USER MOD reduce.3.24.130724 H: found=0, std=0, add=924, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 922 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 1 MET N :NH3+ 154:sc= -0.642 (180deg=-0.0144) USER MOD Set 1.2: B 35 ASN : amide:sc= -1.36 K(o=-2,f=-5.1!) USER MOD Set 2.1: A 35 ASN : amide:sc= -1.42 K(o=-2,f=-5.1!) USER MOD Set 2.2: B 1 MET N :NH3+ 157:sc= -0.611 (180deg=-0.0165) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 160:sc= -0.488 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 MET CE :methyl -125:sc= -1.41 (180deg=-4.81!) USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 149:sc= -0.113 (180deg=-1.15) USER MOD Single : A 28 ASN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : A 29 GLN : amide:sc= -0.436 X(o=-0.44,f=0) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 43 HIS : no HD1:sc= -0.331 X(o=-0.33,f=-0.57!) USER MOD Single : A 48 TYR OH : rot 173:sc= 1.21 USER MOD Single : A 49 GLN : amide:sc= -2.78! C(o=-2.8!,f=-3.1!) USER MOD Single : A 52 GLN : amide:sc= -1.45 X(o=-1.5,f=-1.6) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 5 THR OG1 : rot 155:sc= -0.515 USER MOD Single : B 11 THR OG1 : rot 180:sc= 0 USER MOD Single : B 13 MET CE :methyl -130:sc= -1.4 (180deg=-4.82!) USER MOD Single : B 19 THR OG1 : rot 180:sc= 0 USER MOD Single : B 21 THR OG1 : rot 180:sc= 0 USER MOD Single : B 26 LYS NZ :NH3+ 149:sc= -0.115 (180deg=-1.13) USER MOD Single : B 28 ASN : amide:sc= -0.0104 X(o=-0.01,f=-0.36) USER MOD Single : B 29 GLN : amide:sc= -0.434 X(o=-0.43,f=0) USER MOD Single : B 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 41 SER OG : rot 180:sc= 0 USER MOD Single : B 43 HIS : no HD1:sc= -0.443 X(o=-0.44,f=-0.64) USER MOD Single : B 48 TYR OH : rot 175:sc= 1.16 USER MOD Single : B 49 GLN : amide:sc= -2.85! C(o=-2.8!,f=-3!) USER MOD Single : B 52 GLN : amide:sc= -1.34 X(o=-1.3,f=-1.4) USER MOD Single : B 55 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.00665) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -1.097 -9.530 -5.026 1.00 0.00 N ATOM 2 CA MET A 1 -1.239 -10.233 -3.724 1.00 0.00 C ATOM 3 C MET A 1 0.124 -10.605 -3.147 1.00 0.00 C ATOM 4 O MET A 1 0.555 -11.754 -3.239 1.00 0.00 O ATOM 5 CB MET A 1 -2.081 -11.492 -3.939 1.00 0.00 C ATOM 6 CG MET A 1 -2.440 -12.211 -2.649 1.00 0.00 C ATOM 7 SD MET A 1 -4.086 -12.945 -2.699 1.00 0.00 S ATOM 8 CE MET A 1 -3.850 -14.380 -1.654 1.00 0.00 C ATOM 0 H1 MET A 1 -1.956 -9.674 -5.594 1.00 0.00 H new ATOM 0 H2 MET A 1 -0.959 -8.513 -4.858 1.00 0.00 H new ATOM 0 H3 MET A 1 -0.276 -9.911 -5.538 1.00 0.00 H new ATOM 0 HA MET A 1 -1.729 -9.570 -3.011 1.00 0.00 H new ATOM 0 HB2 MET A 1 -2.998 -11.221 -4.461 1.00 0.00 H new ATOM 0 HB3 MET A 1 -1.536 -12.177 -4.588 1.00 0.00 H new ATOM 0 HG2 MET A 1 -1.704 -12.991 -2.455 1.00 0.00 H new ATOM 0 HG3 MET A 1 -2.385 -11.508 -1.818 1.00 0.00 H new ATOM 0 HE1 MET A 1 -4.784 -14.938 -1.587 1.00 0.00 H new ATOM 0 HE2 MET A 1 -3.076 -15.018 -2.081 1.00 0.00 H new ATOM 0 HE3 MET A 1 -3.547 -14.059 -0.658 1.00 0.00 H new ATOM 20 N LEU A 2 0.799 -9.625 -2.554 1.00 0.00 N ATOM 21 CA LEU A 2 2.114 -9.854 -1.965 1.00 0.00 C ATOM 22 C LEU A 2 2.075 -9.672 -0.451 1.00 0.00 C ATOM 23 O LEU A 2 2.057 -8.545 0.045 1.00 0.00 O ATOM 24 CB LEU A 2 3.142 -8.896 -2.573 1.00 0.00 C ATOM 25 CG LEU A 2 2.970 -8.623 -4.068 1.00 0.00 C ATOM 26 CD1 LEU A 2 2.028 -7.450 -4.291 1.00 0.00 C ATOM 27 CD2 LEU A 2 4.320 -8.357 -4.718 1.00 0.00 C ATOM 0 H LEU A 2 0.458 -8.667 -2.469 1.00 0.00 H new ATOM 0 HA LEU A 2 2.405 -10.881 -2.183 1.00 0.00 H new ATOM 0 HB2 LEU A 2 3.092 -7.947 -2.038 1.00 0.00 H new ATOM 0 HB3 LEU A 2 4.139 -9.304 -2.406 1.00 0.00 H new ATOM 0 HG LEU A 2 2.532 -9.507 -4.533 1.00 0.00 H new ATOM 0 HD11 LEU A 2 1.918 -7.270 -5.360 1.00 0.00 H new ATOM 0 HD12 LEU A 2 1.054 -7.679 -3.859 1.00 0.00 H new ATOM 0 HD13 LEU A 2 2.437 -6.559 -3.814 1.00 0.00 H new ATOM 0 HD21 LEU A 2 4.180 -8.165 -5.782 1.00 0.00 H new ATOM 0 HD22 LEU A 2 4.784 -7.489 -4.250 1.00 0.00 H new ATOM 0 HD23 LEU A 2 4.964 -9.227 -4.588 1.00 0.00 H new ATOM 39 N ILE A 3 2.064 -10.784 0.280 1.00 0.00 N ATOM 40 CA ILE A 3 2.030 -10.728 1.736 1.00 0.00 C ATOM 41 C ILE A 3 3.441 -10.772 2.317 1.00 0.00 C ATOM 42 O ILE A 3 4.091 -11.817 2.341 1.00 0.00 O ATOM 43 CB ILE A 3 1.169 -11.865 2.334 1.00 0.00 C ATOM 44 CG1 ILE A 3 0.923 -11.622 3.826 1.00 0.00 C ATOM 45 CG2 ILE A 3 1.822 -13.222 2.111 1.00 0.00 C ATOM 46 CD1 ILE A 3 -0.445 -12.077 4.297 1.00 0.00 C ATOM 0 H ILE A 3 2.078 -11.727 -0.109 1.00 0.00 H new ATOM 0 HA ILE A 3 1.568 -9.780 2.010 1.00 0.00 H new ATOM 0 HB ILE A 3 0.208 -11.868 1.820 1.00 0.00 H new ATOM 0 HG12 ILE A 3 1.688 -12.143 4.402 1.00 0.00 H new ATOM 0 HG13 ILE A 3 1.035 -10.558 4.036 1.00 0.00 H new ATOM 0 HG21 ILE A 3 1.195 -14.003 2.542 1.00 0.00 H new ATOM 0 HG22 ILE A 3 1.938 -13.399 1.042 1.00 0.00 H new ATOM 0 HG23 ILE A 3 2.801 -13.238 2.590 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -0.549 -11.874 5.363 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -1.217 -11.538 3.748 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -0.554 -13.147 4.119 1.00 0.00 H new ATOM 58 N LEU A 4 3.899 -9.619 2.792 1.00 0.00 N ATOM 59 CA LEU A 4 5.222 -9.494 3.391 1.00 0.00 C ATOM 60 C LEU A 4 5.107 -8.921 4.798 1.00 0.00 C ATOM 61 O LEU A 4 4.132 -8.241 5.113 1.00 0.00 O ATOM 62 CB LEU A 4 6.118 -8.604 2.525 1.00 0.00 C ATOM 63 CG LEU A 4 7.434 -9.249 2.082 1.00 0.00 C ATOM 64 CD1 LEU A 4 7.643 -9.071 0.586 1.00 0.00 C ATOM 65 CD2 LEU A 4 8.604 -8.663 2.858 1.00 0.00 C ATOM 0 H LEU A 4 3.367 -8.749 2.773 1.00 0.00 H new ATOM 0 HA LEU A 4 5.674 -10.484 3.451 1.00 0.00 H new ATOM 0 HB2 LEU A 4 5.560 -8.306 1.638 1.00 0.00 H new ATOM 0 HB3 LEU A 4 6.345 -7.693 3.079 1.00 0.00 H new ATOM 0 HG LEU A 4 7.380 -10.317 2.295 1.00 0.00 H new ATOM 0 HD11 LEU A 4 8.584 -9.537 0.292 1.00 0.00 H new ATOM 0 HD12 LEU A 4 6.821 -9.541 0.045 1.00 0.00 H new ATOM 0 HD13 LEU A 4 7.674 -8.008 0.347 1.00 0.00 H new ATOM 0 HD21 LEU A 4 9.531 -9.134 2.530 1.00 0.00 H new ATOM 0 HD22 LEU A 4 8.659 -7.589 2.678 1.00 0.00 H new ATOM 0 HD23 LEU A 4 8.462 -8.846 3.923 1.00 0.00 H new ATOM 77 N THR A 5 6.101 -9.177 5.641 1.00 0.00 N ATOM 78 CA THR A 5 6.080 -8.655 7.002 1.00 0.00 C ATOM 79 C THR A 5 6.675 -7.256 7.046 1.00 0.00 C ATOM 80 O THR A 5 7.686 -6.981 6.400 1.00 0.00 O ATOM 81 CB THR A 5 6.845 -9.573 7.954 1.00 0.00 C ATOM 82 OG1 THR A 5 7.119 -10.821 7.343 1.00 0.00 O ATOM 83 CG2 THR A 5 6.098 -9.841 9.241 1.00 0.00 C ATOM 0 H THR A 5 6.922 -9.736 5.410 1.00 0.00 H new ATOM 0 HA THR A 5 5.040 -8.610 7.325 1.00 0.00 H new ATOM 0 HB THR A 5 7.769 -9.045 8.189 1.00 0.00 H new ATOM 0 HG1 THR A 5 7.858 -11.260 7.813 1.00 0.00 H new ATOM 0 HG21 THR A 5 6.691 -10.499 9.876 1.00 0.00 H new ATOM 0 HG22 THR A 5 5.919 -8.900 9.761 1.00 0.00 H new ATOM 0 HG23 THR A 5 5.144 -10.318 9.016 1.00 0.00 H new ATOM 91 N ARG A 6 6.046 -6.374 7.811 1.00 0.00 N ATOM 92 CA ARG A 6 6.520 -5.004 7.934 1.00 0.00 C ATOM 93 C ARG A 6 6.158 -4.412 9.291 1.00 0.00 C ATOM 94 O ARG A 6 5.107 -4.718 9.859 1.00 0.00 O ATOM 95 CB ARG A 6 5.934 -4.137 6.819 1.00 0.00 C ATOM 96 CG ARG A 6 6.365 -4.556 5.423 1.00 0.00 C ATOM 97 CD ARG A 6 5.393 -5.553 4.812 1.00 0.00 C ATOM 98 NE ARG A 6 4.763 -5.030 3.602 1.00 0.00 N ATOM 99 CZ ARG A 6 5.350 -5.012 2.407 1.00 0.00 C ATOM 100 NH1 ARG A 6 6.582 -5.483 2.259 1.00 0.00 N ATOM 101 NH2 ARG A 6 4.704 -4.521 1.358 1.00 0.00 N ATOM 0 H ARG A 6 5.208 -6.583 8.354 1.00 0.00 H new ATOM 0 HA ARG A 6 7.606 -5.020 7.846 1.00 0.00 H new ATOM 0 HB2 ARG A 6 4.846 -4.172 6.879 1.00 0.00 H new ATOM 0 HB3 ARG A 6 6.229 -3.101 6.984 1.00 0.00 H new ATOM 0 HG2 ARG A 6 6.434 -3.676 4.784 1.00 0.00 H new ATOM 0 HG3 ARG A 6 7.361 -4.998 5.466 1.00 0.00 H new ATOM 0 HD2 ARG A 6 5.921 -6.477 4.576 1.00 0.00 H new ATOM 0 HD3 ARG A 6 4.624 -5.804 5.542 1.00 0.00 H new ATOM 0 HE ARG A 6 3.817 -4.656 3.677 1.00 0.00 H new ATOM 0 HH11 ARG A 6 7.083 -5.861 3.063 1.00 0.00 H new ATOM 0 HH12 ARG A 6 7.027 -5.467 1.341 1.00 0.00 H new ATOM 0 HH21 ARG A 6 3.757 -4.157 1.467 1.00 0.00 H new ATOM 0 HH22 ARG A 6 5.154 -4.507 0.443 1.00 0.00 H new ATOM 115 N ARG A 7 7.041 -3.559 9.800 1.00 0.00 N ATOM 116 CA ARG A 7 6.826 -2.906 11.090 1.00 0.00 C ATOM 117 C ARG A 7 7.977 -1.958 11.450 1.00 0.00 C ATOM 118 O ARG A 7 8.064 -1.483 12.581 1.00 0.00 O ATOM 119 CB ARG A 7 6.655 -3.955 12.190 1.00 0.00 C ATOM 120 CG ARG A 7 6.343 -3.363 13.556 1.00 0.00 C ATOM 121 CD ARG A 7 7.354 -3.813 14.600 1.00 0.00 C ATOM 122 NE ARG A 7 8.546 -2.968 14.613 1.00 0.00 N ATOM 123 CZ ARG A 7 9.683 -3.300 15.220 1.00 0.00 C ATOM 124 NH1 ARG A 7 9.788 -4.457 15.861 1.00 0.00 N ATOM 125 NH2 ARG A 7 10.719 -2.473 15.182 1.00 0.00 N ATOM 0 H ARG A 7 7.914 -3.302 9.339 1.00 0.00 H new ATOM 0 HA ARG A 7 5.917 -2.311 11.007 1.00 0.00 H new ATOM 0 HB2 ARG A 7 5.853 -4.637 11.908 1.00 0.00 H new ATOM 0 HB3 ARG A 7 7.567 -4.547 12.260 1.00 0.00 H new ATOM 0 HG2 ARG A 7 6.344 -2.275 13.492 1.00 0.00 H new ATOM 0 HG3 ARG A 7 5.341 -3.663 13.864 1.00 0.00 H new ATOM 0 HD2 ARG A 7 6.888 -3.797 15.585 1.00 0.00 H new ATOM 0 HD3 ARG A 7 7.644 -4.845 14.402 1.00 0.00 H new ATOM 0 HE ARG A 7 8.504 -2.071 14.129 1.00 0.00 H new ATOM 0 HH11 ARG A 7 8.995 -5.098 15.890 1.00 0.00 H new ATOM 0 HH12 ARG A 7 10.662 -4.706 16.324 1.00 0.00 H new ATOM 0 HH21 ARG A 7 10.644 -1.584 14.688 1.00 0.00 H new ATOM 0 HH22 ARG A 7 11.591 -2.726 15.647 1.00 0.00 H new ATOM 139 N VAL A 8 8.862 -1.682 10.496 1.00 0.00 N ATOM 140 CA VAL A 8 9.991 -0.796 10.748 1.00 0.00 C ATOM 141 C VAL A 8 10.085 0.302 9.696 1.00 0.00 C ATOM 142 O VAL A 8 10.359 1.459 10.018 1.00 0.00 O ATOM 143 CB VAL A 8 11.315 -1.580 10.787 1.00 0.00 C ATOM 144 CG1 VAL A 8 12.456 -0.682 11.238 1.00 0.00 C ATOM 145 CG2 VAL A 8 11.185 -2.791 11.698 1.00 0.00 C ATOM 0 H VAL A 8 8.819 -2.057 9.548 1.00 0.00 H new ATOM 0 HA VAL A 8 9.820 -0.335 11.721 1.00 0.00 H new ATOM 0 HB VAL A 8 11.541 -1.931 9.780 1.00 0.00 H new ATOM 0 HG11 VAL A 8 13.383 -1.255 11.259 1.00 0.00 H new ATOM 0 HG12 VAL A 8 12.560 0.151 10.543 1.00 0.00 H new ATOM 0 HG13 VAL A 8 12.244 -0.298 12.236 1.00 0.00 H new ATOM 0 HG21 VAL A 8 12.129 -3.336 11.716 1.00 0.00 H new ATOM 0 HG22 VAL A 8 10.937 -2.462 12.707 1.00 0.00 H new ATOM 0 HG23 VAL A 8 10.396 -3.444 11.325 1.00 0.00 H new ATOM 155 N GLY A 9 9.857 -0.061 8.438 1.00 0.00 N ATOM 156 CA GLY A 9 9.922 0.916 7.367 1.00 0.00 C ATOM 157 C GLY A 9 10.052 0.279 5.998 1.00 0.00 C ATOM 158 O GLY A 9 11.157 -0.027 5.551 1.00 0.00 O ATOM 0 H GLY A 9 9.629 -1.010 8.142 1.00 0.00 H new ATOM 0 HA2 GLY A 9 9.025 1.535 7.391 1.00 0.00 H new ATOM 0 HA3 GLY A 9 10.771 1.578 7.537 1.00 0.00 H new ATOM 162 N GLU A 10 8.920 0.086 5.328 1.00 0.00 N ATOM 163 CA GLU A 10 8.914 -0.510 3.998 1.00 0.00 C ATOM 164 C GLU A 10 8.858 0.575 2.928 1.00 0.00 C ATOM 165 O GLU A 10 9.773 0.707 2.115 1.00 0.00 O ATOM 166 CB GLU A 10 7.727 -1.463 3.844 1.00 0.00 C ATOM 167 CG GLU A 10 8.097 -2.792 3.207 1.00 0.00 C ATOM 168 CD GLU A 10 8.989 -3.634 4.097 1.00 0.00 C ATOM 169 OE1 GLU A 10 8.945 -3.445 5.331 1.00 0.00 O ATOM 170 OE2 GLU A 10 9.731 -4.483 3.562 1.00 0.00 O ATOM 0 H GLU A 10 7.997 0.333 5.684 1.00 0.00 H new ATOM 0 HA GLU A 10 9.836 -1.078 3.872 1.00 0.00 H new ATOM 0 HB2 GLU A 10 7.290 -1.648 4.825 1.00 0.00 H new ATOM 0 HB3 GLU A 10 6.959 -0.980 3.239 1.00 0.00 H new ATOM 0 HG2 GLU A 10 7.187 -3.348 2.980 1.00 0.00 H new ATOM 0 HG3 GLU A 10 8.604 -2.609 2.260 1.00 0.00 H new ATOM 177 N THR A 11 7.782 1.356 2.941 1.00 0.00 N ATOM 178 CA THR A 11 7.607 2.438 1.979 1.00 0.00 C ATOM 179 C THR A 11 7.471 1.902 0.558 1.00 0.00 C ATOM 180 O THR A 11 8.467 1.615 -0.106 1.00 0.00 O ATOM 181 CB THR A 11 8.784 3.412 2.056 1.00 0.00 C ATOM 182 OG1 THR A 11 9.043 3.780 3.400 1.00 0.00 O ATOM 183 CG2 THR A 11 8.560 4.685 1.268 1.00 0.00 C ATOM 0 H THR A 11 7.017 1.259 3.609 1.00 0.00 H new ATOM 0 HA THR A 11 6.687 2.963 2.234 1.00 0.00 H new ATOM 0 HB THR A 11 9.629 2.878 1.622 1.00 0.00 H new ATOM 0 HG1 THR A 11 9.800 4.402 3.429 1.00 0.00 H new ATOM 0 HG21 THR A 11 9.432 5.331 1.365 1.00 0.00 H new ATOM 0 HG22 THR A 11 8.405 4.440 0.217 1.00 0.00 H new ATOM 0 HG23 THR A 11 7.681 5.202 1.653 1.00 0.00 H new ATOM 191 N LEU A 12 6.231 1.785 0.090 1.00 0.00 N ATOM 192 CA LEU A 12 5.967 1.301 -1.261 1.00 0.00 C ATOM 193 C LEU A 12 5.210 2.359 -2.058 1.00 0.00 C ATOM 194 O LEU A 12 4.516 3.196 -1.482 1.00 0.00 O ATOM 195 CB LEU A 12 5.185 -0.022 -1.220 1.00 0.00 C ATOM 196 CG LEU A 12 3.656 0.097 -1.146 1.00 0.00 C ATOM 197 CD1 LEU A 12 2.995 -1.005 -1.959 1.00 0.00 C ATOM 198 CD2 LEU A 12 3.189 0.044 0.299 1.00 0.00 C ATOM 0 H LEU A 12 5.395 2.018 0.626 1.00 0.00 H new ATOM 0 HA LEU A 12 6.918 1.111 -1.758 1.00 0.00 H new ATOM 0 HB2 LEU A 12 5.441 -0.599 -2.108 1.00 0.00 H new ATOM 0 HB3 LEU A 12 5.526 -0.595 -0.358 1.00 0.00 H new ATOM 0 HG LEU A 12 3.364 1.058 -1.569 1.00 0.00 H new ATOM 0 HD11 LEU A 12 1.912 -0.905 -1.895 1.00 0.00 H new ATOM 0 HD12 LEU A 12 3.306 -0.925 -3.001 1.00 0.00 H new ATOM 0 HD13 LEU A 12 3.293 -1.977 -1.565 1.00 0.00 H new ATOM 0 HD21 LEU A 12 2.103 0.130 0.334 1.00 0.00 H new ATOM 0 HD22 LEU A 12 3.493 -0.903 0.745 1.00 0.00 H new ATOM 0 HD23 LEU A 12 3.636 0.867 0.856 1.00 0.00 H new ATOM 210 N MET A 13 5.344 2.328 -3.381 1.00 0.00 N ATOM 211 CA MET A 13 4.664 3.298 -4.227 1.00 0.00 C ATOM 212 C MET A 13 3.913 2.605 -5.357 1.00 0.00 C ATOM 213 O MET A 13 4.503 2.221 -6.367 1.00 0.00 O ATOM 214 CB MET A 13 5.676 4.293 -4.804 1.00 0.00 C ATOM 215 CG MET A 13 5.072 5.282 -5.792 1.00 0.00 C ATOM 216 SD MET A 13 5.972 5.347 -7.353 1.00 0.00 S ATOM 217 CE MET A 13 6.680 6.990 -7.268 1.00 0.00 C ATOM 0 H MET A 13 5.912 1.647 -3.885 1.00 0.00 H new ATOM 0 HA MET A 13 3.940 3.836 -3.615 1.00 0.00 H new ATOM 0 HB2 MET A 13 6.134 4.847 -3.985 1.00 0.00 H new ATOM 0 HB3 MET A 13 6.473 3.739 -5.300 1.00 0.00 H new ATOM 0 HG2 MET A 13 4.035 5.007 -5.987 1.00 0.00 H new ATOM 0 HG3 MET A 13 5.060 6.275 -5.343 1.00 0.00 H new ATOM 0 HE1 MET A 13 6.396 7.555 -8.156 1.00 0.00 H new ATOM 0 HE2 MET A 13 6.309 7.501 -6.379 1.00 0.00 H new ATOM 0 HE3 MET A 13 7.766 6.916 -7.217 1.00 0.00 H new ATOM 227 N ILE A 14 2.607 2.450 -5.178 1.00 0.00 N ATOM 228 CA ILE A 14 1.772 1.808 -6.179 1.00 0.00 C ATOM 229 C ILE A 14 0.695 2.764 -6.690 1.00 0.00 C ATOM 230 O ILE A 14 -0.306 3.005 -6.016 1.00 0.00 O ATOM 231 CB ILE A 14 1.106 0.534 -5.617 1.00 0.00 C ATOM 232 CG1 ILE A 14 0.324 -0.186 -6.716 1.00 0.00 C ATOM 233 CG2 ILE A 14 0.198 0.873 -4.443 1.00 0.00 C ATOM 234 CD1 ILE A 14 1.182 -0.584 -7.896 1.00 0.00 C ATOM 0 H ILE A 14 2.105 2.762 -4.347 1.00 0.00 H new ATOM 0 HA ILE A 14 2.421 1.528 -7.009 1.00 0.00 H new ATOM 0 HB ILE A 14 1.888 -0.134 -5.256 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -0.142 -1.078 -6.297 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -0.482 0.461 -7.063 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -0.261 -0.040 -4.063 1.00 0.00 H new ATOM 0 HG22 ILE A 14 0.785 1.341 -3.652 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -0.581 1.561 -4.772 1.00 0.00 H new ATOM 0 HD11 ILE A 14 0.566 -1.090 -8.639 1.00 0.00 H new ATOM 0 HD12 ILE A 14 1.627 0.307 -8.339 1.00 0.00 H new ATOM 0 HD13 ILE A 14 1.972 -1.256 -7.561 1.00 0.00 H new ATOM 246 N GLY A 15 0.910 3.308 -7.884 1.00 0.00 N ATOM 247 CA GLY A 15 -0.048 4.232 -8.463 1.00 0.00 C ATOM 248 C GLY A 15 0.586 5.151 -9.490 1.00 0.00 C ATOM 249 O GLY A 15 0.933 4.719 -10.589 1.00 0.00 O ATOM 0 H GLY A 15 1.731 3.125 -8.461 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -0.855 3.669 -8.932 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -0.496 4.831 -7.670 1.00 0.00 H new ATOM 253 N ASP A 16 0.736 6.422 -9.132 1.00 0.00 N ATOM 254 CA ASP A 16 1.332 7.406 -10.032 1.00 0.00 C ATOM 255 C ASP A 16 2.455 8.188 -9.349 1.00 0.00 C ATOM 256 O ASP A 16 3.252 8.846 -10.018 1.00 0.00 O ATOM 257 CB ASP A 16 0.262 8.374 -10.540 1.00 0.00 C ATOM 258 CG ASP A 16 0.649 9.026 -11.852 1.00 0.00 C ATOM 259 OD1 ASP A 16 1.026 8.293 -12.791 1.00 0.00 O ATOM 260 OD2 ASP A 16 0.576 10.270 -11.942 1.00 0.00 O ATOM 0 H ASP A 16 0.454 6.796 -8.226 1.00 0.00 H new ATOM 0 HA ASP A 16 1.762 6.864 -10.874 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -0.678 7.838 -10.667 1.00 0.00 H new ATOM 0 HB3 ASP A 16 0.089 9.146 -9.791 1.00 0.00 H new ATOM 265 N GLU A 17 2.516 8.114 -8.018 1.00 0.00 N ATOM 266 CA GLU A 17 3.540 8.813 -7.242 1.00 0.00 C ATOM 267 C GLU A 17 3.137 8.865 -5.770 1.00 0.00 C ATOM 268 O GLU A 17 2.944 9.941 -5.203 1.00 0.00 O ATOM 269 CB GLU A 17 3.758 10.235 -7.778 1.00 0.00 C ATOM 270 CG GLU A 17 5.030 10.388 -8.595 1.00 0.00 C ATOM 271 CD GLU A 17 4.949 11.526 -9.594 1.00 0.00 C ATOM 272 OE1 GLU A 17 3.843 11.780 -10.116 1.00 0.00 O ATOM 273 OE2 GLU A 17 5.991 12.163 -9.854 1.00 0.00 O ATOM 0 H GLU A 17 1.862 7.572 -7.452 1.00 0.00 H new ATOM 0 HA GLU A 17 4.476 8.263 -7.338 1.00 0.00 H new ATOM 0 HB2 GLU A 17 2.904 10.517 -8.394 1.00 0.00 H new ATOM 0 HB3 GLU A 17 3.789 10.930 -6.939 1.00 0.00 H new ATOM 0 HG2 GLU A 17 5.871 10.559 -7.923 1.00 0.00 H new ATOM 0 HG3 GLU A 17 5.231 9.457 -9.126 1.00 0.00 H new ATOM 280 N VAL A 18 2.997 7.693 -5.159 1.00 0.00 N ATOM 281 CA VAL A 18 2.603 7.599 -3.766 1.00 0.00 C ATOM 282 C VAL A 18 3.770 7.168 -2.878 1.00 0.00 C ATOM 283 O VAL A 18 4.921 7.141 -3.311 1.00 0.00 O ATOM 284 CB VAL A 18 1.441 6.601 -3.605 1.00 0.00 C ATOM 285 CG1 VAL A 18 0.258 7.011 -4.471 1.00 0.00 C ATOM 286 CG2 VAL A 18 1.894 5.187 -3.941 1.00 0.00 C ATOM 0 H VAL A 18 3.153 6.793 -5.613 1.00 0.00 H new ATOM 0 HA VAL A 18 2.281 8.592 -3.451 1.00 0.00 H new ATOM 0 HB VAL A 18 1.121 6.614 -2.563 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -0.552 6.293 -4.343 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -0.085 8.002 -4.173 1.00 0.00 H new ATOM 0 HG13 VAL A 18 0.563 7.031 -5.517 1.00 0.00 H new ATOM 0 HG21 VAL A 18 1.057 4.499 -3.821 1.00 0.00 H new ATOM 0 HG22 VAL A 18 2.246 5.153 -4.972 1.00 0.00 H new ATOM 0 HG23 VAL A 18 2.703 4.895 -3.271 1.00 0.00 H new ATOM 296 N THR A 19 3.454 6.828 -1.632 1.00 0.00 N ATOM 297 CA THR A 19 4.454 6.391 -0.665 1.00 0.00 C ATOM 298 C THR A 19 3.769 5.965 0.627 1.00 0.00 C ATOM 299 O THR A 19 3.328 6.804 1.410 1.00 0.00 O ATOM 300 CB THR A 19 5.458 7.511 -0.385 1.00 0.00 C ATOM 301 OG1 THR A 19 6.217 7.225 0.776 1.00 0.00 O ATOM 302 CG2 THR A 19 4.808 8.864 -0.185 1.00 0.00 C ATOM 0 H THR A 19 2.502 6.848 -1.266 1.00 0.00 H new ATOM 0 HA THR A 19 4.996 5.541 -1.081 1.00 0.00 H new ATOM 0 HB THR A 19 6.091 7.558 -1.271 1.00 0.00 H new ATOM 0 HG1 THR A 19 6.854 7.952 0.938 1.00 0.00 H new ATOM 0 HG21 THR A 19 5.577 9.612 0.009 1.00 0.00 H new ATOM 0 HG22 THR A 19 4.254 9.138 -1.083 1.00 0.00 H new ATOM 0 HG23 THR A 19 4.125 8.818 0.663 1.00 0.00 H new ATOM 310 N VAL A 20 3.657 4.657 0.834 1.00 0.00 N ATOM 311 CA VAL A 20 2.994 4.136 2.022 1.00 0.00 C ATOM 312 C VAL A 20 3.985 3.641 3.070 1.00 0.00 C ATOM 313 O VAL A 20 4.607 2.588 2.910 1.00 0.00 O ATOM 314 CB VAL A 20 2.030 2.989 1.667 1.00 0.00 C ATOM 315 CG1 VAL A 20 1.200 2.589 2.879 1.00 0.00 C ATOM 316 CG2 VAL A 20 1.135 3.385 0.502 1.00 0.00 C ATOM 0 H VAL A 20 4.014 3.943 0.199 1.00 0.00 H new ATOM 0 HA VAL A 20 2.433 4.970 2.443 1.00 0.00 H new ATOM 0 HB VAL A 20 2.621 2.125 1.363 1.00 0.00 H new ATOM 0 HG11 VAL A 20 0.526 1.777 2.606 1.00 0.00 H new ATOM 0 HG12 VAL A 20 1.861 2.258 3.680 1.00 0.00 H new ATOM 0 HG13 VAL A 20 0.618 3.445 3.220 1.00 0.00 H new ATOM 0 HG21 VAL A 20 0.461 2.562 0.265 1.00 0.00 H new ATOM 0 HG22 VAL A 20 0.552 4.265 0.774 1.00 0.00 H new ATOM 0 HG23 VAL A 20 1.750 3.612 -0.369 1.00 0.00 H new ATOM 326 N THR A 21 4.114 4.415 4.144 1.00 0.00 N ATOM 327 CA THR A 21 5.011 4.078 5.243 1.00 0.00 C ATOM 328 C THR A 21 4.273 3.270 6.310 1.00 0.00 C ATOM 329 O THR A 21 3.382 3.783 6.990 1.00 0.00 O ATOM 330 CB THR A 21 5.596 5.350 5.860 1.00 0.00 C ATOM 331 OG1 THR A 21 6.533 5.030 6.873 1.00 0.00 O ATOM 332 CG2 THR A 21 4.549 6.254 6.473 1.00 0.00 C ATOM 0 H THR A 21 3.603 5.288 4.276 1.00 0.00 H new ATOM 0 HA THR A 21 5.825 3.471 4.848 1.00 0.00 H new ATOM 0 HB THR A 21 6.071 5.879 5.034 1.00 0.00 H new ATOM 0 HG1 THR A 21 6.897 5.856 7.254 1.00 0.00 H new ATOM 0 HG21 THR A 21 5.031 7.137 6.892 1.00 0.00 H new ATOM 0 HG22 THR A 21 3.837 6.559 5.706 1.00 0.00 H new ATOM 0 HG23 THR A 21 4.023 5.718 7.263 1.00 0.00 H new ATOM 340 N VAL A 22 4.643 2.001 6.443 1.00 0.00 N ATOM 341 CA VAL A 22 4.012 1.116 7.417 1.00 0.00 C ATOM 342 C VAL A 22 4.639 1.267 8.802 1.00 0.00 C ATOM 343 O VAL A 22 5.207 0.319 9.345 1.00 0.00 O ATOM 344 CB VAL A 22 4.112 -0.357 6.977 1.00 0.00 C ATOM 345 CG1 VAL A 22 3.356 -0.579 5.676 1.00 0.00 C ATOM 346 CG2 VAL A 22 5.569 -0.773 6.835 1.00 0.00 C ATOM 0 H VAL A 22 5.377 1.561 5.888 1.00 0.00 H new ATOM 0 HA VAL A 22 2.963 1.406 7.471 1.00 0.00 H new ATOM 0 HB VAL A 22 3.654 -0.979 7.746 1.00 0.00 H new ATOM 0 HG11 VAL A 22 3.438 -1.625 5.381 1.00 0.00 H new ATOM 0 HG12 VAL A 22 2.306 -0.323 5.817 1.00 0.00 H new ATOM 0 HG13 VAL A 22 3.781 0.052 4.896 1.00 0.00 H new ATOM 0 HG21 VAL A 22 5.621 -1.816 6.524 1.00 0.00 H new ATOM 0 HG22 VAL A 22 6.055 -0.147 6.087 1.00 0.00 H new ATOM 0 HG23 VAL A 22 6.076 -0.655 7.793 1.00 0.00 H new ATOM 356 N LEU A 23 4.533 2.464 9.369 1.00 0.00 N ATOM 357 CA LEU A 23 5.090 2.734 10.690 1.00 0.00 C ATOM 358 C LEU A 23 4.026 2.545 11.780 1.00 0.00 C ATOM 359 O LEU A 23 3.204 1.634 11.690 1.00 0.00 O ATOM 360 CB LEU A 23 5.676 4.153 10.728 1.00 0.00 C ATOM 361 CG LEU A 23 6.744 4.418 11.805 1.00 0.00 C ATOM 362 CD1 LEU A 23 7.140 3.136 12.535 1.00 0.00 C ATOM 363 CD2 LEU A 23 7.969 5.077 11.187 1.00 0.00 C ATOM 0 H LEU A 23 4.067 3.261 8.936 1.00 0.00 H new ATOM 0 HA LEU A 23 5.892 2.022 10.887 1.00 0.00 H new ATOM 0 HB2 LEU A 23 6.112 4.370 9.753 1.00 0.00 H new ATOM 0 HB3 LEU A 23 4.858 4.858 10.876 1.00 0.00 H new ATOM 0 HG LEU A 23 6.310 5.096 12.540 1.00 0.00 H new ATOM 0 HD11 LEU A 23 7.895 3.364 13.287 1.00 0.00 H new ATOM 0 HD12 LEU A 23 6.263 2.708 13.020 1.00 0.00 H new ATOM 0 HD13 LEU A 23 7.545 2.420 11.820 1.00 0.00 H new ATOM 0 HD21 LEU A 23 8.715 5.258 11.961 1.00 0.00 H new ATOM 0 HD22 LEU A 23 8.389 4.421 10.425 1.00 0.00 H new ATOM 0 HD23 LEU A 23 7.682 6.025 10.732 1.00 0.00 H new ATOM 375 N GLY A 24 4.045 3.396 12.810 1.00 0.00 N ATOM 376 CA GLY A 24 3.077 3.285 13.887 1.00 0.00 C ATOM 377 C GLY A 24 3.034 1.897 14.493 1.00 0.00 C ATOM 378 O GLY A 24 2.056 1.171 14.324 1.00 0.00 O ATOM 0 H GLY A 24 4.715 4.158 12.914 1.00 0.00 H new ATOM 0 HA2 GLY A 24 3.320 4.009 14.665 1.00 0.00 H new ATOM 0 HA3 GLY A 24 2.088 3.543 13.509 1.00 0.00 H new ATOM 382 N VAL A 25 4.100 1.523 15.196 1.00 0.00 N ATOM 383 CA VAL A 25 4.172 0.211 15.815 1.00 0.00 C ATOM 384 C VAL A 25 3.573 0.219 17.218 1.00 0.00 C ATOM 385 O VAL A 25 4.159 0.765 18.153 1.00 0.00 O ATOM 386 CB VAL A 25 5.628 -0.284 15.900 1.00 0.00 C ATOM 387 CG1 VAL A 25 5.673 -1.743 16.328 1.00 0.00 C ATOM 388 CG2 VAL A 25 6.341 -0.086 14.571 1.00 0.00 C ATOM 0 H VAL A 25 4.920 2.110 15.348 1.00 0.00 H new ATOM 0 HA VAL A 25 3.594 -0.464 15.184 1.00 0.00 H new ATOM 0 HB VAL A 25 6.148 0.307 16.654 1.00 0.00 H new ATOM 0 HG11 VAL A 25 6.710 -2.074 16.382 1.00 0.00 H new ATOM 0 HG12 VAL A 25 5.206 -1.849 17.307 1.00 0.00 H new ATOM 0 HG13 VAL A 25 5.135 -2.352 15.602 1.00 0.00 H new ATOM 0 HG21 VAL A 25 7.368 -0.442 14.652 1.00 0.00 H new ATOM 0 HG22 VAL A 25 5.823 -0.647 13.793 1.00 0.00 H new ATOM 0 HG23 VAL A 25 6.344 0.973 14.314 1.00 0.00 H new ATOM 398 N LYS A 26 2.399 -0.389 17.353 1.00 0.00 N ATOM 399 CA LYS A 26 1.714 -0.452 18.639 1.00 0.00 C ATOM 400 C LYS A 26 1.014 -1.794 18.823 1.00 0.00 C ATOM 401 O LYS A 26 0.538 -2.395 17.859 1.00 0.00 O ATOM 402 CB LYS A 26 0.697 0.686 18.754 1.00 0.00 C ATOM 403 CG LYS A 26 1.322 2.070 18.684 1.00 0.00 C ATOM 404 CD LYS A 26 0.428 3.119 19.324 1.00 0.00 C ATOM 405 CE LYS A 26 -0.333 3.918 18.278 1.00 0.00 C ATOM 406 NZ LYS A 26 -1.689 4.309 18.755 1.00 0.00 N ATOM 0 H LYS A 26 1.902 -0.845 16.588 1.00 0.00 H new ATOM 0 HA LYS A 26 2.462 -0.345 19.424 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -0.038 0.587 17.955 1.00 0.00 H new ATOM 0 HB3 LYS A 26 0.158 0.587 19.696 1.00 0.00 H new ATOM 0 HG2 LYS A 26 2.289 2.059 19.187 1.00 0.00 H new ATOM 0 HG3 LYS A 26 1.507 2.334 17.643 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -0.279 2.634 19.998 1.00 0.00 H new ATOM 0 HD3 LYS A 26 1.033 3.794 19.929 1.00 0.00 H new ATOM 0 HE2 LYS A 26 0.234 4.813 18.022 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -0.425 3.327 17.366 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -1.961 5.215 18.324 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -2.377 3.577 18.485 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -1.678 4.408 19.790 1.00 0.00 H new ATOM 420 N GLY A 27 0.956 -2.259 20.067 1.00 0.00 N ATOM 421 CA GLY A 27 0.313 -3.526 20.357 1.00 0.00 C ATOM 422 C GLY A 27 -1.157 -3.529 19.988 1.00 0.00 C ATOM 423 O GLY A 27 -1.777 -2.471 19.872 1.00 0.00 O ATOM 0 H GLY A 27 1.344 -1.780 20.880 1.00 0.00 H new ATOM 0 HA2 GLY A 27 0.822 -4.321 19.813 1.00 0.00 H new ATOM 0 HA3 GLY A 27 0.418 -3.748 21.419 1.00 0.00 H new ATOM 427 N ASN A 28 -1.716 -4.720 19.800 1.00 0.00 N ATOM 428 CA ASN A 28 -3.122 -4.859 19.438 1.00 0.00 C ATOM 429 C ASN A 28 -3.388 -4.258 18.060 1.00 0.00 C ATOM 430 O ASN A 28 -3.436 -4.975 17.061 1.00 0.00 O ATOM 431 CB ASN A 28 -4.014 -4.192 20.490 1.00 0.00 C ATOM 432 CG ASN A 28 -4.547 -5.182 21.507 1.00 0.00 C ATOM 433 OD1 ASN A 28 -3.892 -6.174 21.827 1.00 0.00 O ATOM 434 ND2 ASN A 28 -5.743 -4.918 22.019 1.00 0.00 N ATOM 0 H ASN A 28 -1.216 -5.604 19.893 1.00 0.00 H new ATOM 0 HA ASN A 28 -3.361 -5.922 19.401 1.00 0.00 H new ATOM 0 HB2 ASN A 28 -3.447 -3.416 21.005 1.00 0.00 H new ATOM 0 HB3 ASN A 28 -4.850 -3.699 19.994 1.00 0.00 H new ATOM 0 HD21 ASN A 28 -6.154 -5.549 22.707 1.00 0.00 H new ATOM 0 HD22 ASN A 28 -6.251 -4.084 21.725 1.00 0.00 H new ATOM 441 N GLN A 29 -3.556 -2.939 18.011 1.00 0.00 N ATOM 442 CA GLN A 29 -3.812 -2.249 16.751 1.00 0.00 C ATOM 443 C GLN A 29 -2.595 -1.437 16.323 1.00 0.00 C ATOM 444 O GLN A 29 -2.097 -0.601 17.077 1.00 0.00 O ATOM 445 CB GLN A 29 -5.030 -1.333 16.884 1.00 0.00 C ATOM 446 CG GLN A 29 -6.347 -2.021 16.561 1.00 0.00 C ATOM 447 CD GLN A 29 -7.094 -1.351 15.423 1.00 0.00 C ATOM 448 OE1 GLN A 29 -7.983 -0.530 15.647 1.00 0.00 O ATOM 449 NE2 GLN A 29 -6.734 -1.700 14.193 1.00 0.00 N ATOM 0 H GLN A 29 -3.520 -2.328 18.827 1.00 0.00 H new ATOM 0 HA GLN A 29 -4.015 -3.000 15.987 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -5.073 -0.944 17.902 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -4.905 -0.477 16.221 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -6.154 -3.062 16.301 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -6.977 -2.026 17.450 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -5.991 -2.385 14.054 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -7.200 -1.283 13.387 1.00 0.00 H new ATOM 458 N VAL A 30 -2.113 -1.696 15.112 1.00 0.00 N ATOM 459 CA VAL A 30 -0.946 -0.995 14.590 1.00 0.00 C ATOM 460 C VAL A 30 -1.355 0.218 13.765 1.00 0.00 C ATOM 461 O VAL A 30 -2.274 0.145 12.950 1.00 0.00 O ATOM 462 CB VAL A 30 -0.075 -1.924 13.721 1.00 0.00 C ATOM 463 CG1 VAL A 30 1.212 -1.223 13.311 1.00 0.00 C ATOM 464 CG2 VAL A 30 0.227 -3.220 14.459 1.00 0.00 C ATOM 0 H VAL A 30 -2.512 -2.385 14.475 1.00 0.00 H new ATOM 0 HA VAL A 30 -0.365 -0.664 15.451 1.00 0.00 H new ATOM 0 HB VAL A 30 -0.631 -2.170 12.816 1.00 0.00 H new ATOM 0 HG11 VAL A 30 1.813 -1.895 12.698 1.00 0.00 H new ATOM 0 HG12 VAL A 30 0.972 -0.327 12.738 1.00 0.00 H new ATOM 0 HG13 VAL A 30 1.774 -0.944 14.202 1.00 0.00 H new ATOM 0 HG21 VAL A 30 0.843 -3.862 13.829 1.00 0.00 H new ATOM 0 HG22 VAL A 30 0.762 -2.997 15.382 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -0.707 -3.731 14.695 1.00 0.00 H new ATOM 474 N ARG A 31 -0.658 1.333 13.971 1.00 0.00 N ATOM 475 CA ARG A 31 -0.938 2.549 13.239 1.00 0.00 C ATOM 476 C ARG A 31 -0.240 2.518 11.885 1.00 0.00 C ATOM 477 O ARG A 31 0.983 2.613 11.803 1.00 0.00 O ATOM 478 CB ARG A 31 -0.497 3.777 14.039 1.00 0.00 C ATOM 479 CG ARG A 31 -1.599 4.810 14.221 1.00 0.00 C ATOM 480 CD ARG A 31 -2.103 4.845 15.656 1.00 0.00 C ATOM 481 NE ARG A 31 -3.546 5.065 15.723 1.00 0.00 N ATOM 482 CZ ARG A 31 -4.146 6.184 15.323 1.00 0.00 C ATOM 483 NH1 ARG A 31 -3.431 7.188 14.830 1.00 0.00 N ATOM 484 NH2 ARG A 31 -5.463 6.301 15.417 1.00 0.00 N ATOM 0 H ARG A 31 0.106 1.412 14.643 1.00 0.00 H new ATOM 0 HA ARG A 31 -2.014 2.616 13.079 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -0.146 3.455 15.019 1.00 0.00 H new ATOM 0 HB3 ARG A 31 0.349 4.245 13.535 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -1.225 5.795 13.942 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -2.427 4.582 13.550 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -1.856 3.905 16.150 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -1.590 5.637 16.202 1.00 0.00 H new ATOM 0 HE ARG A 31 -4.128 4.317 16.099 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -2.417 7.104 14.756 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -3.896 8.043 14.525 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -6.017 5.533 15.796 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -5.922 7.159 15.110 1.00 0.00 H new ATOM 498 N ILE A 32 -1.025 2.375 10.827 1.00 0.00 N ATOM 499 CA ILE A 32 -0.484 2.318 9.476 1.00 0.00 C ATOM 500 C ILE A 32 -0.472 3.697 8.826 1.00 0.00 C ATOM 501 O ILE A 32 -1.447 4.444 8.917 1.00 0.00 O ATOM 502 CB ILE A 32 -1.295 1.347 8.595 1.00 0.00 C ATOM 503 CG1 ILE A 32 -1.705 0.111 9.404 1.00 0.00 C ATOM 504 CG2 ILE A 32 -0.491 0.945 7.367 1.00 0.00 C ATOM 505 CD1 ILE A 32 -0.532 -0.733 9.854 1.00 0.00 C ATOM 0 H ILE A 32 -2.041 2.296 10.878 1.00 0.00 H new ATOM 0 HA ILE A 32 0.541 1.956 9.557 1.00 0.00 H new ATOM 0 HB ILE A 32 -2.200 1.854 8.259 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -2.269 0.431 10.280 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -2.374 -0.503 8.801 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -1.078 0.259 6.756 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -0.248 1.834 6.784 1.00 0.00 H new ATOM 0 HG23 ILE A 32 0.430 0.454 7.680 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -0.896 -1.590 10.421 1.00 0.00 H new ATOM 0 HD12 ILE A 32 0.020 -1.083 8.982 1.00 0.00 H new ATOM 0 HD13 ILE A 32 0.126 -0.135 10.484 1.00 0.00 H new ATOM 517 N GLY A 33 0.636 4.030 8.169 1.00 0.00 N ATOM 518 CA GLY A 33 0.749 5.319 7.514 1.00 0.00 C ATOM 519 C GLY A 33 0.743 5.198 6.006 1.00 0.00 C ATOM 520 O GLY A 33 1.692 4.685 5.418 1.00 0.00 O ATOM 0 H GLY A 33 1.456 3.430 8.079 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -0.076 5.958 7.829 1.00 0.00 H new ATOM 0 HA3 GLY A 33 1.670 5.807 7.834 1.00 0.00 H new ATOM 524 N VAL A 34 -0.327 5.668 5.374 1.00 0.00 N ATOM 525 CA VAL A 34 -0.430 5.597 3.923 1.00 0.00 C ATOM 526 C VAL A 34 -0.409 6.985 3.294 1.00 0.00 C ATOM 527 O VAL A 34 -1.407 7.706 3.319 1.00 0.00 O ATOM 528 CB VAL A 34 -1.718 4.872 3.488 1.00 0.00 C ATOM 529 CG1 VAL A 34 -1.688 4.576 1.996 1.00 0.00 C ATOM 530 CG2 VAL A 34 -1.908 3.592 4.288 1.00 0.00 C ATOM 0 H VAL A 34 -1.127 6.098 5.839 1.00 0.00 H new ATOM 0 HA VAL A 34 0.436 5.034 3.576 1.00 0.00 H new ATOM 0 HB VAL A 34 -2.565 5.528 3.688 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -2.606 4.064 1.708 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -1.605 5.511 1.441 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -0.832 3.941 1.768 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -2.823 3.094 3.966 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -1.058 2.930 4.123 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -1.980 3.833 5.349 1.00 0.00 H new ATOM 540 N ASN A 35 0.738 7.352 2.732 1.00 0.00 N ATOM 541 CA ASN A 35 0.888 8.655 2.096 1.00 0.00 C ATOM 542 C ASN A 35 0.552 8.571 0.612 1.00 0.00 C ATOM 543 O ASN A 35 1.312 8.013 -0.180 1.00 0.00 O ATOM 544 CB ASN A 35 2.314 9.177 2.283 1.00 0.00 C ATOM 545 CG ASN A 35 2.351 10.663 2.582 1.00 0.00 C ATOM 546 OD1 ASN A 35 2.675 11.076 3.695 1.00 0.00 O ATOM 547 ND2 ASN A 35 2.019 11.476 1.586 1.00 0.00 N ATOM 0 H ASN A 35 1.574 6.768 2.704 1.00 0.00 H new ATOM 0 HA ASN A 35 0.193 9.349 2.570 1.00 0.00 H new ATOM 0 HB2 ASN A 35 2.793 8.633 3.097 1.00 0.00 H new ATOM 0 HB3 ASN A 35 2.893 8.976 1.381 1.00 0.00 H new ATOM 0 HD21 ASN A 35 2.026 12.486 1.728 1.00 0.00 H new ATOM 0 HD22 ASN A 35 1.757 11.090 0.679 1.00 0.00 H new ATOM 554 N ALA A 36 -0.598 9.123 0.248 1.00 0.00 N ATOM 555 CA ALA A 36 -1.048 9.107 -1.138 1.00 0.00 C ATOM 556 C ALA A 36 -1.470 10.497 -1.606 1.00 0.00 C ATOM 557 O ALA A 36 -2.005 11.288 -0.829 1.00 0.00 O ATOM 558 CB ALA A 36 -2.196 8.123 -1.306 1.00 0.00 C ATOM 0 H ALA A 36 -1.237 9.588 0.893 1.00 0.00 H new ATOM 0 HA ALA A 36 -0.210 8.788 -1.758 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -2.523 8.120 -2.346 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -1.862 7.123 -1.028 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -3.026 8.420 -0.665 1.00 0.00 H new ATOM 564 N PRO A 37 -1.240 10.809 -2.894 1.00 0.00 N ATOM 565 CA PRO A 37 -1.602 12.103 -3.472 1.00 0.00 C ATOM 566 C PRO A 37 -3.092 12.195 -3.778 1.00 0.00 C ATOM 567 O PRO A 37 -3.761 11.178 -3.957 1.00 0.00 O ATOM 568 CB PRO A 37 -0.788 12.142 -4.763 1.00 0.00 C ATOM 569 CG PRO A 37 -0.667 10.714 -5.168 1.00 0.00 C ATOM 570 CD PRO A 37 -0.612 9.918 -3.890 1.00 0.00 C ATOM 0 HA PRO A 37 -1.397 12.933 -2.795 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -1.289 12.732 -5.531 1.00 0.00 H new ATOM 0 HB3 PRO A 37 0.191 12.594 -4.602 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -1.516 10.410 -5.780 1.00 0.00 H new ATOM 0 HG3 PRO A 37 0.230 10.554 -5.766 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -1.153 8.976 -3.982 1.00 0.00 H new ATOM 0 HD3 PRO A 37 0.414 9.671 -3.616 1.00 0.00 H new ATOM 578 N LYS A 38 -3.607 13.418 -3.836 1.00 0.00 N ATOM 579 CA LYS A 38 -5.020 13.636 -4.121 1.00 0.00 C ATOM 580 C LYS A 38 -5.259 13.806 -5.620 1.00 0.00 C ATOM 581 O LYS A 38 -6.081 14.622 -6.037 1.00 0.00 O ATOM 582 CB LYS A 38 -5.528 14.868 -3.370 1.00 0.00 C ATOM 583 CG LYS A 38 -5.938 14.578 -1.934 1.00 0.00 C ATOM 584 CD LYS A 38 -5.365 15.605 -0.970 1.00 0.00 C ATOM 585 CE LYS A 38 -3.953 15.241 -0.544 1.00 0.00 C ATOM 586 NZ LYS A 38 -3.437 16.157 0.511 1.00 0.00 N ATOM 0 H LYS A 38 -3.068 14.272 -3.690 1.00 0.00 H new ATOM 0 HA LYS A 38 -5.570 12.758 -3.783 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -4.749 15.630 -3.370 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -6.381 15.284 -3.906 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -7.025 14.575 -1.859 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -5.596 13.582 -1.651 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -5.362 16.587 -1.443 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -6.005 15.677 -0.090 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -3.939 14.216 -0.173 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -3.292 15.276 -1.410 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -2.471 15.875 0.774 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -3.426 17.132 0.149 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -4.053 16.105 1.348 1.00 0.00 H new ATOM 600 N GLU A 39 -4.537 13.033 -6.428 1.00 0.00 N ATOM 601 CA GLU A 39 -4.676 13.104 -7.879 1.00 0.00 C ATOM 602 C GLU A 39 -5.027 11.738 -8.465 1.00 0.00 C ATOM 603 O GLU A 39 -5.827 11.641 -9.396 1.00 0.00 O ATOM 604 CB GLU A 39 -3.382 13.623 -8.509 1.00 0.00 C ATOM 605 CG GLU A 39 -3.197 15.125 -8.369 1.00 0.00 C ATOM 606 CD GLU A 39 -3.671 15.888 -9.591 1.00 0.00 C ATOM 607 OE1 GLU A 39 -3.501 15.372 -10.715 1.00 0.00 O ATOM 608 OE2 GLU A 39 -4.211 17.001 -9.423 1.00 0.00 O ATOM 0 H GLU A 39 -3.851 12.352 -6.103 1.00 0.00 H new ATOM 0 HA GLU A 39 -5.489 13.794 -8.106 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -2.534 13.116 -8.048 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -3.372 13.361 -9.567 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -3.743 15.474 -7.493 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -2.143 15.343 -8.196 1.00 0.00 H new ATOM 615 N VAL A 40 -4.427 10.684 -7.916 1.00 0.00 N ATOM 616 CA VAL A 40 -4.684 9.328 -8.390 1.00 0.00 C ATOM 617 C VAL A 40 -5.947 8.757 -7.753 1.00 0.00 C ATOM 618 O VAL A 40 -6.369 9.198 -6.684 1.00 0.00 O ATOM 619 CB VAL A 40 -3.498 8.386 -8.095 1.00 0.00 C ATOM 620 CG1 VAL A 40 -3.635 7.093 -8.883 1.00 0.00 C ATOM 621 CG2 VAL A 40 -2.177 9.072 -8.411 1.00 0.00 C ATOM 0 H VAL A 40 -3.762 10.743 -7.145 1.00 0.00 H new ATOM 0 HA VAL A 40 -4.819 9.392 -9.470 1.00 0.00 H new ATOM 0 HB VAL A 40 -3.509 8.142 -7.033 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -2.790 6.441 -8.662 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -4.562 6.593 -8.603 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -3.652 7.317 -9.950 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -1.353 8.391 -8.196 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -2.154 9.349 -9.465 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -2.077 9.968 -7.798 1.00 0.00 H new ATOM 631 N SER A 41 -6.549 7.777 -8.419 1.00 0.00 N ATOM 632 CA SER A 41 -7.768 7.147 -7.922 1.00 0.00 C ATOM 633 C SER A 41 -7.560 6.569 -6.525 1.00 0.00 C ATOM 634 O SER A 41 -6.779 5.636 -6.338 1.00 0.00 O ATOM 635 CB SER A 41 -8.222 6.044 -8.879 1.00 0.00 C ATOM 636 OG SER A 41 -9.590 5.729 -8.681 1.00 0.00 O ATOM 0 H SER A 41 -6.212 7.401 -9.305 1.00 0.00 H new ATOM 0 HA SER A 41 -8.541 7.913 -7.864 1.00 0.00 H new ATOM 0 HB2 SER A 41 -8.065 6.364 -9.909 1.00 0.00 H new ATOM 0 HB3 SER A 41 -7.614 5.152 -8.726 1.00 0.00 H new ATOM 0 HG SER A 41 -9.857 5.023 -9.306 1.00 0.00 H new ATOM 642 N VAL A 42 -8.267 7.129 -5.548 1.00 0.00 N ATOM 643 CA VAL A 42 -8.165 6.669 -4.168 1.00 0.00 C ATOM 644 C VAL A 42 -9.530 6.231 -3.636 1.00 0.00 C ATOM 645 O VAL A 42 -10.475 7.019 -3.611 1.00 0.00 O ATOM 646 CB VAL A 42 -7.592 7.768 -3.251 1.00 0.00 C ATOM 647 CG1 VAL A 42 -8.497 8.990 -3.245 1.00 0.00 C ATOM 648 CG2 VAL A 42 -7.390 7.237 -1.839 1.00 0.00 C ATOM 0 H VAL A 42 -8.917 7.903 -5.687 1.00 0.00 H new ATOM 0 HA VAL A 42 -7.486 5.816 -4.164 1.00 0.00 H new ATOM 0 HB VAL A 42 -6.621 8.069 -3.643 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -8.074 9.753 -2.592 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -8.581 9.385 -4.257 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -9.485 8.709 -2.882 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -6.985 8.028 -1.207 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -8.346 6.904 -1.435 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -6.694 6.398 -1.862 1.00 0.00 H new ATOM 658 N HIS A 43 -9.624 4.977 -3.202 1.00 0.00 N ATOM 659 CA HIS A 43 -10.869 4.445 -2.659 1.00 0.00 C ATOM 660 C HIS A 43 -10.624 3.786 -1.305 1.00 0.00 C ATOM 661 O HIS A 43 -9.815 2.865 -1.196 1.00 0.00 O ATOM 662 CB HIS A 43 -11.488 3.438 -3.632 1.00 0.00 C ATOM 663 CG HIS A 43 -12.908 3.748 -3.989 1.00 0.00 C ATOM 664 ND1 HIS A 43 -13.428 5.025 -3.972 1.00 0.00 N ATOM 665 CD2 HIS A 43 -13.923 2.938 -4.375 1.00 0.00 C ATOM 666 CE1 HIS A 43 -14.698 4.989 -4.330 1.00 0.00 C ATOM 667 NE2 HIS A 43 -15.024 3.734 -4.581 1.00 0.00 N ATOM 0 H HIS A 43 -8.852 4.310 -3.216 1.00 0.00 H new ATOM 0 HA HIS A 43 -11.565 5.273 -2.522 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -10.890 3.411 -4.543 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -11.442 2.443 -3.190 1.00 0.00 H new ATOM 0 HD2 HIS A 43 -13.876 1.866 -4.498 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -15.358 5.841 -4.405 1.00 0.00 H new ATOM 0 HE2 HIS A 43 -15.944 3.409 -4.879 1.00 0.00 H new ATOM 675 N ARG A 44 -11.319 4.256 -0.274 1.00 0.00 N ATOM 676 CA ARG A 44 -11.158 3.698 1.064 1.00 0.00 C ATOM 677 C ARG A 44 -12.313 4.112 1.973 1.00 0.00 C ATOM 678 O ARG A 44 -13.221 3.323 2.235 1.00 0.00 O ATOM 679 CB ARG A 44 -9.822 4.146 1.664 1.00 0.00 C ATOM 680 CG ARG A 44 -9.586 3.650 3.082 1.00 0.00 C ATOM 681 CD ARG A 44 -8.747 4.635 3.880 1.00 0.00 C ATOM 682 NE ARG A 44 -7.349 4.632 3.454 1.00 0.00 N ATOM 683 CZ ARG A 44 -6.532 5.677 3.577 1.00 0.00 C ATOM 684 NH1 ARG A 44 -6.962 6.809 4.119 1.00 0.00 N ATOM 685 NH2 ARG A 44 -5.277 5.587 3.157 1.00 0.00 N ATOM 0 H ARG A 44 -11.995 5.017 -0.338 1.00 0.00 H new ATOM 0 HA ARG A 44 -11.164 2.611 0.984 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -9.012 3.792 1.026 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -9.780 5.235 1.659 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -10.543 3.498 3.580 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -9.085 2.683 3.052 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -9.159 5.638 3.766 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -8.804 4.385 4.939 1.00 0.00 H new ATOM 0 HE ARG A 44 -6.977 3.779 3.038 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -7.925 6.884 4.446 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -6.329 7.604 4.209 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -4.939 4.719 2.741 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -4.650 6.386 3.250 1.00 0.00 H new ATOM 699 N GLU A 45 -12.273 5.352 2.452 1.00 0.00 N ATOM 700 CA GLU A 45 -13.317 5.865 3.332 1.00 0.00 C ATOM 701 C GLU A 45 -13.399 7.386 3.249 1.00 0.00 C ATOM 702 O GLU A 45 -12.384 8.078 3.335 1.00 0.00 O ATOM 703 CB GLU A 45 -13.053 5.435 4.776 1.00 0.00 C ATOM 704 CG GLU A 45 -13.614 4.064 5.115 1.00 0.00 C ATOM 705 CD GLU A 45 -15.116 3.985 4.927 1.00 0.00 C ATOM 706 OE1 GLU A 45 -15.561 3.770 3.780 1.00 0.00 O ATOM 707 OE2 GLU A 45 -15.848 4.140 5.928 1.00 0.00 O ATOM 0 H GLU A 45 -11.530 6.019 2.246 1.00 0.00 H new ATOM 0 HA GLU A 45 -14.270 5.449 3.005 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -11.978 5.433 4.955 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -13.487 6.173 5.451 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -13.133 3.314 4.487 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -13.368 3.820 6.148 1.00 0.00 H new ATOM 714 N GLU A 46 -14.613 7.900 3.079 1.00 0.00 N ATOM 715 CA GLU A 46 -14.829 9.340 2.981 1.00 0.00 C ATOM 716 C GLU A 46 -14.303 10.063 4.218 1.00 0.00 C ATOM 717 O GLU A 46 -13.554 11.033 4.108 1.00 0.00 O ATOM 718 CB GLU A 46 -16.317 9.642 2.792 1.00 0.00 C ATOM 719 CG GLU A 46 -17.208 9.007 3.847 1.00 0.00 C ATOM 720 CD GLU A 46 -18.575 8.634 3.308 1.00 0.00 C ATOM 721 OE1 GLU A 46 -19.046 9.307 2.368 1.00 0.00 O ATOM 722 OE2 GLU A 46 -19.174 7.668 3.827 1.00 0.00 O ATOM 0 H GLU A 46 -15.463 7.341 3.006 1.00 0.00 H new ATOM 0 HA GLU A 46 -14.277 9.703 2.114 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -16.464 10.722 2.807 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -16.628 9.291 1.808 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -16.721 8.115 4.240 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -17.327 9.699 4.681 1.00 0.00 H new ATOM 729 N ILE A 47 -14.701 9.588 5.395 1.00 0.00 N ATOM 730 CA ILE A 47 -14.268 10.195 6.648 1.00 0.00 C ATOM 731 C ILE A 47 -12.755 10.083 6.821 1.00 0.00 C ATOM 732 O ILE A 47 -12.094 11.030 7.251 1.00 0.00 O ATOM 733 CB ILE A 47 -14.969 9.543 7.858 1.00 0.00 C ATOM 734 CG1 ILE A 47 -14.575 10.257 9.153 1.00 0.00 C ATOM 735 CG2 ILE A 47 -14.630 8.062 7.938 1.00 0.00 C ATOM 736 CD1 ILE A 47 -15.273 9.711 10.380 1.00 0.00 C ATOM 0 H ILE A 47 -15.321 8.786 5.506 1.00 0.00 H new ATOM 0 HA ILE A 47 -14.545 11.248 6.604 1.00 0.00 H new ATOM 0 HB ILE A 47 -16.047 9.640 7.726 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -13.497 10.174 9.291 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -14.803 11.319 9.057 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -15.133 7.619 8.798 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -14.961 7.563 7.027 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -13.552 7.941 8.047 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -14.946 10.264 11.261 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -16.351 9.819 10.263 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -15.025 8.657 10.501 1.00 0.00 H new ATOM 748 N TYR A 48 -12.213 8.917 6.481 1.00 0.00 N ATOM 749 CA TYR A 48 -10.779 8.672 6.597 1.00 0.00 C ATOM 750 C TYR A 48 -9.974 9.781 5.924 1.00 0.00 C ATOM 751 O TYR A 48 -9.091 10.382 6.539 1.00 0.00 O ATOM 752 CB TYR A 48 -10.420 7.319 5.979 1.00 0.00 C ATOM 753 CG TYR A 48 -10.641 6.148 6.910 1.00 0.00 C ATOM 754 CD1 TYR A 48 -11.865 5.956 7.537 1.00 0.00 C ATOM 755 CD2 TYR A 48 -9.625 5.234 7.162 1.00 0.00 C ATOM 756 CE1 TYR A 48 -12.071 4.887 8.389 1.00 0.00 C ATOM 757 CE2 TYR A 48 -9.823 4.163 8.012 1.00 0.00 C ATOM 758 CZ TYR A 48 -11.047 3.995 8.624 1.00 0.00 C ATOM 759 OH TYR A 48 -11.248 2.930 9.472 1.00 0.00 O ATOM 0 H TYR A 48 -12.747 8.125 6.122 1.00 0.00 H new ATOM 0 HA TYR A 48 -10.526 8.660 7.657 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -11.014 7.172 5.077 1.00 0.00 H new ATOM 0 HB3 TYR A 48 -9.374 7.336 5.672 1.00 0.00 H new ATOM 0 HD1 TYR A 48 -12.669 6.653 7.356 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -8.664 5.363 6.685 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -13.029 4.752 8.868 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -9.023 3.461 8.196 1.00 0.00 H new ATOM 0 HH TYR A 48 -10.472 2.333 9.437 1.00 0.00 H new ATOM 769 N GLN A 49 -10.284 10.049 4.660 1.00 0.00 N ATOM 770 CA GLN A 49 -9.587 11.085 3.907 1.00 0.00 C ATOM 771 C GLN A 49 -10.096 12.475 4.282 1.00 0.00 C ATOM 772 O GLN A 49 -9.404 13.470 4.079 1.00 0.00 O ATOM 773 CB GLN A 49 -9.762 10.855 2.405 1.00 0.00 C ATOM 774 CG GLN A 49 -9.044 9.617 1.891 1.00 0.00 C ATOM 775 CD GLN A 49 -8.283 9.874 0.605 1.00 0.00 C ATOM 776 OE1 GLN A 49 -7.163 9.394 0.427 1.00 0.00 O ATOM 777 NE2 GLN A 49 -8.888 10.634 -0.300 1.00 0.00 N ATOM 0 H GLN A 49 -11.012 9.564 4.136 1.00 0.00 H new ATOM 0 HA GLN A 49 -8.528 11.028 4.159 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -10.825 10.768 2.181 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -9.393 11.728 1.867 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -8.351 9.261 2.653 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -9.772 8.822 1.725 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -9.817 11.011 -0.111 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -8.424 10.841 -1.185 1.00 0.00 H new ATOM 786 N ARG A 50 -11.306 12.541 4.828 1.00 0.00 N ATOM 787 CA ARG A 50 -11.891 13.814 5.226 1.00 0.00 C ATOM 788 C ARG A 50 -11.218 14.362 6.483 1.00 0.00 C ATOM 789 O ARG A 50 -11.370 15.538 6.815 1.00 0.00 O ATOM 790 CB ARG A 50 -13.393 13.657 5.466 1.00 0.00 C ATOM 791 CG ARG A 50 -14.225 13.724 4.195 1.00 0.00 C ATOM 792 CD ARG A 50 -15.622 13.162 4.410 1.00 0.00 C ATOM 793 NE ARG A 50 -16.659 14.077 3.938 1.00 0.00 N ATOM 794 CZ ARG A 50 -17.939 13.991 4.291 1.00 0.00 C ATOM 795 NH1 ARG A 50 -18.345 13.036 5.119 1.00 0.00 N ATOM 796 NH2 ARG A 50 -18.817 14.864 3.816 1.00 0.00 N ATOM 0 H ARG A 50 -11.898 11.730 5.004 1.00 0.00 H new ATOM 0 HA ARG A 50 -11.730 14.524 4.415 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -13.575 12.702 5.959 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -13.726 14.438 6.150 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -14.296 14.759 3.860 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -13.726 13.166 3.403 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -15.714 12.210 3.888 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -15.772 12.960 5.471 1.00 0.00 H new ATOM 0 HE ARG A 50 -16.386 14.825 3.301 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -17.674 12.362 5.489 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -19.328 12.976 5.385 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -18.511 15.601 3.180 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -19.798 14.799 4.086 1.00 0.00 H new ATOM 810 N ILE A 51 -10.477 13.507 7.182 1.00 0.00 N ATOM 811 CA ILE A 51 -9.787 13.915 8.400 1.00 0.00 C ATOM 812 C ILE A 51 -8.275 13.964 8.192 1.00 0.00 C ATOM 813 O ILE A 51 -7.573 14.716 8.868 1.00 0.00 O ATOM 814 CB ILE A 51 -10.105 12.965 9.571 1.00 0.00 C ATOM 815 CG1 ILE A 51 -11.618 12.815 9.739 1.00 0.00 C ATOM 816 CG2 ILE A 51 -9.474 13.475 10.859 1.00 0.00 C ATOM 817 CD1 ILE A 51 -12.016 11.652 10.622 1.00 0.00 C ATOM 0 H ILE A 51 -10.340 12.529 6.926 1.00 0.00 H new ATOM 0 HA ILE A 51 -10.146 14.915 8.645 1.00 0.00 H new ATOM 0 HB ILE A 51 -9.682 11.986 9.346 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -12.022 13.736 10.161 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -12.074 12.688 8.757 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -9.709 12.792 11.675 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -8.393 13.534 10.736 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -9.868 14.465 11.090 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -13.103 11.607 10.696 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -11.643 10.723 10.191 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -11.590 11.787 11.616 1.00 0.00 H new ATOM 829 N GLN A 52 -7.778 13.159 7.257 1.00 0.00 N ATOM 830 CA GLN A 52 -6.347 13.117 6.971 1.00 0.00 C ATOM 831 C GLN A 52 -6.030 13.778 5.632 1.00 0.00 C ATOM 832 O GLN A 52 -5.199 14.683 5.557 1.00 0.00 O ATOM 833 CB GLN A 52 -5.852 11.670 6.968 1.00 0.00 C ATOM 834 CG GLN A 52 -5.427 11.170 8.339 1.00 0.00 C ATOM 835 CD GLN A 52 -6.593 11.041 9.299 1.00 0.00 C ATOM 836 OE1 GLN A 52 -7.411 10.129 9.182 1.00 0.00 O ATOM 837 NE2 GLN A 52 -6.675 11.958 10.257 1.00 0.00 N ATOM 0 H GLN A 52 -8.342 12.529 6.687 1.00 0.00 H new ATOM 0 HA GLN A 52 -5.832 13.673 7.755 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -6.642 11.025 6.584 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -5.009 11.584 6.282 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -4.939 10.201 8.233 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -4.689 11.854 8.759 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -5.975 12.697 10.317 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -7.438 11.923 10.933 1.00 0.00 H new ATOM 846 N ALA A 53 -6.694 13.317 4.578 1.00 0.00 N ATOM 847 CA ALA A 53 -6.481 13.860 3.242 1.00 0.00 C ATOM 848 C ALA A 53 -6.916 15.320 3.162 1.00 0.00 C ATOM 849 O ALA A 53 -6.082 16.224 3.110 1.00 0.00 O ATOM 850 CB ALA A 53 -7.228 13.026 2.210 1.00 0.00 C ATOM 0 H ALA A 53 -7.385 12.568 4.623 1.00 0.00 H new ATOM 0 HA ALA A 53 -5.413 13.817 3.026 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -7.061 13.442 1.216 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -6.864 11.999 2.240 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -8.295 13.039 2.434 1.00 0.00 H new ATOM 856 N GLU A 54 -8.226 15.543 3.153 1.00 0.00 N ATOM 857 CA GLU A 54 -8.773 16.892 3.081 1.00 0.00 C ATOM 858 C GLU A 54 -9.465 17.266 4.388 1.00 0.00 C ATOM 859 O GLU A 54 -10.371 16.570 4.843 1.00 0.00 O ATOM 860 CB GLU A 54 -9.757 17.005 1.916 1.00 0.00 C ATOM 861 CG GLU A 54 -10.028 18.438 1.486 1.00 0.00 C ATOM 862 CD GLU A 54 -11.256 18.560 0.606 1.00 0.00 C ATOM 863 OE1 GLU A 54 -12.361 18.222 1.079 1.00 0.00 O ATOM 864 OE2 GLU A 54 -11.113 18.995 -0.557 1.00 0.00 O ATOM 0 H GLU A 54 -8.929 14.805 3.195 1.00 0.00 H new ATOM 0 HA GLU A 54 -7.948 17.585 2.916 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -9.366 16.447 1.065 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -10.699 16.535 2.200 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -10.157 19.061 2.371 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -9.161 18.822 0.949 1.00 0.00 H new ATOM 871 N LYS A 55 -9.026 18.369 4.985 1.00 0.00 N ATOM 872 CA LYS A 55 -9.587 18.843 6.234 1.00 0.00 C ATOM 873 C LYS A 55 -11.071 19.164 6.088 1.00 0.00 C ATOM 874 O LYS A 55 -11.442 20.289 5.754 1.00 0.00 O ATOM 875 CB LYS A 55 -8.829 20.080 6.721 1.00 0.00 C ATOM 876 CG LYS A 55 -8.560 20.077 8.217 1.00 0.00 C ATOM 877 CD LYS A 55 -8.876 21.425 8.846 1.00 0.00 C ATOM 878 CE LYS A 55 -7.820 21.826 9.864 1.00 0.00 C ATOM 879 NZ LYS A 55 -8.051 23.200 10.391 1.00 0.00 N ATOM 0 H LYS A 55 -8.276 18.953 4.615 1.00 0.00 H new ATOM 0 HA LYS A 55 -9.483 18.046 6.971 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -7.880 20.147 6.189 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -9.402 20.971 6.465 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -9.161 19.303 8.694 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -7.515 19.826 8.399 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -8.939 22.185 8.067 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -9.852 21.382 9.330 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -7.823 21.115 10.690 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -6.833 21.775 9.403 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -7.310 23.436 11.082 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -8.023 23.882 9.606 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -8.982 23.243 10.853 1.00 0.00 H new ATOM 983 N MET B 1 -0.641 11.787 3.351 1.00 0.00 N ATOM 984 CA MET B 1 -0.148 11.438 4.709 1.00 0.00 C ATOM 985 C MET B 1 -1.307 11.200 5.672 1.00 0.00 C ATOM 986 O MET B 1 -1.643 12.066 6.479 1.00 0.00 O ATOM 987 CB MET B 1 0.733 12.581 5.216 1.00 0.00 C ATOM 988 CG MET B 1 1.437 12.271 6.527 1.00 0.00 C ATOM 989 SD MET B 1 3.088 12.990 6.616 1.00 0.00 S ATOM 990 CE MET B 1 3.222 13.316 8.372 1.00 0.00 C ATOM 0 H1 MET B 1 0.097 12.309 2.837 1.00 0.00 H new ATOM 0 H2 MET B 1 -0.875 10.916 2.832 1.00 0.00 H new ATOM 0 H3 MET B 1 -1.491 12.381 3.432 1.00 0.00 H new ATOM 0 HA MET B 1 0.428 10.514 4.654 1.00 0.00 H new ATOM 0 HB2 MET B 1 1.481 12.816 4.458 1.00 0.00 H new ATOM 0 HB3 MET B 1 0.119 13.472 5.345 1.00 0.00 H new ATOM 0 HG2 MET B 1 0.836 12.647 7.355 1.00 0.00 H new ATOM 0 HG3 MET B 1 1.509 11.190 6.650 1.00 0.00 H new ATOM 0 HE1 MET B 1 4.193 13.763 8.586 1.00 0.00 H new ATOM 0 HE2 MET B 1 2.431 14.002 8.676 1.00 0.00 H new ATOM 0 HE3 MET B 1 3.124 12.381 8.924 1.00 0.00 H new ATOM 1002 N LEU B 2 -1.915 10.021 5.581 1.00 0.00 N ATOM 1003 CA LEU B 2 -3.038 9.675 6.446 1.00 0.00 C ATOM 1004 C LEU B 2 -2.675 8.524 7.379 1.00 0.00 C ATOM 1005 O LEU B 2 -2.645 7.365 6.965 1.00 0.00 O ATOM 1006 CB LEU B 2 -4.257 9.290 5.604 1.00 0.00 C ATOM 1007 CG LEU B 2 -4.452 10.113 4.330 1.00 0.00 C ATOM 1008 CD1 LEU B 2 -3.693 9.488 3.170 1.00 0.00 C ATOM 1009 CD2 LEU B 2 -5.932 10.236 3.997 1.00 0.00 C ATOM 0 H LEU B 2 -1.650 9.291 4.919 1.00 0.00 H new ATOM 0 HA LEU B 2 -3.278 10.550 7.050 1.00 0.00 H new ATOM 0 HB2 LEU B 2 -4.172 8.239 5.329 1.00 0.00 H new ATOM 0 HB3 LEU B 2 -5.150 9.387 6.221 1.00 0.00 H new ATOM 0 HG LEU B 2 -4.054 11.113 4.501 1.00 0.00 H new ATOM 0 HD11 LEU B 2 -3.843 10.087 2.272 1.00 0.00 H new ATOM 0 HD12 LEU B 2 -2.630 9.452 3.408 1.00 0.00 H new ATOM 0 HD13 LEU B 2 -4.061 8.477 2.997 1.00 0.00 H new ATOM 0 HD21 LEU B 2 -6.053 10.825 3.088 1.00 0.00 H new ATOM 0 HD22 LEU B 2 -6.355 9.243 3.845 1.00 0.00 H new ATOM 0 HD23 LEU B 2 -6.450 10.729 4.820 1.00 0.00 H new ATOM 1021 N ILE B 3 -2.400 8.847 8.640 1.00 0.00 N ATOM 1022 CA ILE B 3 -2.044 7.828 9.619 1.00 0.00 C ATOM 1023 C ILE B 3 -3.278 7.342 10.375 1.00 0.00 C ATOM 1024 O ILE B 3 -3.811 8.034 11.243 1.00 0.00 O ATOM 1025 CB ILE B 3 -0.973 8.335 10.613 1.00 0.00 C ATOM 1026 CG1 ILE B 3 -0.419 7.173 11.442 1.00 0.00 C ATOM 1027 CG2 ILE B 3 -1.536 9.422 11.518 1.00 0.00 C ATOM 1028 CD1 ILE B 3 1.054 7.311 11.772 1.00 0.00 C ATOM 0 H ILE B 3 -2.417 9.799 9.005 1.00 0.00 H new ATOM 0 HA ILE B 3 -1.618 6.990 9.068 1.00 0.00 H new ATOM 0 HB ILE B 3 -0.156 8.770 10.038 1.00 0.00 H new ATOM 0 HG12 ILE B 3 -0.985 7.098 12.370 1.00 0.00 H new ATOM 0 HG13 ILE B 3 -0.575 6.242 10.897 1.00 0.00 H new ATOM 0 HG21 ILE B 3 -0.761 9.760 12.206 1.00 0.00 H new ATOM 0 HG22 ILE B 3 -1.873 10.262 10.911 1.00 0.00 H new ATOM 0 HG23 ILE B 3 -2.377 9.024 12.085 1.00 0.00 H new ATOM 0 HD11 ILE B 3 1.377 6.452 12.361 1.00 0.00 H new ATOM 0 HD12 ILE B 3 1.631 7.356 10.848 1.00 0.00 H new ATOM 0 HD13 ILE B 3 1.215 8.224 12.345 1.00 0.00 H new ATOM 1040 N LEU B 4 -3.718 6.136 10.036 1.00 0.00 N ATOM 1041 CA LEU B 4 -4.878 5.523 10.671 1.00 0.00 C ATOM 1042 C LEU B 4 -4.499 4.164 11.248 1.00 0.00 C ATOM 1043 O LEU B 4 -3.544 3.540 10.792 1.00 0.00 O ATOM 1044 CB LEU B 4 -6.021 5.374 9.664 1.00 0.00 C ATOM 1045 CG LEU B 4 -7.341 6.028 10.084 1.00 0.00 C ATOM 1046 CD1 LEU B 4 -7.896 6.887 8.958 1.00 0.00 C ATOM 1047 CD2 LEU B 4 -8.354 4.970 10.498 1.00 0.00 C ATOM 0 H LEU B 4 -3.283 5.558 9.317 1.00 0.00 H new ATOM 0 HA LEU B 4 -5.216 6.168 11.482 1.00 0.00 H new ATOM 0 HB2 LEU B 4 -5.706 5.804 8.713 1.00 0.00 H new ATOM 0 HB3 LEU B 4 -6.197 4.312 9.491 1.00 0.00 H new ATOM 0 HG LEU B 4 -7.146 6.672 10.942 1.00 0.00 H new ATOM 0 HD11 LEU B 4 -8.834 7.343 9.276 1.00 0.00 H new ATOM 0 HD12 LEU B 4 -7.179 7.669 8.709 1.00 0.00 H new ATOM 0 HD13 LEU B 4 -8.074 6.266 8.080 1.00 0.00 H new ATOM 0 HD21 LEU B 4 -9.285 5.454 10.793 1.00 0.00 H new ATOM 0 HD22 LEU B 4 -8.543 4.299 9.660 1.00 0.00 H new ATOM 0 HD23 LEU B 4 -7.960 4.398 11.338 1.00 0.00 H new ATOM 1059 N THR B 5 -5.251 3.695 12.237 1.00 0.00 N ATOM 1060 CA THR B 5 -4.970 2.396 12.838 1.00 0.00 C ATOM 1061 C THR B 5 -5.663 1.287 12.060 1.00 0.00 C ATOM 1062 O THR B 5 -6.814 1.432 11.649 1.00 0.00 O ATOM 1063 CB THR B 5 -5.417 2.359 14.299 1.00 0.00 C ATOM 1064 OG1 THR B 5 -5.709 3.662 14.773 1.00 0.00 O ATOM 1065 CG2 THR B 5 -4.378 1.755 15.217 1.00 0.00 C ATOM 0 H THR B 5 -6.050 4.187 12.636 1.00 0.00 H new ATOM 0 HA THR B 5 -3.892 2.238 12.801 1.00 0.00 H new ATOM 0 HB THR B 5 -6.308 1.732 14.316 1.00 0.00 H new ATOM 0 HG1 THR B 5 -6.345 3.605 15.517 1.00 0.00 H new ATOM 0 HG21 THR B 5 -4.752 1.756 16.241 1.00 0.00 H new ATOM 0 HG22 THR B 5 -4.170 0.731 14.908 1.00 0.00 H new ATOM 0 HG23 THR B 5 -3.461 2.342 15.165 1.00 0.00 H new ATOM 1073 N ARG B 6 -4.958 0.181 11.862 1.00 0.00 N ATOM 1074 CA ARG B 6 -5.513 -0.948 11.131 1.00 0.00 C ATOM 1075 C ARG B 6 -4.909 -2.265 11.605 1.00 0.00 C ATOM 1076 O ARG B 6 -3.734 -2.329 11.974 1.00 0.00 O ATOM 1077 CB ARG B 6 -5.273 -0.780 9.630 1.00 0.00 C ATOM 1078 CG ARG B 6 -5.969 0.430 9.029 1.00 0.00 C ATOM 1079 CD ARG B 6 -5.075 1.660 9.052 1.00 0.00 C ATOM 1080 NE ARG B 6 -4.782 2.148 7.706 1.00 0.00 N ATOM 1081 CZ ARG B 6 -5.623 2.888 6.986 1.00 0.00 C ATOM 1082 NH1 ARG B 6 -6.810 3.223 7.477 1.00 0.00 N ATOM 1083 NH2 ARG B 6 -5.277 3.293 5.772 1.00 0.00 N ATOM 0 H ARG B 6 -4.004 0.043 12.196 1.00 0.00 H new ATOM 0 HA ARG B 6 -6.585 -0.973 11.324 1.00 0.00 H new ATOM 0 HB2 ARG B 6 -4.201 -0.698 9.450 1.00 0.00 H new ATOM 0 HB3 ARG B 6 -5.615 -1.677 9.114 1.00 0.00 H new ATOM 0 HG2 ARG B 6 -6.260 0.210 8.002 1.00 0.00 H new ATOM 0 HG3 ARG B 6 -6.885 0.635 9.582 1.00 0.00 H new ATOM 0 HD2 ARG B 6 -5.559 2.450 9.627 1.00 0.00 H new ATOM 0 HD3 ARG B 6 -4.142 1.421 9.562 1.00 0.00 H new ATOM 0 HE ARG B 6 -3.880 1.908 7.294 1.00 0.00 H new ATOM 0 HH11 ARG B 6 -7.082 2.913 8.410 1.00 0.00 H new ATOM 0 HH12 ARG B 6 -7.450 3.790 6.921 1.00 0.00 H new ATOM 0 HH21 ARG B 6 -4.367 3.038 5.389 1.00 0.00 H new ATOM 0 HH22 ARG B 6 -5.921 3.860 5.221 1.00 0.00 H new ATOM 1097 N ARG B 7 -5.726 -3.312 11.586 1.00 0.00 N ATOM 1098 CA ARG B 7 -5.286 -4.641 12.005 1.00 0.00 C ATOM 1099 C ARG B 7 -6.405 -5.682 11.879 1.00 0.00 C ATOM 1100 O ARG B 7 -6.277 -6.800 12.374 1.00 0.00 O ATOM 1101 CB ARG B 7 -4.778 -4.599 13.447 1.00 0.00 C ATOM 1102 CG ARG B 7 -4.220 -5.925 13.939 1.00 0.00 C ATOM 1103 CD ARG B 7 -4.925 -6.390 15.204 1.00 0.00 C ATOM 1104 NE ARG B 7 -6.154 -7.125 14.912 1.00 0.00 N ATOM 1105 CZ ARG B 7 -7.091 -7.392 15.819 1.00 0.00 C ATOM 1106 NH1 ARG B 7 -6.945 -6.985 17.075 1.00 0.00 N ATOM 1107 NH2 ARG B 7 -8.178 -8.065 15.470 1.00 0.00 N ATOM 0 H ARG B 7 -6.699 -3.268 11.284 1.00 0.00 H new ATOM 0 HA ARG B 7 -4.476 -4.940 11.340 1.00 0.00 H new ATOM 0 HB2 ARG B 7 -4.003 -3.837 13.527 1.00 0.00 H new ATOM 0 HB3 ARG B 7 -5.594 -4.294 14.101 1.00 0.00 H new ATOM 0 HG2 ARG B 7 -4.332 -6.680 13.160 1.00 0.00 H new ATOM 0 HG3 ARG B 7 -3.152 -5.822 14.133 1.00 0.00 H new ATOM 0 HD2 ARG B 7 -4.252 -7.025 15.781 1.00 0.00 H new ATOM 0 HD3 ARG B 7 -5.159 -5.526 15.826 1.00 0.00 H new ATOM 0 HE ARG B 7 -6.302 -7.452 13.957 1.00 0.00 H new ATOM 0 HH11 ARG B 7 -6.111 -6.465 17.349 1.00 0.00 H new ATOM 0 HH12 ARG B 7 -7.666 -7.193 17.766 1.00 0.00 H new ATOM 0 HH21 ARG B 7 -8.296 -8.378 14.507 1.00 0.00 H new ATOM 0 HH22 ARG B 7 -8.896 -8.270 16.165 1.00 0.00 H new ATOM 1121 N VAL B 8 -7.503 -5.320 11.221 1.00 0.00 N ATOM 1122 CA VAL B 8 -8.621 -6.241 11.056 1.00 0.00 C ATOM 1123 C VAL B 8 -9.048 -6.345 9.596 1.00 0.00 C ATOM 1124 O VAL B 8 -9.343 -7.434 9.105 1.00 0.00 O ATOM 1125 CB VAL B 8 -9.827 -5.810 11.910 1.00 0.00 C ATOM 1126 CG1 VAL B 8 -10.913 -6.875 11.880 1.00 0.00 C ATOM 1127 CG2 VAL B 8 -9.387 -5.525 13.339 1.00 0.00 C ATOM 0 H VAL B 8 -7.641 -4.403 10.797 1.00 0.00 H new ATOM 0 HA VAL B 8 -8.277 -7.219 11.392 1.00 0.00 H new ATOM 0 HB VAL B 8 -10.241 -4.894 11.489 1.00 0.00 H new ATOM 0 HG11 VAL B 8 -11.757 -6.552 12.490 1.00 0.00 H new ATOM 0 HG12 VAL B 8 -11.245 -7.028 10.853 1.00 0.00 H new ATOM 0 HG13 VAL B 8 -10.517 -7.810 12.276 1.00 0.00 H new ATOM 0 HG21 VAL B 8 -10.250 -5.221 13.932 1.00 0.00 H new ATOM 0 HG22 VAL B 8 -8.949 -6.425 13.771 1.00 0.00 H new ATOM 0 HG23 VAL B 8 -8.647 -4.725 13.339 1.00 0.00 H new ATOM 1137 N GLY B 9 -9.078 -5.210 8.905 1.00 0.00 N ATOM 1138 CA GLY B 9 -9.469 -5.210 7.508 1.00 0.00 C ATOM 1139 C GLY B 9 -9.847 -3.832 7.004 1.00 0.00 C ATOM 1140 O GLY B 9 -10.993 -3.404 7.145 1.00 0.00 O ATOM 0 H GLY B 9 -8.840 -4.294 9.286 1.00 0.00 H new ATOM 0 HA2 GLY B 9 -8.648 -5.600 6.906 1.00 0.00 H new ATOM 0 HA3 GLY B 9 -10.313 -5.886 7.372 1.00 0.00 H new ATOM 1144 N GLU B 10 -8.883 -3.138 6.408 1.00 0.00 N ATOM 1145 CA GLU B 10 -9.124 -1.803 5.872 1.00 0.00 C ATOM 1146 C GLU B 10 -9.407 -1.872 4.376 1.00 0.00 C ATOM 1147 O GLU B 10 -10.490 -1.502 3.921 1.00 0.00 O ATOM 1148 CB GLU B 10 -7.922 -0.895 6.139 1.00 0.00 C ATOM 1149 CG GLU B 10 -8.306 0.476 6.670 1.00 0.00 C ATOM 1150 CD GLU B 10 -8.895 0.414 8.066 1.00 0.00 C ATOM 1151 OE1 GLU B 10 -8.592 -0.553 8.796 1.00 0.00 O ATOM 1152 OE2 GLU B 10 -9.661 1.331 8.429 1.00 0.00 O ATOM 0 H GLU B 10 -7.929 -3.477 6.284 1.00 0.00 H new ATOM 0 HA GLU B 10 -9.997 -1.384 6.373 1.00 0.00 H new ATOM 0 HB2 GLU B 10 -7.261 -1.382 6.856 1.00 0.00 H new ATOM 0 HB3 GLU B 10 -7.356 -0.773 5.215 1.00 0.00 H new ATOM 0 HG2 GLU B 10 -7.425 1.118 6.679 1.00 0.00 H new ATOM 0 HG3 GLU B 10 -9.028 0.935 5.994 1.00 0.00 H new ATOM 1159 N THR B 11 -8.430 -2.357 3.616 1.00 0.00 N ATOM 1160 CA THR B 11 -8.574 -2.486 2.171 1.00 0.00 C ATOM 1161 C THR B 11 -8.714 -1.123 1.501 1.00 0.00 C ATOM 1162 O THR B 11 -9.804 -0.554 1.453 1.00 0.00 O ATOM 1163 CB THR B 11 -9.785 -3.358 1.833 1.00 0.00 C ATOM 1164 OG1 THR B 11 -9.766 -4.557 2.588 1.00 0.00 O ATOM 1165 CG2 THR B 11 -9.859 -3.739 0.370 1.00 0.00 C ATOM 0 H THR B 11 -7.528 -2.668 3.978 1.00 0.00 H new ATOM 0 HA THR B 11 -7.670 -2.961 1.790 1.00 0.00 H new ATOM 0 HB THR B 11 -10.656 -2.750 2.078 1.00 0.00 H new ATOM 0 HG1 THR B 11 -10.549 -5.100 2.359 1.00 0.00 H new ATOM 0 HG21 THR B 11 -10.741 -4.357 0.199 1.00 0.00 H new ATOM 0 HG22 THR B 11 -9.925 -2.837 -0.238 1.00 0.00 H new ATOM 0 HG23 THR B 11 -8.965 -4.298 0.094 1.00 0.00 H new ATOM 1173 N LEU B 12 -7.606 -0.612 0.972 1.00 0.00 N ATOM 1174 CA LEU B 12 -7.611 0.677 0.288 1.00 0.00 C ATOM 1175 C LEU B 12 -7.151 0.507 -1.157 1.00 0.00 C ATOM 1176 O LEU B 12 -6.422 -0.433 -1.473 1.00 0.00 O ATOM 1177 CB LEU B 12 -6.725 1.689 1.032 1.00 0.00 C ATOM 1178 CG LEU B 12 -5.236 1.689 0.660 1.00 0.00 C ATOM 1179 CD1 LEU B 12 -4.680 3.104 0.683 1.00 0.00 C ATOM 1180 CD2 LEU B 12 -4.452 0.795 1.607 1.00 0.00 C ATOM 0 H LEU B 12 -6.695 -1.070 1.004 1.00 0.00 H new ATOM 0 HA LEU B 12 -8.629 1.066 0.281 1.00 0.00 H new ATOM 0 HB2 LEU B 12 -7.123 2.688 0.854 1.00 0.00 H new ATOM 0 HB3 LEU B 12 -6.811 1.498 2.102 1.00 0.00 H new ATOM 0 HG LEU B 12 -5.134 1.296 -0.351 1.00 0.00 H new ATOM 0 HD11 LEU B 12 -3.623 3.084 0.417 1.00 0.00 H new ATOM 0 HD12 LEU B 12 -5.223 3.720 -0.034 1.00 0.00 H new ATOM 0 HD13 LEU B 12 -4.794 3.524 1.682 1.00 0.00 H new ATOM 0 HD21 LEU B 12 -3.398 0.806 1.329 1.00 0.00 H new ATOM 0 HD22 LEU B 12 -4.562 1.161 2.628 1.00 0.00 H new ATOM 0 HD23 LEU B 12 -4.833 -0.224 1.544 1.00 0.00 H new ATOM 1192 N MET B 13 -7.577 1.410 -2.035 1.00 0.00 N ATOM 1193 CA MET B 13 -7.194 1.330 -3.438 1.00 0.00 C ATOM 1194 C MET B 13 -6.658 2.667 -3.934 1.00 0.00 C ATOM 1195 O MET B 13 -7.424 3.576 -4.253 1.00 0.00 O ATOM 1196 CB MET B 13 -8.394 0.899 -4.286 1.00 0.00 C ATOM 1197 CG MET B 13 -8.120 0.893 -5.784 1.00 0.00 C ATOM 1198 SD MET B 13 -9.351 1.818 -6.723 1.00 0.00 S ATOM 1199 CE MET B 13 -10.164 0.493 -7.611 1.00 0.00 C ATOM 0 H MET B 13 -8.182 2.198 -1.802 1.00 0.00 H new ATOM 0 HA MET B 13 -6.402 0.588 -3.534 1.00 0.00 H new ATOM 0 HB2 MET B 13 -8.703 -0.100 -3.979 1.00 0.00 H new ATOM 0 HB3 MET B 13 -9.230 1.568 -4.082 1.00 0.00 H new ATOM 0 HG2 MET B 13 -7.133 1.317 -5.970 1.00 0.00 H new ATOM 0 HG3 MET B 13 -8.096 -0.137 -6.140 1.00 0.00 H new ATOM 0 HE1 MET B 13 -10.218 0.744 -8.670 1.00 0.00 H new ATOM 0 HE2 MET B 13 -9.598 -0.430 -7.485 1.00 0.00 H new ATOM 0 HE3 MET B 13 -11.172 0.357 -7.219 1.00 0.00 H new ATOM 1209 N ILE B 14 -5.337 2.776 -3.998 1.00 0.00 N ATOM 1210 CA ILE B 14 -4.696 3.996 -4.457 1.00 0.00 C ATOM 1211 C ILE B 14 -3.852 3.736 -5.704 1.00 0.00 C ATOM 1212 O ILE B 14 -2.750 3.195 -5.618 1.00 0.00 O ATOM 1213 CB ILE B 14 -3.809 4.611 -3.354 1.00 0.00 C ATOM 1214 CG1 ILE B 14 -3.234 5.950 -3.817 1.00 0.00 C ATOM 1215 CG2 ILE B 14 -2.694 3.652 -2.962 1.00 0.00 C ATOM 1216 CD1 ILE B 14 -4.297 6.960 -4.186 1.00 0.00 C ATOM 0 H ILE B 14 -4.690 2.032 -3.737 1.00 0.00 H new ATOM 0 HA ILE B 14 -5.488 4.702 -4.705 1.00 0.00 H new ATOM 0 HB ILE B 14 -4.427 4.788 -2.474 1.00 0.00 H new ATOM 0 HG12 ILE B 14 -2.609 6.363 -3.025 1.00 0.00 H new ATOM 0 HG13 ILE B 14 -2.587 5.782 -4.678 1.00 0.00 H new ATOM 0 HG21 ILE B 14 -2.081 4.106 -2.183 1.00 0.00 H new ATOM 0 HG22 ILE B 14 -3.127 2.724 -2.589 1.00 0.00 H new ATOM 0 HG23 ILE B 14 -2.075 3.439 -3.833 1.00 0.00 H new ATOM 0 HD11 ILE B 14 -3.822 7.888 -4.506 1.00 0.00 H new ATOM 0 HD12 ILE B 14 -4.907 6.566 -4.999 1.00 0.00 H new ATOM 0 HD13 ILE B 14 -4.929 7.156 -3.320 1.00 0.00 H new ATOM 1228 N GLY B 15 -4.378 4.123 -6.862 1.00 0.00 N ATOM 1229 CA GLY B 15 -3.661 3.921 -8.109 1.00 0.00 C ATOM 1230 C GLY B 15 -4.590 3.884 -9.308 1.00 0.00 C ATOM 1231 O GLY B 15 -5.135 4.911 -9.711 1.00 0.00 O ATOM 0 H GLY B 15 -5.288 4.573 -6.960 1.00 0.00 H new ATOM 0 HA2 GLY B 15 -2.933 4.722 -8.241 1.00 0.00 H new ATOM 0 HA3 GLY B 15 -3.102 2.987 -8.057 1.00 0.00 H new ATOM 1235 N ASP B 16 -4.768 2.697 -9.878 1.00 0.00 N ATOM 1236 CA ASP B 16 -5.636 2.529 -11.040 1.00 0.00 C ATOM 1237 C ASP B 16 -6.642 1.395 -10.834 1.00 0.00 C ATOM 1238 O ASP B 16 -7.625 1.292 -11.569 1.00 0.00 O ATOM 1239 CB ASP B 16 -4.799 2.257 -12.291 1.00 0.00 C ATOM 1240 CG ASP B 16 -5.529 2.630 -13.567 1.00 0.00 C ATOM 1241 OD1 ASP B 16 -6.040 3.766 -13.648 1.00 0.00 O ATOM 1242 OD2 ASP B 16 -5.589 1.785 -14.485 1.00 0.00 O ATOM 0 H ASP B 16 -4.324 1.837 -9.555 1.00 0.00 H new ATOM 0 HA ASP B 16 -6.194 3.456 -11.170 1.00 0.00 H new ATOM 0 HB2 ASP B 16 -3.867 2.819 -12.231 1.00 0.00 H new ATOM 0 HB3 ASP B 16 -4.532 1.201 -12.324 1.00 0.00 H new ATOM 1247 N GLU B 17 -6.394 0.546 -9.834 1.00 0.00 N ATOM 1248 CA GLU B 17 -7.275 -0.581 -9.529 1.00 0.00 C ATOM 1249 C GLU B 17 -6.557 -1.576 -8.620 1.00 0.00 C ATOM 1250 O GLU B 17 -6.337 -2.729 -8.990 1.00 0.00 O ATOM 1251 CB GLU B 17 -7.733 -1.282 -10.816 1.00 0.00 C ATOM 1252 CG GLU B 17 -9.166 -0.956 -11.207 1.00 0.00 C ATOM 1253 CD GLU B 17 -9.413 -1.110 -12.695 1.00 0.00 C ATOM 1254 OE1 GLU B 17 -8.481 -0.845 -13.483 1.00 0.00 O ATOM 1255 OE2 GLU B 17 -10.540 -1.494 -13.073 1.00 0.00 O ATOM 0 H GLU B 17 -5.584 0.620 -9.218 1.00 0.00 H new ATOM 0 HA GLU B 17 -8.156 -0.197 -9.015 1.00 0.00 H new ATOM 0 HB2 GLU B 17 -7.068 -0.997 -11.632 1.00 0.00 H new ATOM 0 HB3 GLU B 17 -7.636 -2.360 -10.687 1.00 0.00 H new ATOM 0 HG2 GLU B 17 -9.846 -1.609 -10.660 1.00 0.00 H new ATOM 0 HG3 GLU B 17 -9.397 0.066 -10.908 1.00 0.00 H new ATOM 1262 N VAL B 18 -6.179 -1.115 -7.431 1.00 0.00 N ATOM 1263 CA VAL B 18 -5.474 -1.950 -6.478 1.00 0.00 C ATOM 1264 C VAL B 18 -6.367 -2.337 -5.299 1.00 0.00 C ATOM 1265 O VAL B 18 -7.580 -2.129 -5.326 1.00 0.00 O ATOM 1266 CB VAL B 18 -4.221 -1.224 -5.953 1.00 0.00 C ATOM 1267 CG1 VAL B 18 -3.305 -0.834 -7.105 1.00 0.00 C ATOM 1268 CG2 VAL B 18 -4.611 0.000 -5.134 1.00 0.00 C ATOM 0 H VAL B 18 -6.353 -0.163 -7.109 1.00 0.00 H new ATOM 0 HA VAL B 18 -5.179 -2.861 -7.000 1.00 0.00 H new ATOM 0 HB VAL B 18 -3.677 -1.908 -5.302 1.00 0.00 H new ATOM 0 HG11 VAL B 18 -2.426 -0.322 -6.714 1.00 0.00 H new ATOM 0 HG12 VAL B 18 -2.994 -1.730 -7.642 1.00 0.00 H new ATOM 0 HG13 VAL B 18 -3.838 -0.170 -7.785 1.00 0.00 H new ATOM 0 HG21 VAL B 18 -3.711 0.498 -4.773 1.00 0.00 H new ATOM 0 HG22 VAL B 18 -5.181 0.688 -5.758 1.00 0.00 H new ATOM 0 HG23 VAL B 18 -5.220 -0.309 -4.285 1.00 0.00 H new ATOM 1278 N THR B 19 -5.750 -2.900 -4.265 1.00 0.00 N ATOM 1279 CA THR B 19 -6.463 -3.320 -3.065 1.00 0.00 C ATOM 1280 C THR B 19 -5.469 -3.818 -2.023 1.00 0.00 C ATOM 1281 O THR B 19 -4.940 -4.922 -2.137 1.00 0.00 O ATOM 1282 CB THR B 19 -7.474 -4.421 -3.397 1.00 0.00 C ATOM 1283 OG1 THR B 19 -7.923 -5.061 -2.216 1.00 0.00 O ATOM 1284 CG2 THR B 19 -6.919 -5.489 -4.314 1.00 0.00 C ATOM 0 H THR B 19 -4.746 -3.077 -4.236 1.00 0.00 H new ATOM 0 HA THR B 19 -7.006 -2.465 -2.663 1.00 0.00 H new ATOM 0 HB THR B 19 -8.292 -3.915 -3.910 1.00 0.00 H new ATOM 0 HG1 THR B 19 -8.569 -5.760 -2.448 1.00 0.00 H new ATOM 0 HG21 THR B 19 -7.687 -6.237 -4.508 1.00 0.00 H new ATOM 0 HG22 THR B 19 -6.609 -5.035 -5.255 1.00 0.00 H new ATOM 0 HG23 THR B 19 -6.061 -5.965 -3.840 1.00 0.00 H new ATOM 1292 N VAL B 20 -5.197 -2.989 -1.021 1.00 0.00 N ATOM 1293 CA VAL B 20 -4.240 -3.349 0.016 1.00 0.00 C ATOM 1294 C VAL B 20 -4.921 -3.781 1.311 1.00 0.00 C ATOM 1295 O VAL B 20 -5.467 -2.957 2.048 1.00 0.00 O ATOM 1296 CB VAL B 20 -3.283 -2.183 0.323 1.00 0.00 C ATOM 1297 CG1 VAL B 20 -2.168 -2.632 1.258 1.00 0.00 C ATOM 1298 CG2 VAL B 20 -2.712 -1.608 -0.965 1.00 0.00 C ATOM 0 H VAL B 20 -5.623 -2.069 -0.906 1.00 0.00 H new ATOM 0 HA VAL B 20 -3.676 -4.194 -0.378 1.00 0.00 H new ATOM 0 HB VAL B 20 -3.848 -1.398 0.826 1.00 0.00 H new ATOM 0 HG11 VAL B 20 -1.504 -1.792 1.461 1.00 0.00 H new ATOM 0 HG12 VAL B 20 -2.599 -2.989 2.193 1.00 0.00 H new ATOM 0 HG13 VAL B 20 -1.602 -3.437 0.789 1.00 0.00 H new ATOM 0 HG21 VAL B 20 -2.038 -0.785 -0.728 1.00 0.00 H new ATOM 0 HG22 VAL B 20 -2.164 -2.384 -1.498 1.00 0.00 H new ATOM 0 HG23 VAL B 20 -3.525 -1.242 -1.592 1.00 0.00 H new ATOM 1308 N THR B 21 -4.873 -5.084 1.573 1.00 0.00 N ATOM 1309 CA THR B 21 -5.466 -5.658 2.775 1.00 0.00 C ATOM 1310 C THR B 21 -4.436 -5.719 3.904 1.00 0.00 C ATOM 1311 O THR B 21 -3.464 -6.474 3.836 1.00 0.00 O ATOM 1312 CB THR B 21 -6.007 -7.059 2.484 1.00 0.00 C ATOM 1313 OG1 THR B 21 -6.660 -7.591 3.623 1.00 0.00 O ATOM 1314 CG2 THR B 21 -4.934 -8.041 2.069 1.00 0.00 C ATOM 0 H THR B 21 -4.425 -5.767 0.962 1.00 0.00 H new ATOM 0 HA THR B 21 -6.292 -5.019 3.089 1.00 0.00 H new ATOM 0 HB THR B 21 -6.702 -6.933 1.653 1.00 0.00 H new ATOM 0 HG1 THR B 21 -7.000 -8.487 3.416 1.00 0.00 H new ATOM 0 HG21 THR B 21 -5.386 -9.014 1.878 1.00 0.00 H new ATOM 0 HG22 THR B 21 -4.445 -7.684 1.163 1.00 0.00 H new ATOM 0 HG23 THR B 21 -4.197 -8.133 2.867 1.00 0.00 H new ATOM 1322 N VAL B 22 -4.653 -4.911 4.937 1.00 0.00 N ATOM 1323 CA VAL B 22 -3.742 -4.862 6.077 1.00 0.00 C ATOM 1324 C VAL B 22 -4.051 -5.963 7.090 1.00 0.00 C ATOM 1325 O VAL B 22 -4.396 -5.685 8.239 1.00 0.00 O ATOM 1326 CB VAL B 22 -3.807 -3.495 6.782 1.00 0.00 C ATOM 1327 CG1 VAL B 22 -3.347 -2.388 5.847 1.00 0.00 C ATOM 1328 CG2 VAL B 22 -5.215 -3.224 7.291 1.00 0.00 C ATOM 0 H VAL B 22 -5.452 -4.281 5.009 1.00 0.00 H new ATOM 0 HA VAL B 22 -2.737 -5.017 5.683 1.00 0.00 H new ATOM 0 HB VAL B 22 -3.133 -3.516 7.639 1.00 0.00 H new ATOM 0 HG11 VAL B 22 -3.400 -1.430 6.364 1.00 0.00 H new ATOM 0 HG12 VAL B 22 -2.319 -2.577 5.538 1.00 0.00 H new ATOM 0 HG13 VAL B 22 -3.991 -2.363 4.968 1.00 0.00 H new ATOM 0 HG21 VAL B 22 -5.242 -2.254 7.787 1.00 0.00 H new ATOM 0 HG22 VAL B 22 -5.911 -3.223 6.452 1.00 0.00 H new ATOM 0 HG23 VAL B 22 -5.502 -4.001 7.999 1.00 0.00 H new ATOM 1338 N LEU B 23 -3.927 -7.213 6.658 1.00 0.00 N ATOM 1339 CA LEU B 23 -4.195 -8.352 7.530 1.00 0.00 C ATOM 1340 C LEU B 23 -2.899 -8.852 8.185 1.00 0.00 C ATOM 1341 O LEU B 23 -2.040 -8.051 8.550 1.00 0.00 O ATOM 1342 CB LEU B 23 -4.881 -9.470 6.732 1.00 0.00 C ATOM 1343 CG LEU B 23 -5.698 -10.486 7.552 1.00 0.00 C ATOM 1344 CD1 LEU B 23 -5.803 -10.074 9.019 1.00 0.00 C ATOM 1345 CD2 LEU B 23 -7.084 -10.661 6.950 1.00 0.00 C ATOM 0 H LEU B 23 -3.643 -7.464 5.711 1.00 0.00 H new ATOM 0 HA LEU B 23 -4.866 -8.036 8.329 1.00 0.00 H new ATOM 0 HB2 LEU B 23 -5.543 -9.011 5.998 1.00 0.00 H new ATOM 0 HB3 LEU B 23 -4.117 -10.013 6.176 1.00 0.00 H new ATOM 0 HG LEU B 23 -5.172 -11.440 7.514 1.00 0.00 H new ATOM 0 HD11 LEU B 23 -6.387 -10.816 9.564 1.00 0.00 H new ATOM 0 HD12 LEU B 23 -4.804 -10.009 9.451 1.00 0.00 H new ATOM 0 HD13 LEU B 23 -6.293 -9.103 9.090 1.00 0.00 H new ATOM 0 HD21 LEU B 23 -7.649 -11.382 7.541 1.00 0.00 H new ATOM 0 HD22 LEU B 23 -7.605 -9.703 6.951 1.00 0.00 H new ATOM 0 HD23 LEU B 23 -6.993 -11.023 5.926 1.00 0.00 H new ATOM 1357 N GLY B 24 -2.761 -10.173 8.340 1.00 0.00 N ATOM 1358 CA GLY B 24 -1.569 -10.731 8.953 1.00 0.00 C ATOM 1359 C GLY B 24 -1.268 -10.119 10.306 1.00 0.00 C ATOM 1360 O GLY B 24 -0.292 -9.385 10.456 1.00 0.00 O ATOM 0 H GLY B 24 -3.455 -10.862 8.051 1.00 0.00 H new ATOM 0 HA2 GLY B 24 -1.693 -11.808 9.065 1.00 0.00 H new ATOM 0 HA3 GLY B 24 -0.718 -10.575 8.291 1.00 0.00 H new ATOM 1364 N VAL B 25 -2.109 -10.413 11.293 1.00 0.00 N ATOM 1365 CA VAL B 25 -1.923 -9.875 12.629 1.00 0.00 C ATOM 1366 C VAL B 25 -1.026 -10.773 13.475 1.00 0.00 C ATOM 1367 O VAL B 25 -1.433 -11.856 13.898 1.00 0.00 O ATOM 1368 CB VAL B 25 -3.272 -9.699 13.351 1.00 0.00 C ATOM 1369 CG1 VAL B 25 -3.089 -8.922 14.645 1.00 0.00 C ATOM 1370 CG2 VAL B 25 -4.281 -9.012 12.443 1.00 0.00 C ATOM 0 H VAL B 25 -2.923 -11.019 11.190 1.00 0.00 H new ATOM 0 HA VAL B 25 -1.444 -8.903 12.510 1.00 0.00 H new ATOM 0 HB VAL B 25 -3.660 -10.687 13.601 1.00 0.00 H new ATOM 0 HG11 VAL B 25 -4.053 -8.808 15.140 1.00 0.00 H new ATOM 0 HG12 VAL B 25 -2.406 -9.462 15.300 1.00 0.00 H new ATOM 0 HG13 VAL B 25 -2.677 -7.938 14.423 1.00 0.00 H new ATOM 0 HG21 VAL B 25 -5.227 -8.897 12.972 1.00 0.00 H new ATOM 0 HG22 VAL B 25 -3.904 -8.030 12.157 1.00 0.00 H new ATOM 0 HG23 VAL B 25 -4.436 -9.616 11.549 1.00 0.00 H new ATOM 1380 N LYS B 26 0.197 -10.314 13.715 1.00 0.00 N ATOM 1381 CA LYS B 26 1.158 -11.073 14.508 1.00 0.00 C ATOM 1382 C LYS B 26 1.997 -10.150 15.384 1.00 0.00 C ATOM 1383 O LYS B 26 2.296 -9.018 15.005 1.00 0.00 O ATOM 1384 CB LYS B 26 2.069 -11.894 13.592 1.00 0.00 C ATOM 1385 CG LYS B 26 1.323 -12.918 12.752 1.00 0.00 C ATOM 1386 CD LYS B 26 2.242 -14.039 12.293 1.00 0.00 C ATOM 1387 CE LYS B 26 2.672 -13.852 10.847 1.00 0.00 C ATOM 1388 NZ LYS B 26 4.060 -14.339 10.613 1.00 0.00 N ATOM 0 H LYS B 26 0.547 -9.420 13.372 1.00 0.00 H new ATOM 0 HA LYS B 26 0.601 -11.748 15.157 1.00 0.00 H new ATOM 0 HB2 LYS B 26 2.610 -11.218 12.930 1.00 0.00 H new ATOM 0 HB3 LYS B 26 2.814 -12.408 14.200 1.00 0.00 H new ATOM 0 HG2 LYS B 26 0.500 -13.335 13.332 1.00 0.00 H new ATOM 0 HG3 LYS B 26 0.884 -12.427 11.883 1.00 0.00 H new ATOM 0 HD2 LYS B 26 3.123 -14.074 12.934 1.00 0.00 H new ATOM 0 HD3 LYS B 26 1.732 -14.996 12.401 1.00 0.00 H new ATOM 0 HE2 LYS B 26 1.984 -14.387 10.192 1.00 0.00 H new ATOM 0 HE3 LYS B 26 2.608 -12.796 10.583 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 4.145 -14.689 9.637 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 4.731 -13.559 10.761 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 4.274 -15.110 11.277 1.00 0.00 H new ATOM 1402 N GLY B 27 2.375 -10.644 16.559 1.00 0.00 N ATOM 1403 CA GLY B 27 3.177 -9.853 17.473 1.00 0.00 C ATOM 1404 C GLY B 27 4.521 -9.471 16.884 1.00 0.00 C ATOM 1405 O GLY B 27 5.002 -10.113 15.950 1.00 0.00 O ATOM 0 H GLY B 27 2.140 -11.578 16.894 1.00 0.00 H new ATOM 0 HA2 GLY B 27 2.631 -8.948 17.741 1.00 0.00 H new ATOM 0 HA3 GLY B 27 3.334 -10.415 18.394 1.00 0.00 H new ATOM 1409 N ASN B 28 5.127 -8.421 17.429 1.00 0.00 N ATOM 1410 CA ASN B 28 6.422 -7.949 16.951 1.00 0.00 C ATOM 1411 C ASN B 28 6.316 -7.437 15.517 1.00 0.00 C ATOM 1412 O ASN B 28 6.201 -6.234 15.287 1.00 0.00 O ATOM 1413 CB ASN B 28 7.465 -9.067 17.040 1.00 0.00 C ATOM 1414 CG ASN B 28 8.299 -8.979 18.303 1.00 0.00 C ATOM 1415 OD1 ASN B 28 7.824 -8.527 19.345 1.00 0.00 O ATOM 1416 ND2 ASN B 28 9.552 -9.412 18.216 1.00 0.00 N ATOM 0 H ASN B 28 4.741 -7.880 18.203 1.00 0.00 H new ATOM 0 HA ASN B 28 6.740 -7.123 17.588 1.00 0.00 H new ATOM 0 HB2 ASN B 28 6.962 -10.033 17.007 1.00 0.00 H new ATOM 0 HB3 ASN B 28 8.121 -9.019 16.171 1.00 0.00 H new ATOM 0 HD21 ASN B 28 10.161 -9.377 19.033 1.00 0.00 H new ATOM 0 HD22 ASN B 28 9.905 -9.779 17.332 1.00 0.00 H new ATOM 1423 N GLN B 29 6.350 -8.356 14.555 1.00 0.00 N ATOM 1424 CA GLN B 29 6.253 -7.990 13.146 1.00 0.00 C ATOM 1425 C GLN B 29 4.903 -8.405 12.572 1.00 0.00 C ATOM 1426 O GLN B 29 4.516 -9.571 12.651 1.00 0.00 O ATOM 1427 CB GLN B 29 7.383 -8.642 12.347 1.00 0.00 C ATOM 1428 CG GLN B 29 8.650 -7.803 12.288 1.00 0.00 C ATOM 1429 CD GLN B 29 9.058 -7.460 10.868 1.00 0.00 C ATOM 1430 OE1 GLN B 29 9.898 -8.133 10.271 1.00 0.00 O ATOM 1431 NE2 GLN B 29 8.462 -6.407 10.319 1.00 0.00 N ATOM 0 H GLN B 29 6.444 -9.357 14.726 1.00 0.00 H new ATOM 0 HA GLN B 29 6.345 -6.907 13.070 1.00 0.00 H new ATOM 0 HB2 GLN B 29 7.618 -9.610 12.790 1.00 0.00 H new ATOM 0 HB3 GLN B 29 7.036 -8.832 11.331 1.00 0.00 H new ATOM 0 HG2 GLN B 29 8.498 -6.882 12.851 1.00 0.00 H new ATOM 0 HG3 GLN B 29 9.462 -8.343 12.775 1.00 0.00 H new ATOM 0 HE21 GLN B 29 7.771 -5.877 10.851 1.00 0.00 H new ATOM 0 HE22 GLN B 29 8.695 -6.128 9.366 1.00 0.00 H new ATOM 1440 N VAL B 30 4.185 -7.442 12.004 1.00 0.00 N ATOM 1441 CA VAL B 30 2.873 -7.708 11.427 1.00 0.00 C ATOM 1442 C VAL B 30 2.976 -8.005 9.937 1.00 0.00 C ATOM 1443 O VAL B 30 3.691 -7.319 9.206 1.00 0.00 O ATOM 1444 CB VAL B 30 1.915 -6.519 11.638 1.00 0.00 C ATOM 1445 CG1 VAL B 30 0.512 -6.871 11.168 1.00 0.00 C ATOM 1446 CG2 VAL B 30 1.904 -6.094 13.099 1.00 0.00 C ATOM 0 H VAL B 30 4.489 -6.471 11.931 1.00 0.00 H new ATOM 0 HA VAL B 30 2.474 -8.583 11.941 1.00 0.00 H new ATOM 0 HB VAL B 30 2.273 -5.680 11.041 1.00 0.00 H new ATOM 0 HG11 VAL B 30 -0.149 -6.019 11.325 1.00 0.00 H new ATOM 0 HG12 VAL B 30 0.536 -7.121 10.107 1.00 0.00 H new ATOM 0 HG13 VAL B 30 0.143 -7.726 11.734 1.00 0.00 H new ATOM 0 HG21 VAL B 30 1.222 -5.254 13.228 1.00 0.00 H new ATOM 0 HG22 VAL B 30 1.573 -6.928 13.718 1.00 0.00 H new ATOM 0 HG23 VAL B 30 2.909 -5.796 13.399 1.00 0.00 H new ATOM 1456 N ARG B 31 2.247 -9.023 9.487 1.00 0.00 N ATOM 1457 CA ARG B 31 2.245 -9.396 8.089 1.00 0.00 C ATOM 1458 C ARG B 31 1.266 -8.523 7.315 1.00 0.00 C ATOM 1459 O ARG B 31 0.052 -8.647 7.469 1.00 0.00 O ATOM 1460 CB ARG B 31 1.889 -10.875 7.924 1.00 0.00 C ATOM 1461 CG ARG B 31 2.906 -11.657 7.107 1.00 0.00 C ATOM 1462 CD ARG B 31 3.716 -12.604 7.978 1.00 0.00 C ATOM 1463 NE ARG B 31 5.111 -12.682 7.552 1.00 0.00 N ATOM 1464 CZ ARG B 31 5.503 -13.180 6.381 1.00 0.00 C ATOM 1465 NH1 ARG B 31 4.609 -13.647 5.518 1.00 0.00 N ATOM 1466 NH2 ARG B 31 6.792 -13.211 6.072 1.00 0.00 N ATOM 0 H ARG B 31 1.650 -9.602 10.078 1.00 0.00 H new ATOM 0 HA ARG B 31 3.246 -9.241 7.688 1.00 0.00 H new ATOM 0 HB2 ARG B 31 1.799 -11.331 8.910 1.00 0.00 H new ATOM 0 HB3 ARG B 31 0.913 -10.954 7.446 1.00 0.00 H new ATOM 0 HG2 ARG B 31 2.391 -12.225 6.332 1.00 0.00 H new ATOM 0 HG3 ARG B 31 3.577 -10.963 6.601 1.00 0.00 H new ATOM 0 HD2 ARG B 31 3.672 -12.270 9.015 1.00 0.00 H new ATOM 0 HD3 ARG B 31 3.271 -13.598 7.944 1.00 0.00 H new ATOM 0 HE ARG B 31 5.827 -12.334 8.189 1.00 0.00 H new ATOM 0 HH11 ARG B 31 3.616 -13.625 5.750 1.00 0.00 H new ATOM 0 HH12 ARG B 31 4.915 -14.027 4.622 1.00 0.00 H new ATOM 0 HH21 ARG B 31 7.483 -12.853 6.731 1.00 0.00 H new ATOM 0 HH22 ARG B 31 7.092 -13.592 5.175 1.00 0.00 H new ATOM 1480 N ILE B 32 1.801 -7.635 6.491 1.00 0.00 N ATOM 1481 CA ILE B 32 0.977 -6.730 5.701 1.00 0.00 C ATOM 1482 C ILE B 32 0.696 -7.305 4.317 1.00 0.00 C ATOM 1483 O ILE B 32 1.595 -7.826 3.657 1.00 0.00 O ATOM 1484 CB ILE B 32 1.652 -5.352 5.553 1.00 0.00 C ATOM 1485 CG1 ILE B 32 2.342 -4.955 6.863 1.00 0.00 C ATOM 1486 CG2 ILE B 32 0.631 -4.301 5.142 1.00 0.00 C ATOM 1487 CD1 ILE B 32 1.380 -4.744 8.013 1.00 0.00 C ATOM 0 H ILE B 32 2.805 -7.521 6.351 1.00 0.00 H new ATOM 0 HA ILE B 32 0.033 -6.610 6.233 1.00 0.00 H new ATOM 0 HB ILE B 32 2.409 -5.416 4.771 1.00 0.00 H new ATOM 0 HG12 ILE B 32 3.058 -5.730 7.136 1.00 0.00 H new ATOM 0 HG13 ILE B 32 2.910 -4.039 6.702 1.00 0.00 H new ATOM 0 HG21 ILE B 32 1.124 -3.334 5.042 1.00 0.00 H new ATOM 0 HG22 ILE B 32 0.185 -4.581 4.188 1.00 0.00 H new ATOM 0 HG23 ILE B 32 -0.148 -4.234 5.901 1.00 0.00 H new ATOM 0 HD11 ILE B 32 1.937 -4.465 8.907 1.00 0.00 H new ATOM 0 HD12 ILE B 32 0.679 -3.949 7.760 1.00 0.00 H new ATOM 0 HD13 ILE B 32 0.830 -5.666 8.201 1.00 0.00 H new ATOM 1499 N GLY B 33 -0.557 -7.204 3.880 1.00 0.00 N ATOM 1500 CA GLY B 33 -0.929 -7.717 2.576 1.00 0.00 C ATOM 1501 C GLY B 33 -1.253 -6.612 1.595 1.00 0.00 C ATOM 1502 O GLY B 33 -2.260 -5.924 1.741 1.00 0.00 O ATOM 0 H GLY B 33 -1.319 -6.776 4.406 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -0.114 -8.323 2.181 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -1.793 -8.373 2.679 1.00 0.00 H new ATOM 1506 N VAL B 34 -0.399 -6.435 0.592 1.00 0.00 N ATOM 1507 CA VAL B 34 -0.619 -5.395 -0.404 1.00 0.00 C ATOM 1508 C VAL B 34 -0.905 -5.991 -1.776 1.00 0.00 C ATOM 1509 O VAL B 34 0.004 -6.448 -2.470 1.00 0.00 O ATOM 1510 CB VAL B 34 0.597 -4.456 -0.511 1.00 0.00 C ATOM 1511 CG1 VAL B 34 0.258 -3.236 -1.354 1.00 0.00 C ATOM 1512 CG2 VAL B 34 1.076 -4.040 0.872 1.00 0.00 C ATOM 0 H VAL B 34 0.443 -6.992 0.449 1.00 0.00 H new ATOM 0 HA VAL B 34 -1.487 -4.824 -0.074 1.00 0.00 H new ATOM 0 HB VAL B 34 1.406 -4.996 -1.003 1.00 0.00 H new ATOM 0 HG11 VAL B 34 1.129 -2.584 -1.418 1.00 0.00 H new ATOM 0 HG12 VAL B 34 -0.031 -3.555 -2.355 1.00 0.00 H new ATOM 0 HG13 VAL B 34 -0.568 -2.693 -0.893 1.00 0.00 H new ATOM 0 HG21 VAL B 34 1.936 -3.377 0.775 1.00 0.00 H new ATOM 0 HG22 VAL B 34 0.273 -3.519 1.394 1.00 0.00 H new ATOM 0 HG23 VAL B 34 1.363 -4.925 1.439 1.00 0.00 H new ATOM 1522 N ASN B 35 -2.177 -5.984 -2.161 1.00 0.00 N ATOM 1523 CA ASN B 35 -2.583 -6.523 -3.452 1.00 0.00 C ATOM 1524 C ASN B 35 -2.584 -5.431 -4.515 1.00 0.00 C ATOM 1525 O ASN B 35 -3.450 -4.556 -4.525 1.00 0.00 O ATOM 1526 CB ASN B 35 -3.971 -7.160 -3.352 1.00 0.00 C ATOM 1527 CG ASN B 35 -4.072 -8.454 -4.135 1.00 0.00 C ATOM 1528 OD1 ASN B 35 -4.172 -9.536 -3.557 1.00 0.00 O ATOM 1529 ND2 ASN B 35 -4.046 -8.348 -5.459 1.00 0.00 N ATOM 0 H ASN B 35 -2.942 -5.612 -1.598 1.00 0.00 H new ATOM 0 HA ASN B 35 -1.864 -7.289 -3.742 1.00 0.00 H new ATOM 0 HB2 ASN B 35 -4.204 -7.353 -2.305 1.00 0.00 H new ATOM 0 HB3 ASN B 35 -4.718 -6.457 -3.720 1.00 0.00 H new ATOM 0 HD21 ASN B 35 -4.110 -9.185 -6.039 1.00 0.00 H new ATOM 0 HD22 ASN B 35 -3.962 -7.430 -5.896 1.00 0.00 H new ATOM 1536 N ALA B 36 -1.599 -5.488 -5.403 1.00 0.00 N ATOM 1537 CA ALA B 36 -1.474 -4.501 -6.469 1.00 0.00 C ATOM 1538 C ALA B 36 -1.294 -5.168 -7.830 1.00 0.00 C ATOM 1539 O ALA B 36 -0.670 -6.224 -7.938 1.00 0.00 O ATOM 1540 CB ALA B 36 -0.310 -3.565 -6.182 1.00 0.00 C ATOM 0 H ALA B 36 -0.875 -6.207 -5.406 1.00 0.00 H new ATOM 0 HA ALA B 36 -2.398 -3.924 -6.502 1.00 0.00 H new ATOM 0 HB1 ALA B 36 -0.226 -2.832 -6.984 1.00 0.00 H new ATOM 0 HB2 ALA B 36 -0.482 -3.050 -5.237 1.00 0.00 H new ATOM 0 HB3 ALA B 36 0.613 -4.141 -6.119 1.00 0.00 H new ATOM 1546 N PRO B 37 -1.835 -4.549 -8.894 1.00 0.00 N ATOM 1547 CA PRO B 37 -1.730 -5.075 -10.255 1.00 0.00 C ATOM 1548 C PRO B 37 -0.362 -4.804 -10.868 1.00 0.00 C ATOM 1549 O PRO B 37 0.338 -3.877 -10.460 1.00 0.00 O ATOM 1550 CB PRO B 37 -2.815 -4.306 -11.006 1.00 0.00 C ATOM 1551 CG PRO B 37 -2.896 -2.997 -10.300 1.00 0.00 C ATOM 1552 CD PRO B 37 -2.590 -3.279 -8.852 1.00 0.00 C ATOM 0 HA PRO B 37 -1.850 -6.158 -10.293 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -2.555 -4.176 -12.056 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -3.769 -4.833 -10.977 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -2.183 -2.285 -10.717 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -3.887 -2.557 -10.410 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -2.002 -2.478 -8.404 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -3.501 -3.374 -8.261 1.00 0.00 H new ATOM 1560 N LYS B 38 0.016 -5.615 -11.849 1.00 0.00 N ATOM 1561 CA LYS B 38 1.303 -5.456 -12.515 1.00 0.00 C ATOM 1562 C LYS B 38 1.182 -4.549 -13.738 1.00 0.00 C ATOM 1563 O LYS B 38 1.813 -4.793 -14.766 1.00 0.00 O ATOM 1564 CB LYS B 38 1.856 -6.821 -12.931 1.00 0.00 C ATOM 1565 CG LYS B 38 2.603 -7.539 -11.819 1.00 0.00 C ATOM 1566 CD LYS B 38 2.174 -8.993 -11.704 1.00 0.00 C ATOM 1567 CE LYS B 38 0.931 -9.140 -10.841 1.00 0.00 C ATOM 1568 NZ LYS B 38 0.588 -10.569 -10.600 1.00 0.00 N ATOM 0 H LYS B 38 -0.549 -6.388 -12.200 1.00 0.00 H new ATOM 0 HA LYS B 38 1.991 -4.990 -11.810 1.00 0.00 H new ATOM 0 HB2 LYS B 38 1.032 -7.450 -13.269 1.00 0.00 H new ATOM 0 HB3 LYS B 38 2.526 -6.689 -13.781 1.00 0.00 H new ATOM 0 HG2 LYS B 38 3.675 -7.489 -12.009 1.00 0.00 H new ATOM 0 HG3 LYS B 38 2.423 -7.030 -10.872 1.00 0.00 H new ATOM 0 HD2 LYS B 38 1.978 -9.395 -12.698 1.00 0.00 H new ATOM 0 HD3 LYS B 38 2.987 -9.581 -11.277 1.00 0.00 H new ATOM 0 HE2 LYS B 38 1.091 -8.639 -9.886 1.00 0.00 H new ATOM 0 HE3 LYS B 38 0.091 -8.642 -11.326 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 -0.265 -10.626 -10.008 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 0.411 -11.042 -11.509 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 1.379 -11.039 -10.114 1.00 0.00 H new ATOM 1582 N GLU B 39 0.368 -3.502 -13.622 1.00 0.00 N ATOM 1583 CA GLU B 39 0.170 -2.564 -14.722 1.00 0.00 C ATOM 1584 C GLU B 39 0.500 -1.136 -14.292 1.00 0.00 C ATOM 1585 O GLU B 39 1.074 -0.366 -15.062 1.00 0.00 O ATOM 1586 CB GLU B 39 -1.274 -2.635 -15.224 1.00 0.00 C ATOM 1587 CG GLU B 39 -1.556 -3.848 -16.096 1.00 0.00 C ATOM 1588 CD GLU B 39 -1.440 -3.541 -17.576 1.00 0.00 C ATOM 1589 OE1 GLU B 39 -1.813 -2.420 -17.981 1.00 0.00 O ATOM 1590 OE2 GLU B 39 -0.977 -4.422 -18.331 1.00 0.00 O ATOM 0 H GLU B 39 -0.163 -3.283 -12.779 1.00 0.00 H new ATOM 0 HA GLU B 39 0.846 -2.845 -15.530 1.00 0.00 H new ATOM 0 HB2 GLU B 39 -1.947 -2.649 -14.367 1.00 0.00 H new ATOM 0 HB3 GLU B 39 -1.498 -1.731 -15.790 1.00 0.00 H new ATOM 0 HG2 GLU B 39 -0.860 -4.646 -15.838 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -2.559 -4.219 -15.883 1.00 0.00 H new ATOM 1597 N VAL B 40 0.136 -0.787 -13.060 1.00 0.00 N ATOM 1598 CA VAL B 40 0.399 0.549 -12.537 1.00 0.00 C ATOM 1599 C VAL B 40 1.819 0.652 -11.989 1.00 0.00 C ATOM 1600 O VAL B 40 2.430 -0.354 -11.629 1.00 0.00 O ATOM 1601 CB VAL B 40 -0.601 0.936 -11.427 1.00 0.00 C ATOM 1602 CG1 VAL B 40 -0.530 2.427 -11.141 1.00 0.00 C ATOM 1603 CG2 VAL B 40 -2.015 0.529 -11.815 1.00 0.00 C ATOM 0 H VAL B 40 -0.341 -1.410 -12.408 1.00 0.00 H new ATOM 0 HA VAL B 40 0.280 1.241 -13.371 1.00 0.00 H new ATOM 0 HB VAL B 40 -0.330 0.400 -10.517 1.00 0.00 H new ATOM 0 HG11 VAL B 40 -1.242 2.681 -10.356 1.00 0.00 H new ATOM 0 HG12 VAL B 40 0.477 2.688 -10.816 1.00 0.00 H new ATOM 0 HG13 VAL B 40 -0.774 2.983 -12.046 1.00 0.00 H new ATOM 0 HG21 VAL B 40 -2.706 0.810 -11.020 1.00 0.00 H new ATOM 0 HG22 VAL B 40 -2.299 1.035 -12.738 1.00 0.00 H new ATOM 0 HG23 VAL B 40 -2.055 -0.550 -11.965 1.00 0.00 H new ATOM 1613 N SER B 41 2.340 1.874 -11.933 1.00 0.00 N ATOM 1614 CA SER B 41 3.691 2.109 -11.433 1.00 0.00 C ATOM 1615 C SER B 41 3.855 1.572 -10.014 1.00 0.00 C ATOM 1616 O SER B 41 3.223 2.061 -9.077 1.00 0.00 O ATOM 1617 CB SER B 41 4.015 3.603 -11.465 1.00 0.00 C ATOM 1618 OG SER B 41 5.414 3.823 -11.421 1.00 0.00 O ATOM 0 H SER B 41 1.847 2.717 -12.228 1.00 0.00 H new ATOM 0 HA SER B 41 4.386 1.577 -12.082 1.00 0.00 H new ATOM 0 HB2 SER B 41 3.602 4.048 -12.370 1.00 0.00 H new ATOM 0 HB3 SER B 41 3.539 4.100 -10.620 1.00 0.00 H new ATOM 0 HG SER B 41 5.595 4.786 -11.444 1.00 0.00 H new ATOM 1624 N VAL B 42 4.711 0.566 -9.863 1.00 0.00 N ATOM 1625 CA VAL B 42 4.965 -0.036 -8.560 1.00 0.00 C ATOM 1626 C VAL B 42 6.448 0.049 -8.198 1.00 0.00 C ATOM 1627 O VAL B 42 7.300 -0.462 -8.925 1.00 0.00 O ATOM 1628 CB VAL B 42 4.517 -1.511 -8.527 1.00 0.00 C ATOM 1629 CG1 VAL B 42 5.288 -2.330 -9.551 1.00 0.00 C ATOM 1630 CG2 VAL B 42 4.688 -2.092 -7.130 1.00 0.00 C ATOM 0 H VAL B 42 5.241 0.150 -10.629 1.00 0.00 H new ATOM 0 HA VAL B 42 4.384 0.525 -7.829 1.00 0.00 H new ATOM 0 HB VAL B 42 3.459 -1.554 -8.786 1.00 0.00 H new ATOM 0 HG11 VAL B 42 4.957 -3.368 -9.511 1.00 0.00 H new ATOM 0 HG12 VAL B 42 5.107 -1.929 -10.548 1.00 0.00 H new ATOM 0 HG13 VAL B 42 6.354 -2.281 -9.328 1.00 0.00 H new ATOM 0 HG21 VAL B 42 4.366 -3.133 -7.127 1.00 0.00 H new ATOM 0 HG22 VAL B 42 5.737 -2.035 -6.838 1.00 0.00 H new ATOM 0 HG23 VAL B 42 4.083 -1.524 -6.423 1.00 0.00 H new ATOM 1640 N HIS B 43 6.749 0.684 -7.068 1.00 0.00 N ATOM 1641 CA HIS B 43 8.127 0.819 -6.609 1.00 0.00 C ATOM 1642 C HIS B 43 8.254 0.367 -5.157 1.00 0.00 C ATOM 1643 O HIS B 43 7.575 0.896 -4.277 1.00 0.00 O ATOM 1644 CB HIS B 43 8.598 2.268 -6.754 1.00 0.00 C ATOM 1645 CG HIS B 43 9.868 2.408 -7.534 1.00 0.00 C ATOM 1646 ND1 HIS B 43 10.262 1.507 -8.500 1.00 0.00 N ATOM 1647 CD2 HIS B 43 10.837 3.353 -7.488 1.00 0.00 C ATOM 1648 CE1 HIS B 43 11.417 1.888 -9.014 1.00 0.00 C ATOM 1649 NE2 HIS B 43 11.788 3.006 -8.417 1.00 0.00 N ATOM 0 H HIS B 43 6.057 1.113 -6.454 1.00 0.00 H new ATOM 0 HA HIS B 43 8.759 0.182 -7.228 1.00 0.00 H new ATOM 0 HB2 HIS B 43 7.815 2.849 -7.242 1.00 0.00 H new ATOM 0 HB3 HIS B 43 8.741 2.696 -5.762 1.00 0.00 H new ATOM 0 HD2 HIS B 43 10.858 4.218 -6.842 1.00 0.00 H new ATOM 0 HE1 HIS B 43 11.965 1.373 -9.790 1.00 0.00 H new ATOM 0 HE2 HIS B 43 12.642 3.527 -8.614 1.00 0.00 H new ATOM 1657 N ARG B 44 9.118 -0.611 -4.905 1.00 0.00 N ATOM 1658 CA ARG B 44 9.313 -1.117 -3.552 1.00 0.00 C ATOM 1659 C ARG B 44 10.602 -1.931 -3.452 1.00 0.00 C ATOM 1660 O ARG B 44 11.612 -1.449 -2.940 1.00 0.00 O ATOM 1661 CB ARG B 44 8.113 -1.970 -3.131 1.00 0.00 C ATOM 1662 CG ARG B 44 8.247 -2.584 -1.746 1.00 0.00 C ATOM 1663 CD ARG B 44 7.526 -3.919 -1.659 1.00 0.00 C ATOM 1664 NE ARG B 44 6.074 -3.754 -1.643 1.00 0.00 N ATOM 1665 CZ ARG B 44 5.215 -4.675 -2.076 1.00 0.00 C ATOM 1666 NH1 ARG B 44 5.654 -5.833 -2.555 1.00 0.00 N ATOM 1667 NH2 ARG B 44 3.911 -4.439 -2.028 1.00 0.00 N ATOM 0 H ARG B 44 9.691 -1.066 -5.615 1.00 0.00 H new ATOM 0 HA ARG B 44 9.398 -0.265 -2.878 1.00 0.00 H new ATOM 0 HB2 ARG B 44 7.214 -1.354 -3.159 1.00 0.00 H new ATOM 0 HB3 ARG B 44 7.974 -2.769 -3.860 1.00 0.00 H new ATOM 0 HG2 ARG B 44 9.302 -2.722 -1.508 1.00 0.00 H new ATOM 0 HG3 ARG B 44 7.840 -1.900 -1.002 1.00 0.00 H new ATOM 0 HD2 ARG B 44 7.811 -4.542 -2.507 1.00 0.00 H new ATOM 0 HD3 ARG B 44 7.842 -4.444 -0.757 1.00 0.00 H new ATOM 0 HE ARG B 44 5.695 -2.880 -1.278 1.00 0.00 H new ATOM 0 HH11 ARG B 44 6.656 -6.022 -2.593 1.00 0.00 H new ATOM 0 HH12 ARG B 44 4.990 -6.533 -2.885 1.00 0.00 H new ATOM 0 HH21 ARG B 44 3.566 -3.552 -1.660 1.00 0.00 H new ATOM 0 HH22 ARG B 44 3.253 -5.144 -2.360 1.00 0.00 H new ATOM 1681 N GLU B 45 10.560 -3.166 -3.942 1.00 0.00 N ATOM 1682 CA GLU B 45 11.726 -4.043 -3.904 1.00 0.00 C ATOM 1683 C GLU B 45 11.651 -5.095 -5.006 1.00 0.00 C ATOM 1684 O GLU B 45 10.624 -5.750 -5.184 1.00 0.00 O ATOM 1685 CB GLU B 45 11.833 -4.724 -2.539 1.00 0.00 C ATOM 1686 CG GLU B 45 12.576 -3.897 -1.502 1.00 0.00 C ATOM 1687 CD GLU B 45 13.998 -3.579 -1.920 1.00 0.00 C ATOM 1688 OE1 GLU B 45 14.190 -2.608 -2.682 1.00 0.00 O ATOM 1689 OE2 GLU B 45 14.920 -4.301 -1.486 1.00 0.00 O ATOM 0 H GLU B 45 9.733 -3.582 -4.370 1.00 0.00 H new ATOM 0 HA GLU B 45 12.614 -3.433 -4.069 1.00 0.00 H new ATOM 0 HB2 GLU B 45 10.830 -4.938 -2.170 1.00 0.00 H new ATOM 0 HB3 GLU B 45 12.340 -5.681 -2.659 1.00 0.00 H new ATOM 0 HG2 GLU B 45 12.035 -2.966 -1.329 1.00 0.00 H new ATOM 0 HG3 GLU B 45 12.592 -4.437 -0.555 1.00 0.00 H new ATOM 1696 N GLU B 46 12.745 -5.249 -5.746 1.00 0.00 N ATOM 1697 CA GLU B 46 12.803 -6.219 -6.835 1.00 0.00 C ATOM 1698 C GLU B 46 12.508 -7.630 -6.333 1.00 0.00 C ATOM 1699 O GLU B 46 11.670 -8.334 -6.896 1.00 0.00 O ATOM 1700 CB GLU B 46 14.178 -6.180 -7.507 1.00 0.00 C ATOM 1701 CG GLU B 46 15.337 -6.347 -6.537 1.00 0.00 C ATOM 1702 CD GLU B 46 16.574 -5.587 -6.973 1.00 0.00 C ATOM 1703 OE1 GLU B 46 16.760 -5.404 -8.194 1.00 0.00 O ATOM 1704 OE2 GLU B 46 17.359 -5.175 -6.092 1.00 0.00 O ATOM 0 H GLU B 46 13.603 -4.715 -5.612 1.00 0.00 H new ATOM 0 HA GLU B 46 12.040 -5.950 -7.565 1.00 0.00 H new ATOM 0 HB2 GLU B 46 14.228 -6.968 -8.258 1.00 0.00 H new ATOM 0 HB3 GLU B 46 14.289 -5.231 -8.032 1.00 0.00 H new ATOM 0 HG2 GLU B 46 15.032 -6.002 -5.549 1.00 0.00 H new ATOM 0 HG3 GLU B 46 15.579 -7.406 -6.444 1.00 0.00 H new ATOM 1711 N ILE B 47 13.201 -8.039 -5.275 1.00 0.00 N ATOM 1712 CA ILE B 47 13.010 -9.368 -4.706 1.00 0.00 C ATOM 1713 C ILE B 47 11.591 -9.537 -4.167 1.00 0.00 C ATOM 1714 O ILE B 47 10.962 -10.581 -4.355 1.00 0.00 O ATOM 1715 CB ILE B 47 14.021 -9.644 -3.573 1.00 0.00 C ATOM 1716 CG1 ILE B 47 13.867 -11.075 -3.054 1.00 0.00 C ATOM 1717 CG2 ILE B 47 13.842 -8.642 -2.442 1.00 0.00 C ATOM 1718 CD1 ILE B 47 14.869 -11.439 -1.981 1.00 0.00 C ATOM 0 H ILE B 47 13.899 -7.470 -4.795 1.00 0.00 H new ATOM 0 HA ILE B 47 13.175 -10.085 -5.510 1.00 0.00 H new ATOM 0 HB ILE B 47 15.028 -9.531 -3.975 1.00 0.00 H new ATOM 0 HG12 ILE B 47 12.860 -11.203 -2.658 1.00 0.00 H new ATOM 0 HG13 ILE B 47 13.972 -11.769 -3.888 1.00 0.00 H new ATOM 0 HG21 ILE B 47 14.563 -8.852 -1.652 1.00 0.00 H new ATOM 0 HG22 ILE B 47 14.003 -7.633 -2.821 1.00 0.00 H new ATOM 0 HG23 ILE B 47 12.832 -8.722 -2.041 1.00 0.00 H new ATOM 0 HD11 ILE B 47 14.701 -12.467 -1.660 1.00 0.00 H new ATOM 0 HD12 ILE B 47 15.879 -11.344 -2.379 1.00 0.00 H new ATOM 0 HD13 ILE B 47 14.750 -10.769 -1.130 1.00 0.00 H new ATOM 1730 N TYR B 48 11.093 -8.501 -3.498 1.00 0.00 N ATOM 1731 CA TYR B 48 9.749 -8.528 -2.928 1.00 0.00 C ATOM 1732 C TYR B 48 8.717 -8.959 -3.968 1.00 0.00 C ATOM 1733 O TYR B 48 7.946 -9.893 -3.741 1.00 0.00 O ATOM 1734 CB TYR B 48 9.381 -7.151 -2.370 1.00 0.00 C ATOM 1735 CG TYR B 48 9.910 -6.900 -0.975 1.00 0.00 C ATOM 1736 CD1 TYR B 48 11.257 -7.073 -0.681 1.00 0.00 C ATOM 1737 CD2 TYR B 48 9.063 -6.492 0.047 1.00 0.00 C ATOM 1738 CE1 TYR B 48 11.744 -6.847 0.593 1.00 0.00 C ATOM 1739 CE2 TYR B 48 9.543 -6.263 1.323 1.00 0.00 C ATOM 1740 CZ TYR B 48 10.883 -6.442 1.590 1.00 0.00 C ATOM 1741 OH TYR B 48 11.365 -6.216 2.859 1.00 0.00 O ATOM 0 H TYR B 48 11.601 -7.631 -3.337 1.00 0.00 H new ATOM 0 HA TYR B 48 9.744 -9.257 -2.118 1.00 0.00 H new ATOM 0 HB2 TYR B 48 9.767 -6.382 -3.039 1.00 0.00 H new ATOM 0 HB3 TYR B 48 8.296 -7.050 -2.361 1.00 0.00 H new ATOM 0 HD1 TYR B 48 11.935 -7.389 -1.460 1.00 0.00 H new ATOM 0 HD2 TYR B 48 8.012 -6.351 -0.158 1.00 0.00 H new ATOM 0 HE1 TYR B 48 12.794 -6.987 0.806 1.00 0.00 H new ATOM 0 HE2 TYR B 48 8.871 -5.945 2.107 1.00 0.00 H new ATOM 0 HH TYR B 48 10.647 -5.859 3.423 1.00 0.00 H new ATOM 1751 N GLN B 49 8.709 -8.276 -5.107 1.00 0.00 N ATOM 1752 CA GLN B 49 7.772 -8.591 -6.178 1.00 0.00 C ATOM 1753 C GLN B 49 8.226 -9.817 -6.967 1.00 0.00 C ATOM 1754 O GLN B 49 7.420 -10.472 -7.624 1.00 0.00 O ATOM 1755 CB GLN B 49 7.623 -7.394 -7.119 1.00 0.00 C ATOM 1756 CG GLN B 49 6.921 -6.204 -6.484 1.00 0.00 C ATOM 1757 CD GLN B 49 5.870 -5.593 -7.391 1.00 0.00 C ATOM 1758 OE1 GLN B 49 4.786 -5.221 -6.940 1.00 0.00 O ATOM 1759 NE2 GLN B 49 6.185 -5.487 -8.676 1.00 0.00 N ATOM 0 H GLN B 49 9.340 -7.501 -5.312 1.00 0.00 H new ATOM 0 HA GLN B 49 6.807 -8.815 -5.723 1.00 0.00 H new ATOM 0 HB2 GLN B 49 8.611 -7.084 -7.458 1.00 0.00 H new ATOM 0 HB3 GLN B 49 7.066 -7.705 -8.003 1.00 0.00 H new ATOM 0 HG2 GLN B 49 6.452 -6.519 -5.552 1.00 0.00 H new ATOM 0 HG3 GLN B 49 7.660 -5.445 -6.228 1.00 0.00 H new ATOM 0 HE21 GLN B 49 7.095 -5.808 -9.006 1.00 0.00 H new ATOM 0 HE22 GLN B 49 5.517 -5.084 -9.333 1.00 0.00 H new ATOM 1768 N ARG B 50 9.517 -10.126 -6.899 1.00 0.00 N ATOM 1769 CA ARG B 50 10.062 -11.275 -7.610 1.00 0.00 C ATOM 1770 C ARG B 50 9.644 -12.586 -6.944 1.00 0.00 C ATOM 1771 O ARG B 50 9.764 -13.658 -7.536 1.00 0.00 O ATOM 1772 CB ARG B 50 11.587 -11.188 -7.674 1.00 0.00 C ATOM 1773 CG ARG B 50 12.100 -10.307 -8.801 1.00 0.00 C ATOM 1774 CD ARG B 50 13.554 -9.914 -8.585 1.00 0.00 C ATOM 1775 NE ARG B 50 14.372 -10.174 -9.768 1.00 0.00 N ATOM 1776 CZ ARG B 50 15.702 -10.235 -9.750 1.00 0.00 C ATOM 1777 NH1 ARG B 50 16.367 -10.056 -8.616 1.00 0.00 N ATOM 1778 NH2 ARG B 50 16.369 -10.475 -10.871 1.00 0.00 N ATOM 0 H ARG B 50 10.203 -9.598 -6.360 1.00 0.00 H new ATOM 0 HA ARG B 50 9.660 -11.261 -8.623 1.00 0.00 H new ATOM 0 HB2 ARG B 50 11.961 -10.804 -6.725 1.00 0.00 H new ATOM 0 HB3 ARG B 50 11.995 -12.192 -7.794 1.00 0.00 H new ATOM 0 HG2 ARG B 50 12.002 -10.834 -9.750 1.00 0.00 H new ATOM 0 HG3 ARG B 50 11.486 -9.409 -8.870 1.00 0.00 H new ATOM 0 HD2 ARG B 50 13.610 -8.855 -8.331 1.00 0.00 H new ATOM 0 HD3 ARG B 50 13.957 -10.467 -7.737 1.00 0.00 H new ATOM 0 HE ARG B 50 13.896 -10.317 -10.659 1.00 0.00 H new ATOM 0 HH11 ARG B 50 15.859 -9.870 -7.751 1.00 0.00 H new ATOM 0 HH12 ARG B 50 17.386 -10.104 -8.609 1.00 0.00 H new ATOM 0 HH21 ARG B 50 15.863 -10.613 -11.746 1.00 0.00 H new ATOM 0 HH22 ARG B 50 17.388 -10.522 -10.858 1.00 0.00 H new ATOM 1792 N ILE B 51 9.157 -12.496 -5.710 1.00 0.00 N ATOM 1793 CA ILE B 51 8.726 -13.677 -4.972 1.00 0.00 C ATOM 1794 C ILE B 51 7.208 -13.708 -4.810 1.00 0.00 C ATOM 1795 O ILE B 51 6.612 -14.777 -4.682 1.00 0.00 O ATOM 1796 CB ILE B 51 9.383 -13.741 -3.579 1.00 0.00 C ATOM 1797 CG1 ILE B 51 10.902 -13.609 -3.701 1.00 0.00 C ATOM 1798 CG2 ILE B 51 9.016 -15.040 -2.875 1.00 0.00 C ATOM 1799 CD1 ILE B 51 11.591 -13.317 -2.385 1.00 0.00 C ATOM 0 H ILE B 51 9.051 -11.618 -5.201 1.00 0.00 H new ATOM 0 HA ILE B 51 9.041 -14.543 -5.555 1.00 0.00 H new ATOM 0 HB ILE B 51 9.009 -12.909 -2.982 1.00 0.00 H new ATOM 0 HG12 ILE B 51 11.307 -14.532 -4.117 1.00 0.00 H new ATOM 0 HG13 ILE B 51 11.134 -12.812 -4.408 1.00 0.00 H new ATOM 0 HG21 ILE B 51 9.489 -15.068 -1.893 1.00 0.00 H new ATOM 0 HG22 ILE B 51 7.934 -15.098 -2.759 1.00 0.00 H new ATOM 0 HG23 ILE B 51 9.363 -15.886 -3.469 1.00 0.00 H new ATOM 0 HD11 ILE B 51 12.666 -13.236 -2.547 1.00 0.00 H new ATOM 0 HD12 ILE B 51 11.214 -12.379 -1.977 1.00 0.00 H new ATOM 0 HD13 ILE B 51 11.390 -14.125 -1.682 1.00 0.00 H new ATOM 1811 N GLN B 52 6.587 -12.532 -4.813 1.00 0.00 N ATOM 1812 CA GLN B 52 5.138 -12.436 -4.663 1.00 0.00 C ATOM 1813 C GLN B 52 4.469 -12.046 -5.979 1.00 0.00 C ATOM 1814 O GLN B 52 3.565 -12.734 -6.454 1.00 0.00 O ATOM 1815 CB GLN B 52 4.785 -11.417 -3.578 1.00 0.00 C ATOM 1816 CG GLN B 52 4.727 -12.012 -2.181 1.00 0.00 C ATOM 1817 CD GLN B 52 6.087 -12.461 -1.682 1.00 0.00 C ATOM 1818 OE1 GLN B 52 6.935 -11.640 -1.334 1.00 0.00 O ATOM 1819 NE2 GLN B 52 6.301 -13.772 -1.645 1.00 0.00 N ATOM 0 H GLN B 52 7.062 -11.635 -4.917 1.00 0.00 H new ATOM 0 HA GLN B 52 4.767 -13.418 -4.370 1.00 0.00 H new ATOM 0 HB2 GLN B 52 5.522 -10.614 -3.592 1.00 0.00 H new ATOM 0 HB3 GLN B 52 3.820 -10.968 -3.813 1.00 0.00 H new ATOM 0 HG2 GLN B 52 4.317 -11.273 -1.492 1.00 0.00 H new ATOM 0 HG3 GLN B 52 4.045 -12.862 -2.180 1.00 0.00 H new ATOM 0 HE21 GLN B 52 5.569 -14.417 -1.943 1.00 0.00 H new ATOM 0 HE22 GLN B 52 7.197 -14.133 -1.318 1.00 0.00 H new ATOM 1828 N ALA B 53 4.916 -10.939 -6.560 1.00 0.00 N ATOM 1829 CA ALA B 53 4.361 -10.455 -7.818 1.00 0.00 C ATOM 1830 C ALA B 53 4.634 -11.433 -8.956 1.00 0.00 C ATOM 1831 O ALA B 53 3.733 -12.135 -9.414 1.00 0.00 O ATOM 1832 CB ALA B 53 4.927 -9.081 -8.149 1.00 0.00 C ATOM 0 H ALA B 53 5.663 -10.358 -6.179 1.00 0.00 H new ATOM 0 HA ALA B 53 3.280 -10.373 -7.701 1.00 0.00 H new ATOM 0 HB1 ALA B 53 4.505 -8.731 -9.091 1.00 0.00 H new ATOM 0 HB2 ALA B 53 4.671 -8.381 -7.354 1.00 0.00 H new ATOM 0 HB3 ALA B 53 6.011 -9.146 -8.240 1.00 0.00 H new ATOM 1838 N GLU B 54 5.884 -11.473 -9.406 1.00 0.00 N ATOM 1839 CA GLU B 54 6.280 -12.365 -10.489 1.00 0.00 C ATOM 1840 C GLU B 54 7.223 -13.449 -9.978 1.00 0.00 C ATOM 1841 O GLU B 54 8.255 -13.154 -9.379 1.00 0.00 O ATOM 1842 CB GLU B 54 6.958 -11.573 -11.609 1.00 0.00 C ATOM 1843 CG GLU B 54 6.997 -12.310 -12.938 1.00 0.00 C ATOM 1844 CD GLU B 54 7.980 -11.697 -13.916 1.00 0.00 C ATOM 1845 OE1 GLU B 54 9.189 -11.670 -13.604 1.00 0.00 O ATOM 1846 OE2 GLU B 54 7.540 -11.243 -14.994 1.00 0.00 O ATOM 0 H GLU B 54 6.641 -10.897 -9.037 1.00 0.00 H new ATOM 0 HA GLU B 54 5.382 -12.841 -10.882 1.00 0.00 H new ATOM 0 HB2 GLU B 54 6.433 -10.627 -11.743 1.00 0.00 H new ATOM 0 HB3 GLU B 54 7.977 -11.332 -11.307 1.00 0.00 H new ATOM 0 HG2 GLU B 54 7.266 -13.352 -12.764 1.00 0.00 H new ATOM 0 HG3 GLU B 54 6.001 -12.307 -13.380 1.00 0.00 H new ATOM 1853 N LYS B 55 6.862 -14.703 -10.223 1.00 0.00 N ATOM 1854 CA LYS B 55 7.678 -15.832 -9.791 1.00 0.00 C ATOM 1855 C LYS B 55 9.025 -15.834 -10.507 1.00 0.00 C ATOM 1856 O LYS B 55 9.173 -16.441 -11.567 1.00 0.00 O ATOM 1857 CB LYS B 55 6.944 -17.148 -10.055 1.00 0.00 C ATOM 1858 CG LYS B 55 5.667 -17.305 -9.247 1.00 0.00 C ATOM 1859 CD LYS B 55 5.283 -18.767 -9.089 1.00 0.00 C ATOM 1860 CE LYS B 55 6.174 -19.471 -8.078 1.00 0.00 C ATOM 1861 NZ LYS B 55 5.795 -19.138 -6.677 1.00 0.00 N ATOM 0 H LYS B 55 6.010 -14.964 -10.719 1.00 0.00 H new ATOM 0 HA LYS B 55 7.856 -15.732 -8.720 1.00 0.00 H new ATOM 0 HB2 LYS B 55 6.703 -17.213 -11.116 1.00 0.00 H new ATOM 0 HB3 LYS B 55 7.612 -17.979 -9.828 1.00 0.00 H new ATOM 0 HG2 LYS B 55 5.800 -16.855 -8.263 1.00 0.00 H new ATOM 0 HG3 LYS B 55 4.856 -16.766 -9.737 1.00 0.00 H new ATOM 0 HD2 LYS B 55 4.243 -18.839 -8.771 1.00 0.00 H new ATOM 0 HD3 LYS B 55 5.357 -19.270 -10.053 1.00 0.00 H new ATOM 0 HE2 LYS B 55 6.109 -20.549 -8.225 1.00 0.00 H new ATOM 0 HE3 LYS B 55 7.212 -19.188 -8.250 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 6.381 -19.689 -6.018 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 5.946 -18.123 -6.508 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 4.792 -19.369 -6.524 1.00 0.00 H new