751 1.00 0.00 C ATOM 2053 O ARG A 128 6.380 -5.176 17.582 1.00 0.00 O ATOM 2054 CB ARG A 128 3.387 -5.281 17.721 1.00 0.00 C ATOM 2055 CG ARG A 128 4.062 -6.070 18.831 1.00 0.00 C ATOM 2056 CD ARG A 128 3.102 -7.059 19.475 1.00 0.00 C ATOM 2057 NE ARG A 128 3.740 -8.345 19.745 1.00 0.00 N ATOM 2058 CZ ARG A 128 4.067 -9.223 18.800 1.00 0.00 C ATOM 2059 NH1 ARG A 128 3.819 -8.958 17.523 1.00 0.00 N ATOM 2060 NH2 ARG A 128 4.646 -10.369 19.131 1.00 0.00 N ATOM 0 H ARG A 128 2.861 -4.111 15.590 1.00 0.00 H new ATOM 0 HA ARG A 128 4.383 -3.395 17.933 1.00 0.00 H new ATOM 0 HB2 ARG A 128 2.456 -4.861 18.101 1.00 0.00 H new ATOM 0 HB3 ARG A 128 3.123 -5.962 16.912 1.00 0.00 H new ATOM 0 HG2 ARG A 128 4.921 -6.606 18.427 1.00 0.00 H new ATOM 0 HG3 ARG A 128 4.441 -5.384 19.588 1.00 0.00 H new ATOM 0 HD2 ARG A 128 2.722 -6.640 20.407 1.00 0.00 H new ATOM 0 HD3 ARG A 128 2.244 -7.210 18.820 1.00 0.00 H new ATOM 0 HE ARG A 128 3.947 -8.584 20.715 1.00 0.00 H new ATOM 0 HH11 ARG A 128 3.376 -8.077 17.262 1.00 0.00 H new ATOM 0 HH12 ARG A 128 4.072 -9.635 16.803 1.00 0.00 H new ATOM 0 HH21 ARG A 128 4.841 -10.578 20.110 1.00 0.00 H new ATOM 0 HH22 ARG A 128 4.897 -11.042 18.406 1.00 0.00 H new ATOM 2074 N LEU A 129 5.940 -4.555 15.459 1.00 0.00 N ATOM 2075 CA LEU A 129 7.223 -5.013 14.937 1.00 0.00 C ATOM 2076 C LEU A 129 7.499 -6.458 15.345 1.00 0.00 C ATOM 2077 O LEU A 129 8.276 -7.159 14.696 1.00 0.00 O ATOM 2078 CB LEU A 129 8.349 -4.104 15.433 1.00 0.00 C ATOM 2079 CG LEU A 129 8.185 -2.623 15.086 1.00 0.00 C ATOM 2080 CD1 LEU A 129 7.551 -1.871 16.246 1.00 0.00 C ATOM 2081 CD2 LEU A 129 9.527 -2.007 14.720 1.00 0.00 C ATOM 0 H LEU A 129 5.324 -4.143 14.758 1.00 0.00 H new ATOM 0 HA LEU A 129 7.180 -4.969 13.849 1.00 0.00 H new ATOM 0 HB2 LEU A 129 8.424 -4.202 16.516 1.00 0.00 H new ATOM 0 HB3 LEU A 129 9.292 -4.457 15.015 1.00 0.00 H new ATOM 0 HG LEU A 129 7.525 -2.544 14.222 1.00 0.00 H new ATOM 0 HD11 LEU A 129 7.442 -0.819 15.982 1.00 0.00 H new ATOM 0 HD12 LEU A 129 6.570 -2.295 16.461 1.00 0.00 H new ATOM 0 HD13 LEU A 129 8.186 -1.960 17.127 1.00 0.00 H new ATOM 0 HD21 LEU A 129 9.389 -0.954 14.476 1.00 0.00 H new ATOM 0 HD22 LEU A 129 10.211 -2.098 15.564 1.00 0.00 H new ATOM 0 HD23 LEU A 129 9.943 -2.527 13.857 1.00 0.00 H new TER 2093 LEU A 129 HETATM 2094 MG MG A 130 -4.299 2.388 -8.967 1.00 0.00 MG HETATM 2095 OP3 8OG A 131 -8.527 6.076 -4.532 1.00 20.00 O HETATM 2096 P 8OG A 131 -9.697 4.971 -4.577 1.00 20.00 P HETATM 2097 OP1 8OG A 131 -9.076 3.630 -4.653 1.00 20.00 O HETATM 2098 OP2 8OG A 131 -10.672 5.372 -5.616 1.00 20.00 O HETATM 2099 O5' 8OG A 131 -10.384 5.144 -3.132 1.00 20.00 O HETATM 2100 C5' 8OG A 131 -11.351 4.192 -2.677 1.00 20.00 C HETATM 2101 C4' 8OG A 131 -10.737 2.793 -2.599 1.00 20.00 C HETATM 2102 O4' 8OG A 131 -9.591 2.556 -1.773 1.00 20.00 O HETATM 2103 C3' 8OG A 131 -11.722 1.733 -2.102 1.00 20.00 C HETATM 2104 O3' 8OG A 131 -12.033 0.785 -3.127 1.00 20.00 O HETATM 2105 C2' 8OG A 131 -11.084 1.059 -0.883 1.00 20.00 C HETATM 2106 C1' 8OG A 131 -9.716 1.700 -0.630 1.00 20.00 C HETATM 2107 N9 8OG A 131 -9.413 2.057 0.774 1.00 20.00 N HETATM 2108 C8 8OG A 131 -10.279 2.793 1.539 1.00 20.00 C HETATM 2109 N7 8OG A 131 -9.673 2.872 2.765 1.00 20.00 N HETATM 2110 C5 8OG A 131 -8.473 2.210 2.773 1.00 20.00 C HETATM 2111 C6 8OG A 131 -7.507 1.988 3.689 1.00 20.00 C HETATM 2112 O6 8OG A 131 -7.661 2.463 4.867 1.00 20.00 O HETATM 2113 N1 8OG A 131 -6.352 1.263 3.413 1.00 20.00 N HETATM 2114 C2 8OG A 131 -6.209 0.757 2.149 1.00 20.00 C HETATM 2115 N2 8OG A 131 -5.096 0.060 1.886 1.00 20.00 N HETATM 2116 N3 8OG A 131 -7.152 0.928 1.129 1.00 20.00 N HETATM 2117 C4 8OG A 131 -8.293 1.684 1.509 1.00 20.00 C HETATM 2118 O8 8OG A 131 -11.410 3.286 1.195 1.00 20.00 O HETATM 0 HO3' 8OG A 131 -11.220 0.569 -3.630 1.00 20.00 H new HETATM 0 H5'' 8OG A 131 -11.724 4.486 -1.696 1.00 20.00 H new HETATM 0 H2'' 8OG A 131 -11.724 1.176 -0.008 1.00 20.00 H new HETATM 0 H7 8OG A 131 -10.065 3.361 3.570 1.00 20.00 H new HETATM 0 H5' 8OG A 131 -12.206 4.182 -3.354 1.00 20.00 H new HETATM 0 H4' 8OG A 131 -10.436 2.724 -3.644 1.00 20.00 H new HETATM 0 H3' 8OG A 131 -12.670 2.194 -1.825 1.00 20.00 H new HETATM 0 H22 8OG A 131 -4.949 -0.335 0.957 1.00 20.00 H new HETATM 0 H21 8OG A 131 -4.395 -0.076 2.615 1.00 20.00 H new HETATM 0 H2' 8OG A 131 -10.974 -0.011 -1.057 1.00 20.00 H new HETATM 0 H1' 8OG A 131 -8.823 1.076 -0.609 1.00 20.00 H new HETATM 0 H1 8OG A 131 -5.638 1.114 4.126 1.00 20.00 H new HETATM 2131 O HOH A5143 -5.854 3.798 -9.200 1.00 0.00 O HETATM 2132 O HOH A5144 -3.881 3.277 -7.101 1.00 0.00 O