USER MOD reduce.3.24.130724 H: found=0, std=0, add=1032, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 1061 hydrogens (21 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 19 SER OG : rot -31:sc= 0.292 USER MOD Single : A 20 ASN : amide:sc= -2.6! C(o=-2.6!,f=-13!) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot -63:sc= 0.328 USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 37 HIS : no HD1:sc= -9.24! C(o=-9.2!,f=-11!) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 19 SER OG : rot -31:sc= 0.263 USER MOD Single : B 20 ASN : amide:sc= -2.55! C(o=-2.6!,f=-13!) USER MOD Single : B 22 SER OG : rot 180:sc= 0 USER MOD Single : B 23 SER OG : rot -68:sc= 0.522 USER MOD Single : B 31 SER OG : rot 180:sc= 0 USER MOD Single : B 37 HIS : no HD1:sc= -9.44! C(o=-9.4!,f=-11!) USER MOD Single : B 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 19 SER OG : rot -21:sc= 0.25 USER MOD Single : C 20 ASN : amide:sc= -2.45! C(o=-2.4!,f=-13!) USER MOD Single : C 22 SER OG : rot 180:sc= 0 USER MOD Single : C 23 SER OG : rot -68:sc= 0.442 USER MOD Single : C 31 SER OG : rot 180:sc= 0 USER MOD Single : C 37 HIS : no HD1:sc= -9.03! C(o=-9!,f=-11!) USER MOD Single : C 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 19 SER OG : rot -37:sc= 0.258 USER MOD Single : D 20 ASN : amide:sc= -2.49! C(o=-2.5!,f=-13!) USER MOD Single : D 22 SER OG : rot 180:sc= 0 USER MOD Single : D 23 SER OG : rot -66:sc= 0.424 USER MOD Single : D 31 SER OG : rot 180:sc= 0 USER MOD Single : D 37 HIS : no HD1:sc= -9.45! C(o=-9.4!,f=-11!) USER MOD Single : D 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 19 -21.985 14.920 4.102 1.00 0.00 N ATOM 2 CA SER A 19 -22.190 13.529 3.608 1.00 0.00 C ATOM 3 C SER A 19 -21.276 12.580 4.375 1.00 0.00 C ATOM 4 O SER A 19 -20.952 11.493 3.898 1.00 0.00 O ATOM 5 CB SER A 19 -21.868 13.469 2.114 1.00 0.00 C ATOM 6 OG SER A 19 -20.599 14.067 1.883 1.00 0.00 O ATOM 0 HA SER A 19 -23.227 13.232 3.764 1.00 0.00 H new ATOM 0 HB2 SER A 19 -21.863 12.434 1.773 1.00 0.00 H new ATOM 0 HB3 SER A 19 -22.637 13.989 1.543 1.00 0.00 H new ATOM 0 HG SER A 19 -20.448 14.778 2.541 1.00 0.00 H new ATOM 14 N ASN A 20 -20.865 12.999 5.567 1.00 0.00 N ATOM 15 CA ASN A 20 -19.989 12.178 6.393 1.00 0.00 C ATOM 16 C ASN A 20 -20.705 10.905 6.833 1.00 0.00 C ATOM 17 O ASN A 20 -20.071 9.875 7.066 1.00 0.00 O ATOM 18 CB ASN A 20 -19.541 12.969 7.625 1.00 0.00 C ATOM 19 CG ASN A 20 -20.757 13.472 8.395 1.00 0.00 C ATOM 20 OD1 ASN A 20 -21.890 13.119 8.069 1.00 0.00 O ATOM 21 ND2 ASN A 20 -20.590 14.281 9.405 1.00 0.00 N ATOM 0 H ASN A 20 -21.122 13.895 5.980 1.00 0.00 H new ATOM 0 HA ASN A 20 -19.116 11.902 5.802 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -18.928 12.338 8.269 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -18.920 13.811 7.320 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -21.399 14.621 9.925 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -19.651 14.573 9.675 1.00 0.00 H new ATOM 28 N ASP A 21 -22.026 10.983 6.946 1.00 0.00 N ATOM 29 CA ASP A 21 -22.817 9.829 7.358 1.00 0.00 C ATOM 30 C ASP A 21 -22.683 8.696 6.346 1.00 0.00 C ATOM 31 O ASP A 21 -22.542 7.531 6.716 1.00 0.00 O ATOM 32 CB ASP A 21 -24.289 10.225 7.490 1.00 0.00 C ATOM 33 CG ASP A 21 -24.487 11.100 8.722 1.00 0.00 C ATOM 34 OD1 ASP A 21 -23.586 11.145 9.546 1.00 0.00 O ATOM 35 OD2 ASP A 21 -25.536 11.714 8.826 1.00 0.00 O ATOM 0 H ASP A 21 -22.569 11.826 6.760 1.00 0.00 H new ATOM 0 HA ASP A 21 -22.445 9.484 8.323 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -24.611 10.762 6.598 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -24.909 9.332 7.565 1.00 0.00 H new ATOM 40 N SER A 22 -22.732 9.046 5.065 1.00 0.00 N ATOM 41 CA SER A 22 -22.615 8.049 4.009 1.00 0.00 C ATOM 42 C SER A 22 -21.258 7.358 4.077 1.00 0.00 C ATOM 43 O SER A 22 -21.163 6.139 3.934 1.00 0.00 O ATOM 44 CB SER A 22 -22.787 8.712 2.642 1.00 0.00 C ATOM 45 OG SER A 22 -22.722 7.719 1.627 1.00 0.00 O ATOM 0 H SER A 22 -22.851 10.004 4.736 1.00 0.00 H new ATOM 0 HA SER A 22 -23.398 7.303 4.149 1.00 0.00 H new ATOM 0 HB2 SER A 22 -23.743 9.234 2.596 1.00 0.00 H new ATOM 0 HB3 SER A 22 -22.008 9.459 2.487 1.00 0.00 H new ATOM 0 HG SER A 22 -22.833 8.141 0.749 1.00 0.00 H new ATOM 51 N SER A 23 -20.206 8.146 4.294 1.00 0.00 N ATOM 52 CA SER A 23 -18.856 7.594 4.375 1.00 0.00 C ATOM 53 C SER A 23 -18.627 6.587 3.251 1.00 0.00 C ATOM 54 O SER A 23 -18.925 5.402 3.398 1.00 0.00 O ATOM 55 CB SER A 23 -18.651 6.909 5.729 1.00 0.00 C ATOM 56 OG SER A 23 -17.625 5.933 5.610 1.00 0.00 O ATOM 0 H SER A 23 -20.261 9.157 4.416 1.00 0.00 H new ATOM 0 HA SER A 23 -18.140 8.409 4.272 1.00 0.00 H new ATOM 0 HB2 SER A 23 -18.382 7.646 6.486 1.00 0.00 H new ATOM 0 HB3 SER A 23 -19.579 6.440 6.057 1.00 0.00 H new ATOM 0 HG SER A 23 -17.904 5.241 4.975 1.00 0.00 H new ATOM 62 N ASP A 24 -18.111 7.068 2.124 1.00 0.00 N ATOM 63 CA ASP A 24 -17.862 6.202 0.976 1.00 0.00 C ATOM 64 C ASP A 24 -17.070 4.957 1.400 1.00 0.00 C ATOM 65 O ASP A 24 -16.265 5.019 2.329 1.00 0.00 O ATOM 66 CB ASP A 24 -17.080 6.972 -0.098 1.00 0.00 C ATOM 67 CG ASP A 24 -18.014 7.903 -0.865 1.00 0.00 C ATOM 68 OD1 ASP A 24 -18.749 7.410 -1.706 1.00 0.00 O ATOM 69 OD2 ASP A 24 -17.978 9.093 -0.602 1.00 0.00 O ATOM 0 H ASP A 24 -17.859 8.046 1.981 1.00 0.00 H new ATOM 0 HA ASP A 24 -18.821 5.883 0.568 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -16.281 7.549 0.367 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -16.607 6.271 -0.786 1.00 0.00 H new ATOM 74 N PRO A 25 -17.277 3.838 0.742 1.00 0.00 N ATOM 75 CA PRO A 25 -16.557 2.569 1.070 1.00 0.00 C ATOM 76 C PRO A 25 -15.069 2.649 0.722 1.00 0.00 C ATOM 77 O PRO A 25 -14.272 1.836 1.187 1.00 0.00 O ATOM 78 CB PRO A 25 -17.276 1.508 0.218 1.00 0.00 C ATOM 79 CG PRO A 25 -17.857 2.268 -0.930 1.00 0.00 C ATOM 80 CD PRO A 25 -18.213 3.652 -0.385 1.00 0.00 C ATOM 0 HA PRO A 25 -16.582 2.344 2.136 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -16.582 0.741 -0.126 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -18.053 1.001 0.790 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -17.142 2.344 -1.749 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -18.740 1.765 -1.323 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -18.086 4.425 -1.143 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -19.251 3.697 -0.055 1.00 0.00 H new ATOM 88 N LEU A 26 -14.707 3.622 -0.106 1.00 0.00 N ATOM 89 CA LEU A 26 -13.316 3.783 -0.515 1.00 0.00 C ATOM 90 C LEU A 26 -12.430 4.079 0.695 1.00 0.00 C ATOM 91 O LEU A 26 -11.340 3.523 0.823 1.00 0.00 O ATOM 92 CB LEU A 26 -13.207 4.930 -1.535 1.00 0.00 C ATOM 93 CG LEU A 26 -13.611 4.433 -2.927 1.00 0.00 C ATOM 94 CD1 LEU A 26 -15.005 3.808 -2.860 1.00 0.00 C ATOM 95 CD2 LEU A 26 -13.626 5.610 -3.905 1.00 0.00 C ATOM 0 H LEU A 26 -15.350 4.306 -0.505 1.00 0.00 H new ATOM 0 HA LEU A 26 -12.976 2.854 -0.973 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -13.850 5.757 -1.234 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -12.186 5.312 -1.558 1.00 0.00 H new ATOM 0 HG LEU A 26 -12.894 3.686 -3.268 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -15.293 3.454 -3.850 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -14.995 2.969 -2.164 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -15.722 4.554 -2.518 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -13.913 5.257 -4.895 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -14.343 6.357 -3.564 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -12.632 6.056 -3.953 1.00 0.00 H new ATOM 107 N VAL A 27 -12.903 4.954 1.577 1.00 0.00 N ATOM 108 CA VAL A 27 -12.137 5.308 2.768 1.00 0.00 C ATOM 109 C VAL A 27 -11.970 4.097 3.683 1.00 0.00 C ATOM 110 O VAL A 27 -10.863 3.791 4.134 1.00 0.00 O ATOM 111 CB VAL A 27 -12.852 6.429 3.527 1.00 0.00 C ATOM 112 CG1 VAL A 27 -12.112 6.721 4.836 1.00 0.00 C ATOM 113 CG2 VAL A 27 -12.878 7.692 2.664 1.00 0.00 C ATOM 0 H VAL A 27 -13.803 5.427 1.492 1.00 0.00 H new ATOM 0 HA VAL A 27 -11.149 5.648 2.456 1.00 0.00 H new ATOM 0 HB VAL A 27 -13.872 6.118 3.751 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -12.624 7.519 5.373 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -12.094 5.822 5.452 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -11.090 7.030 4.615 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -13.387 8.491 3.203 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -11.857 8.000 2.438 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -13.409 7.487 1.734 1.00 0.00 H new ATOM 123 N VAL A 28 -13.077 3.413 3.952 1.00 0.00 N ATOM 124 CA VAL A 28 -13.048 2.237 4.813 1.00 0.00 C ATOM 125 C VAL A 28 -12.236 1.124 4.163 1.00 0.00 C ATOM 126 O VAL A 28 -11.423 0.469 4.818 1.00 0.00 O ATOM 127 CB VAL A 28 -14.474 1.750 5.081 1.00 0.00 C ATOM 128 CG1 VAL A 28 -14.429 0.458 5.900 1.00 0.00 C ATOM 129 CG2 VAL A 28 -15.238 2.821 5.863 1.00 0.00 C ATOM 0 H VAL A 28 -14.000 3.651 3.589 1.00 0.00 H new ATOM 0 HA VAL A 28 -12.578 2.509 5.758 1.00 0.00 H new ATOM 0 HB VAL A 28 -14.977 1.561 4.133 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -15.445 0.112 6.090 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -13.884 -0.306 5.345 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -13.926 0.646 6.849 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -16.254 2.476 6.055 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -14.733 3.009 6.811 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -15.271 3.742 5.281 1.00 0.00 H new ATOM 139 N ALA A 29 -12.462 0.915 2.870 1.00 0.00 N ATOM 140 CA ALA A 29 -11.748 -0.120 2.138 1.00 0.00 C ATOM 141 C ALA A 29 -10.254 0.173 2.122 1.00 0.00 C ATOM 142 O ALA A 29 -9.437 -0.733 2.260 1.00 0.00 O ATOM 143 CB ALA A 29 -12.269 -0.196 0.700 1.00 0.00 C ATOM 0 H ALA A 29 -13.130 1.446 2.312 1.00 0.00 H new ATOM 0 HA ALA A 29 -11.916 -1.074 2.637 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -11.730 -0.973 0.158 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -13.333 -0.433 0.711 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -12.116 0.764 0.206 1.00 0.00 H new ATOM 149 N ALA A 30 -9.901 1.441 1.959 1.00 0.00 N ATOM 150 CA ALA A 30 -8.494 1.822 1.928 1.00 0.00 C ATOM 151 C ALA A 30 -7.783 1.322 3.181 1.00 0.00 C ATOM 152 O ALA A 30 -6.734 0.686 3.095 1.00 0.00 O ATOM 153 CB ALA A 30 -8.367 3.344 1.837 1.00 0.00 C ATOM 0 H ALA A 30 -10.558 2.213 1.848 1.00 0.00 H new ATOM 0 HA ALA A 30 -8.029 1.369 1.052 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -7.313 3.620 1.814 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -8.854 3.696 0.928 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -8.843 3.801 2.704 1.00 0.00 H new ATOM 159 N SER A 31 -8.367 1.602 4.341 1.00 0.00 N ATOM 160 CA SER A 31 -7.779 1.161 5.603 1.00 0.00 C ATOM 161 C SER A 31 -7.718 -0.364 5.669 1.00 0.00 C ATOM 162 O SER A 31 -6.719 -0.938 6.104 1.00 0.00 O ATOM 163 CB SER A 31 -8.597 1.694 6.779 1.00 0.00 C ATOM 164 OG SER A 31 -8.227 1.000 7.961 1.00 0.00 O ATOM 0 H SER A 31 -9.237 2.126 4.435 1.00 0.00 H new ATOM 0 HA SER A 31 -6.764 1.554 5.661 1.00 0.00 H new ATOM 0 HB2 SER A 31 -8.424 2.763 6.902 1.00 0.00 H new ATOM 0 HB3 SER A 31 -9.662 1.563 6.585 1.00 0.00 H new ATOM 0 HG SER A 31 -8.749 1.341 8.717 1.00 0.00 H new ATOM 170 N ILE A 32 -8.797 -1.015 5.241 1.00 0.00 N ATOM 171 CA ILE A 32 -8.866 -2.476 5.261 1.00 0.00 C ATOM 172 C ILE A 32 -7.805 -3.080 4.344 1.00 0.00 C ATOM 173 O ILE A 32 -7.158 -4.063 4.697 1.00 0.00 O ATOM 174 CB ILE A 32 -10.258 -2.948 4.828 1.00 0.00 C ATOM 175 CG1 ILE A 32 -11.283 -2.538 5.888 1.00 0.00 C ATOM 176 CG2 ILE A 32 -10.264 -4.474 4.683 1.00 0.00 C ATOM 177 CD1 ILE A 32 -12.697 -2.767 5.350 1.00 0.00 C ATOM 0 H ILE A 32 -9.633 -0.557 4.877 1.00 0.00 H new ATOM 0 HA ILE A 32 -8.677 -2.812 6.281 1.00 0.00 H new ATOM 0 HB ILE A 32 -10.513 -2.492 3.871 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -11.131 -3.118 6.799 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -11.149 -1.489 6.152 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -11.255 -4.806 4.375 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -9.532 -4.771 3.932 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -10.009 -4.931 5.639 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -13.426 -2.475 6.106 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -12.846 -2.168 4.452 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -12.828 -3.822 5.109 1.00 0.00 H new ATOM 189 N ILE A 33 -7.635 -2.493 3.165 1.00 0.00 N ATOM 190 CA ILE A 33 -6.651 -2.997 2.213 1.00 0.00 C ATOM 191 C ILE A 33 -5.243 -2.932 2.799 1.00 0.00 C ATOM 192 O ILE A 33 -4.468 -3.881 2.675 1.00 0.00 O ATOM 193 CB ILE A 33 -6.714 -2.167 0.920 1.00 0.00 C ATOM 194 CG1 ILE A 33 -8.018 -2.480 0.175 1.00 0.00 C ATOM 195 CG2 ILE A 33 -5.513 -2.487 0.017 1.00 0.00 C ATOM 196 CD1 ILE A 33 -8.246 -1.416 -0.901 1.00 0.00 C ATOM 0 H ILE A 33 -8.159 -1.677 2.847 1.00 0.00 H new ATOM 0 HA ILE A 33 -6.883 -4.039 1.993 1.00 0.00 H new ATOM 0 HB ILE A 33 -6.684 -1.109 1.179 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -7.964 -3.469 -0.280 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -8.855 -2.495 0.872 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -5.573 -1.891 -0.894 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -4.588 -2.252 0.544 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -5.524 -3.546 -0.241 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -9.171 -1.631 -1.435 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -8.317 -0.434 -0.433 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -7.412 -1.423 -1.603 1.00 0.00 H new ATOM 208 N GLY A 34 -4.913 -1.816 3.435 1.00 0.00 N ATOM 209 CA GLY A 34 -3.588 -1.663 4.026 1.00 0.00 C ATOM 210 C GLY A 34 -3.373 -2.648 5.173 1.00 0.00 C ATOM 211 O GLY A 34 -2.384 -3.379 5.197 1.00 0.00 O ATOM 0 H GLY A 34 -5.532 -1.014 3.555 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -2.827 -1.820 3.262 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -3.467 -0.644 4.392 1.00 0.00 H new ATOM 215 N ILE A 35 -4.302 -2.661 6.126 1.00 0.00 N ATOM 216 CA ILE A 35 -4.192 -3.558 7.274 1.00 0.00 C ATOM 217 C ILE A 35 -4.304 -5.024 6.847 1.00 0.00 C ATOM 218 O ILE A 35 -3.539 -5.872 7.305 1.00 0.00 O ATOM 219 CB ILE A 35 -5.291 -3.233 8.293 1.00 0.00 C ATOM 220 CG1 ILE A 35 -5.037 -1.845 8.889 1.00 0.00 C ATOM 221 CG2 ILE A 35 -5.274 -4.272 9.420 1.00 0.00 C ATOM 222 CD1 ILE A 35 -6.265 -1.398 9.684 1.00 0.00 C ATOM 0 H ILE A 35 -5.131 -2.067 6.127 1.00 0.00 H new ATOM 0 HA ILE A 35 -3.212 -3.409 7.727 1.00 0.00 H new ATOM 0 HB ILE A 35 -6.260 -3.251 7.794 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -4.161 -1.871 9.537 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -4.825 -1.130 8.094 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -6.056 -4.038 10.142 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -5.450 -5.264 9.003 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -4.304 -4.254 9.917 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -6.084 -0.410 10.108 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -7.131 -1.356 9.023 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -6.456 -2.109 10.488 1.00 0.00 H new ATOM 234 N LEU A 36 -5.267 -5.315 5.975 1.00 0.00 N ATOM 235 CA LEU A 36 -5.479 -6.683 5.506 1.00 0.00 C ATOM 236 C LEU A 36 -4.260 -7.185 4.740 1.00 0.00 C ATOM 237 O LEU A 36 -3.791 -8.303 4.960 1.00 0.00 O ATOM 238 CB LEU A 36 -6.714 -6.733 4.598 1.00 0.00 C ATOM 239 CG LEU A 36 -7.002 -8.177 4.159 1.00 0.00 C ATOM 240 CD1 LEU A 36 -7.343 -9.049 5.382 1.00 0.00 C ATOM 241 CD2 LEU A 36 -8.185 -8.170 3.184 1.00 0.00 C ATOM 0 H LEU A 36 -5.909 -4.627 5.581 1.00 0.00 H new ATOM 0 HA LEU A 36 -5.635 -7.326 6.372 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -7.577 -6.328 5.126 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -6.554 -6.105 3.721 1.00 0.00 H new ATOM 0 HG LEU A 36 -6.119 -8.592 3.673 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -7.545 -10.069 5.056 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -6.502 -9.049 6.075 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -8.224 -8.647 5.881 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -8.399 -9.190 2.865 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -9.062 -7.753 3.679 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -7.936 -7.562 2.314 1.00 0.00 H new ATOM 253 N HIS A 37 -3.747 -6.350 3.846 1.00 0.00 N ATOM 254 CA HIS A 37 -2.580 -6.722 3.061 1.00 0.00 C ATOM 255 C HIS A 37 -1.400 -7.007 3.976 1.00 0.00 C ATOM 256 O HIS A 37 -0.634 -7.942 3.743 1.00 0.00 O ATOM 257 CB HIS A 37 -2.213 -5.604 2.085 1.00 0.00 C ATOM 258 CG HIS A 37 -1.017 -6.033 1.279 1.00 0.00 C ATOM 259 ND1 HIS A 37 -1.068 -6.207 -0.095 1.00 0.00 N ATOM 260 CD2 HIS A 37 0.266 -6.347 1.643 1.00 0.00 C ATOM 261 CE1 HIS A 37 0.153 -6.611 -0.497 1.00 0.00 C ATOM 262 NE2 HIS A 37 1.001 -6.710 0.524 1.00 0.00 N ATOM 0 H HIS A 37 -4.117 -5.420 3.648 1.00 0.00 H new ATOM 0 HA HIS A 37 -2.821 -7.622 2.495 1.00 0.00 H new ATOM 0 HB2 HIS A 37 -3.054 -5.388 1.426 1.00 0.00 H new ATOM 0 HB3 HIS A 37 -1.991 -4.686 2.630 1.00 0.00 H new ATOM 0 HD2 HIS A 37 0.649 -6.316 2.652 1.00 0.00 H new ATOM 0 HE1 HIS A 37 0.412 -6.828 -1.523 1.00 0.00 H new ATOM 0 HE2 HIS A 37 1.981 -6.992 0.491 1.00 0.00 H new ATOM 270 N LEU A 38 -1.251 -6.189 5.011 1.00 0.00 N ATOM 271 CA LEU A 38 -0.142 -6.353 5.946 1.00 0.00 C ATOM 272 C LEU A 38 -0.192 -7.715 6.625 1.00 0.00 C ATOM 273 O LEU A 38 0.845 -8.334 6.830 1.00 0.00 O ATOM 274 CB LEU A 38 -0.174 -5.240 7.014 1.00 0.00 C ATOM 275 CG LEU A 38 0.607 -4.001 6.536 1.00 0.00 C ATOM 276 CD1 LEU A 38 0.201 -2.783 7.378 1.00 0.00 C ATOM 277 CD2 LEU A 38 2.123 -4.238 6.688 1.00 0.00 C ATOM 0 H LEU A 38 -1.877 -5.412 5.224 1.00 0.00 H new ATOM 0 HA LEU A 38 0.786 -6.284 5.378 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -1.207 -4.964 7.228 1.00 0.00 H new ATOM 0 HB3 LEU A 38 0.256 -5.610 7.945 1.00 0.00 H new ATOM 0 HG LEU A 38 0.375 -3.821 5.486 1.00 0.00 H new ATOM 0 HD11 LEU A 38 0.754 -1.906 7.040 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -0.868 -2.603 7.266 1.00 0.00 H new ATOM 0 HD13 LEU A 38 0.429 -2.973 8.427 1.00 0.00 H new ATOM 0 HD21 LEU A 38 2.665 -3.356 6.347 1.00 0.00 H new ATOM 0 HD22 LEU A 38 2.359 -4.427 7.735 1.00 0.00 H new ATOM 0 HD23 LEU A 38 2.418 -5.099 6.089 1.00 0.00 H new ATOM 289 N ILE A 39 -1.380 -8.170 6.988 1.00 0.00 N ATOM 290 CA ILE A 39 -1.500 -9.456 7.660 1.00 0.00 C ATOM 291 C ILE A 39 -1.008 -10.573 6.742 1.00 0.00 C ATOM 292 O ILE A 39 -0.267 -11.458 7.166 1.00 0.00 O ATOM 293 CB ILE A 39 -2.960 -9.699 8.040 1.00 0.00 C ATOM 294 CG1 ILE A 39 -3.383 -8.666 9.088 1.00 0.00 C ATOM 295 CG2 ILE A 39 -3.105 -11.102 8.636 1.00 0.00 C ATOM 296 CD1 ILE A 39 -4.903 -8.699 9.260 1.00 0.00 C ATOM 0 H ILE A 39 -2.261 -7.680 6.833 1.00 0.00 H new ATOM 0 HA ILE A 39 -0.889 -9.448 8.563 1.00 0.00 H new ATOM 0 HB ILE A 39 -3.588 -9.610 7.154 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -2.895 -8.878 10.039 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -3.064 -7.670 8.781 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -4.146 -11.276 8.907 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -2.793 -11.844 7.901 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -2.479 -11.186 9.525 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -5.201 -7.963 10.007 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -5.382 -8.466 8.309 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -5.211 -9.692 9.587 1.00 0.00 H new ATOM 308 N LEU A 40 -1.420 -10.525 5.478 1.00 0.00 N ATOM 309 CA LEU A 40 -0.997 -11.539 4.515 1.00 0.00 C ATOM 310 C LEU A 40 0.487 -11.389 4.170 1.00 0.00 C ATOM 311 O LEU A 40 1.214 -12.379 4.084 1.00 0.00 O ATOM 312 CB LEU A 40 -1.852 -11.432 3.240 1.00 0.00 C ATOM 313 CG LEU A 40 -3.184 -12.185 3.430 1.00 0.00 C ATOM 314 CD1 LEU A 40 -2.943 -13.714 3.489 1.00 0.00 C ATOM 315 CD2 LEU A 40 -3.858 -11.716 4.731 1.00 0.00 C ATOM 0 H LEU A 40 -2.037 -9.806 5.100 1.00 0.00 H new ATOM 0 HA LEU A 40 -1.139 -12.522 4.965 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -2.047 -10.384 3.011 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -1.308 -11.848 2.392 1.00 0.00 H new ATOM 0 HG LEU A 40 -3.833 -11.969 2.581 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -3.895 -14.227 3.623 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -2.480 -14.045 2.560 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -2.284 -13.946 4.326 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -4.800 -12.248 4.865 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -3.201 -11.922 5.576 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -4.052 -10.645 4.675 1.00 0.00 H new ATOM 327 N TRP A 41 0.926 -10.151 3.955 1.00 0.00 N ATOM 328 CA TRP A 41 2.320 -9.892 3.600 1.00 0.00 C ATOM 329 C TRP A 41 3.263 -10.170 4.772 1.00 0.00 C ATOM 330 O TRP A 41 4.294 -10.825 4.605 1.00 0.00 O ATOM 331 CB TRP A 41 2.469 -8.444 3.111 1.00 0.00 C ATOM 332 CG TRP A 41 3.915 -8.097 2.941 1.00 0.00 C ATOM 333 CD1 TRP A 41 4.663 -8.377 1.849 1.00 0.00 C ATOM 334 CD2 TRP A 41 4.781 -7.358 3.848 1.00 0.00 C ATOM 335 NE1 TRP A 41 5.945 -7.898 2.051 1.00 0.00 N ATOM 336 CE2 TRP A 41 6.061 -7.254 3.264 1.00 0.00 C ATOM 337 CE3 TRP A 41 4.583 -6.781 5.115 1.00 0.00 C ATOM 338 CZ2 TRP A 41 7.104 -6.602 3.910 1.00 0.00 C ATOM 339 CZ3 TRP A 41 5.634 -6.115 5.763 1.00 0.00 C ATOM 340 CH2 TRP A 41 6.892 -6.028 5.162 1.00 0.00 C ATOM 0 H TRP A 41 0.342 -9.317 4.020 1.00 0.00 H new ATOM 0 HA TRP A 41 2.600 -10.572 2.796 1.00 0.00 H new ATOM 0 HB2 TRP A 41 1.944 -8.317 2.164 1.00 0.00 H new ATOM 0 HB3 TRP A 41 2.006 -7.763 3.825 1.00 0.00 H new ATOM 0 HD1 TRP A 41 4.316 -8.890 0.964 1.00 0.00 H new ATOM 0 HE1 TRP A 41 6.710 -8.008 1.385 1.00 0.00 H new ATOM 0 HE3 TRP A 41 3.617 -6.851 5.592 1.00 0.00 H new ATOM 0 HZ2 TRP A 41 8.076 -6.540 3.443 1.00 0.00 H new ATOM 0 HZ3 TRP A 41 5.470 -5.667 6.732 1.00 0.00 H new ATOM 0 HH2 TRP A 41 7.699 -5.517 5.667 1.00 0.00 H new ATOM 351 N ILE A 42 2.912 -9.671 5.949 1.00 0.00 N ATOM 352 CA ILE A 42 3.750 -9.876 7.126 1.00 0.00 C ATOM 353 C ILE A 42 3.795 -11.361 7.490 1.00 0.00 C ATOM 354 O ILE A 42 4.848 -11.891 7.845 1.00 0.00 O ATOM 355 CB ILE A 42 3.209 -9.054 8.310 1.00 0.00 C ATOM 356 CG1 ILE A 42 4.289 -8.926 9.389 1.00 0.00 C ATOM 357 CG2 ILE A 42 1.973 -9.737 8.919 1.00 0.00 C ATOM 358 CD1 ILE A 42 3.810 -7.951 10.468 1.00 0.00 C ATOM 0 H ILE A 42 2.065 -9.128 6.116 1.00 0.00 H new ATOM 0 HA ILE A 42 4.762 -9.541 6.900 1.00 0.00 H new ATOM 0 HB ILE A 42 2.930 -8.066 7.944 1.00 0.00 H new ATOM 0 HG12 ILE A 42 4.497 -9.901 9.830 1.00 0.00 H new ATOM 0 HG13 ILE A 42 5.220 -8.570 8.948 1.00 0.00 H new ATOM 0 HG21 ILE A 42 1.604 -9.143 9.755 1.00 0.00 H new ATOM 0 HG22 ILE A 42 1.194 -9.822 8.161 1.00 0.00 H new ATOM 0 HG23 ILE A 42 2.244 -10.732 9.273 1.00 0.00 H new ATOM 0 HD11 ILE A 42 4.575 -7.856 11.238 1.00 0.00 H new ATOM 0 HD12 ILE A 42 3.624 -6.975 10.020 1.00 0.00 H new ATOM 0 HD13 ILE A 42 2.890 -8.327 10.915 1.00 0.00 H new ATOM 370 N LEU A 43 2.646 -12.025 7.392 1.00 0.00 N ATOM 371 CA LEU A 43 2.564 -13.444 7.709 1.00 0.00 C ATOM 372 C LEU A 43 3.439 -14.254 6.762 1.00 0.00 C ATOM 373 O LEU A 43 4.111 -15.200 7.176 1.00 0.00 O ATOM 374 CB LEU A 43 1.107 -13.920 7.607 1.00 0.00 C ATOM 375 CG LEU A 43 1.014 -15.433 7.871 1.00 0.00 C ATOM 376 CD1 LEU A 43 1.621 -15.773 9.241 1.00 0.00 C ATOM 377 CD2 LEU A 43 -0.459 -15.851 7.846 1.00 0.00 C ATOM 0 H LEU A 43 1.765 -11.604 7.097 1.00 0.00 H new ATOM 0 HA LEU A 43 2.921 -13.593 8.728 1.00 0.00 H new ATOM 0 HB2 LEU A 43 0.491 -13.381 8.327 1.00 0.00 H new ATOM 0 HB3 LEU A 43 0.713 -13.693 6.617 1.00 0.00 H new ATOM 0 HG LEU A 43 1.569 -15.969 7.100 1.00 0.00 H new ATOM 0 HD11 LEU A 43 1.548 -16.847 9.415 1.00 0.00 H new ATOM 0 HD12 LEU A 43 2.669 -15.472 9.260 1.00 0.00 H new ATOM 0 HD13 LEU A 43 1.077 -15.242 10.022 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -0.536 -16.922 8.032 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -1.004 -15.308 8.618 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -0.886 -15.621 6.870 1.00 0.00 H new ATOM 389 N ASP A 44 3.423 -13.883 5.486 1.00 0.00 N ATOM 390 CA ASP A 44 4.216 -14.590 4.489 1.00 0.00 C ATOM 391 C ASP A 44 5.685 -14.599 4.888 1.00 0.00 C ATOM 392 O ASP A 44 6.349 -15.634 4.823 1.00 0.00 O ATOM 393 CB ASP A 44 4.065 -13.918 3.124 1.00 0.00 C ATOM 394 CG ASP A 44 4.801 -14.730 2.065 1.00 0.00 C ATOM 395 OD1 ASP A 44 5.487 -15.667 2.436 1.00 0.00 O ATOM 396 OD2 ASP A 44 4.670 -14.401 0.897 1.00 0.00 O ATOM 0 H ASP A 44 2.875 -13.104 5.121 1.00 0.00 H new ATOM 0 HA ASP A 44 3.856 -15.617 4.429 1.00 0.00 H new ATOM 0 HB2 ASP A 44 3.010 -13.835 2.864 1.00 0.00 H new ATOM 0 HB3 ASP A 44 4.464 -12.905 3.161 1.00 0.00 H new ATOM 401 N ARG A 45 6.190 -13.444 5.305 1.00 0.00 N ATOM 402 CA ARG A 45 7.585 -13.341 5.716 1.00 0.00 C ATOM 403 C ARG A 45 7.846 -14.192 6.955 1.00 0.00 C ATOM 404 O ARG A 45 8.989 -14.540 7.250 1.00 0.00 O ATOM 405 CB ARG A 45 7.942 -11.884 6.017 1.00 0.00 C ATOM 406 CG ARG A 45 7.948 -11.074 4.720 1.00 0.00 C ATOM 407 CD ARG A 45 8.225 -9.606 5.047 1.00 0.00 C ATOM 408 NE ARG A 45 9.561 -9.462 5.611 1.00 0.00 N ATOM 409 CZ ARG A 45 9.908 -8.376 6.291 1.00 0.00 C ATOM 410 NH1 ARG A 45 9.042 -7.417 6.475 1.00 0.00 N ATOM 411 NH2 ARG A 45 11.114 -8.269 6.780 1.00 0.00 N ATOM 0 H ARG A 45 5.661 -12.574 5.367 1.00 0.00 H new ATOM 0 HA ARG A 45 8.207 -13.705 4.898 1.00 0.00 H new ATOM 0 HB2 ARG A 45 7.222 -11.461 6.718 1.00 0.00 H new ATOM 0 HB3 ARG A 45 8.920 -11.831 6.494 1.00 0.00 H new ATOM 0 HG2 ARG A 45 8.709 -11.458 4.041 1.00 0.00 H new ATOM 0 HG3 ARG A 45 6.989 -11.171 4.212 1.00 0.00 H new ATOM 0 HD2 ARG A 45 8.136 -9.001 4.145 1.00 0.00 H new ATOM 0 HD3 ARG A 45 7.482 -9.236 5.753 1.00 0.00 H new ATOM 0 HE ARG A 45 10.242 -10.210 5.481 1.00 0.00 H new ATOM 0 HH11 ARG A 45 8.099 -7.502 6.096 1.00 0.00 H new ATOM 0 HH12 ARG A 45 9.308 -6.583 6.997 1.00 0.00 H new ATOM 0 HH21 ARG A 45 11.790 -9.020 6.640 1.00 0.00 H new ATOM 0 HH22 ARG A 45 11.380 -7.434 7.302 1.00 0.00 H new ATOM 425 N LEU A 46 6.785 -14.511 7.690 1.00 0.00 N ATOM 426 CA LEU A 46 6.927 -15.309 8.904 1.00 0.00 C ATOM 427 C LEU A 46 7.506 -16.688 8.565 1.00 0.00 C ATOM 428 O LEU A 46 8.424 -17.169 9.230 1.00 0.00 O ATOM 429 CB LEU A 46 5.550 -15.460 9.577 1.00 0.00 C ATOM 430 CG LEU A 46 5.703 -15.703 11.087 1.00 0.00 C ATOM 431 CD1 LEU A 46 4.311 -15.796 11.716 1.00 0.00 C ATOM 432 CD2 LEU A 46 6.478 -17.004 11.349 1.00 0.00 C ATOM 0 H LEU A 46 5.828 -14.233 7.470 1.00 0.00 H new ATOM 0 HA LEU A 46 7.610 -14.807 9.589 1.00 0.00 H new ATOM 0 HB2 LEU A 46 4.957 -14.561 9.407 1.00 0.00 H new ATOM 0 HB3 LEU A 46 5.008 -16.290 9.124 1.00 0.00 H new ATOM 0 HG LEU A 46 6.260 -14.877 11.529 1.00 0.00 H new ATOM 0 HD11 LEU A 46 4.407 -15.968 12.788 1.00 0.00 H new ATOM 0 HD12 LEU A 46 3.772 -14.864 11.545 1.00 0.00 H new ATOM 0 HD13 LEU A 46 3.762 -16.622 11.263 1.00 0.00 H new ATOM 0 HD21 LEU A 46 6.576 -17.159 12.423 1.00 0.00 H new ATOM 0 HD22 LEU A 46 5.939 -17.843 10.909 1.00 0.00 H new ATOM 0 HD23 LEU A 46 7.469 -16.934 10.901 1.00 0.00 H new ATOM 444 N PHE A 47 6.973 -17.315 7.519 1.00 0.00 N ATOM 445 CA PHE A 47 7.454 -18.631 7.106 1.00 0.00 C ATOM 446 C PHE A 47 8.919 -18.564 6.689 1.00 0.00 C ATOM 447 O PHE A 47 9.722 -19.413 7.077 1.00 0.00 O ATOM 448 CB PHE A 47 6.613 -19.163 5.943 1.00 0.00 C ATOM 449 CG PHE A 47 5.236 -19.529 6.443 1.00 0.00 C ATOM 450 CD1 PHE A 47 5.042 -20.730 7.137 1.00 0.00 C ATOM 451 CD2 PHE A 47 4.154 -18.667 6.220 1.00 0.00 C ATOM 452 CE1 PHE A 47 3.768 -21.070 7.607 1.00 0.00 C ATOM 453 CE2 PHE A 47 2.880 -19.007 6.691 1.00 0.00 C ATOM 454 CZ PHE A 47 2.687 -20.209 7.385 1.00 0.00 C ATOM 0 H PHE A 47 6.217 -16.939 6.948 1.00 0.00 H new ATOM 0 HA PHE A 47 7.361 -19.307 7.956 1.00 0.00 H new ATOM 0 HB2 PHE A 47 6.538 -18.409 5.160 1.00 0.00 H new ATOM 0 HB3 PHE A 47 7.095 -20.035 5.501 1.00 0.00 H new ATOM 0 HD1 PHE A 47 5.876 -21.394 7.310 1.00 0.00 H new ATOM 0 HD2 PHE A 47 4.303 -17.741 5.685 1.00 0.00 H new ATOM 0 HE1 PHE A 47 3.619 -21.997 8.141 1.00 0.00 H new ATOM 0 HE2 PHE A 47 2.046 -18.343 6.519 1.00 0.00 H new ATOM 0 HZ PHE A 47 1.704 -20.471 7.749 1.00 0.00 H new ATOM 464 N PHE A 48 9.262 -17.549 5.898 1.00 0.00 N ATOM 465 CA PHE A 48 10.641 -17.372 5.430 1.00 0.00 C ATOM 466 C PHE A 48 11.103 -15.940 5.662 1.00 0.00 C ATOM 467 O PHE A 48 10.370 -14.988 5.391 1.00 0.00 O ATOM 468 CB PHE A 48 10.723 -17.704 3.939 1.00 0.00 C ATOM 469 CG PHE A 48 10.445 -19.176 3.741 1.00 0.00 C ATOM 470 CD1 PHE A 48 11.491 -20.103 3.814 1.00 0.00 C ATOM 471 CD2 PHE A 48 9.137 -19.613 3.488 1.00 0.00 C ATOM 472 CE1 PHE A 48 11.231 -21.467 3.630 1.00 0.00 C ATOM 473 CE2 PHE A 48 8.879 -20.975 3.306 1.00 0.00 C ATOM 474 CZ PHE A 48 9.925 -21.903 3.378 1.00 0.00 C ATOM 0 H PHE A 48 8.610 -16.838 5.567 1.00 0.00 H new ATOM 0 HA PHE A 48 11.291 -18.044 5.991 1.00 0.00 H new ATOM 0 HB2 PHE A 48 10.001 -17.107 3.381 1.00 0.00 H new ATOM 0 HB3 PHE A 48 11.711 -17.453 3.552 1.00 0.00 H new ATOM 0 HD1 PHE A 48 12.498 -19.767 4.012 1.00 0.00 H new ATOM 0 HD2 PHE A 48 8.329 -18.898 3.434 1.00 0.00 H new ATOM 0 HE1 PHE A 48 12.038 -22.182 3.683 1.00 0.00 H new ATOM 0 HE2 PHE A 48 7.872 -21.312 3.110 1.00 0.00 H new ATOM 0 HZ PHE A 48 9.724 -22.955 3.239 1.00 0.00 H new ATOM 484 N LYS A 49 12.325 -15.791 6.164 1.00 0.00 N ATOM 485 CA LYS A 49 12.876 -14.468 6.432 1.00 0.00 C ATOM 486 C LYS A 49 13.408 -13.838 5.148 1.00 0.00 C ATOM 487 O LYS A 49 13.951 -12.749 5.225 1.00 0.00 O ATOM 488 CB LYS A 49 14.007 -14.572 7.457 1.00 0.00 C ATOM 489 CG LYS A 49 13.434 -15.012 8.805 1.00 0.00 C ATOM 490 CD LYS A 49 14.565 -15.129 9.828 1.00 0.00 C ATOM 491 CE LYS A 49 13.993 -15.570 11.178 1.00 0.00 C ATOM 492 NZ LYS A 49 15.098 -15.692 12.170 1.00 0.00 N ATOM 493 OXT LYS A 49 13.262 -14.457 4.105 1.00 0.00 O ATOM 0 H LYS A 49 12.949 -16.565 6.392 1.00 0.00 H new ATOM 0 HA LYS A 49 12.081 -13.838 6.830 1.00 0.00 H new ATOM 0 HB2 LYS A 49 14.756 -15.287 7.117 1.00 0.00 H new ATOM 0 HB3 LYS A 49 14.509 -13.610 7.560 1.00 0.00 H new ATOM 0 HG2 LYS A 49 12.692 -14.292 9.149 1.00 0.00 H new ATOM 0 HG3 LYS A 49 12.924 -15.970 8.700 1.00 0.00 H new ATOM 0 HD2 LYS A 49 15.307 -15.849 9.484 1.00 0.00 H new ATOM 0 HD3 LYS A 49 15.075 -14.171 9.933 1.00 0.00 H new ATOM 0 HE2 LYS A 49 13.256 -14.847 11.526 1.00 0.00 H new ATOM 0 HE3 LYS A 49 13.478 -16.525 11.072 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 14.710 -15.992 13.087 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 15.786 -16.398 11.838 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 15.571 -14.772 12.278 1.00 0.00 H new TER 507 LYS A 49 ATOM 508 N SER B 19 -17.364 20.247 -3.389 1.00 0.00 N ATOM 509 CA SER B 19 -16.567 19.836 -4.579 1.00 0.00 C ATOM 510 C SER B 19 -16.523 18.315 -4.659 1.00 0.00 C ATOM 511 O SER B 19 -15.622 17.740 -5.270 1.00 0.00 O ATOM 512 CB SER B 19 -15.148 20.394 -4.456 1.00 0.00 C ATOM 513 OG SER B 19 -14.627 20.069 -3.174 1.00 0.00 O ATOM 0 HA SER B 19 -17.029 20.228 -5.485 1.00 0.00 H new ATOM 0 HB2 SER B 19 -14.512 19.977 -5.237 1.00 0.00 H new ATOM 0 HB3 SER B 19 -15.156 21.475 -4.595 1.00 0.00 H new ATOM 0 HG SER B 19 -15.359 20.034 -2.523 1.00 0.00 H new ATOM 521 N ASN B 20 -17.504 17.667 -4.039 1.00 0.00 N ATOM 522 CA ASN B 20 -17.569 16.212 -4.046 1.00 0.00 C ATOM 523 C ASN B 20 -17.810 15.692 -5.460 1.00 0.00 C ATOM 524 O ASN B 20 -17.402 14.582 -5.803 1.00 0.00 O ATOM 525 CB ASN B 20 -18.693 15.735 -3.124 1.00 0.00 C ATOM 526 CG ASN B 20 -20.015 16.375 -3.535 1.00 0.00 C ATOM 527 OD1 ASN B 20 -20.086 17.049 -4.561 1.00 0.00 O ATOM 528 ND2 ASN B 20 -21.073 16.201 -2.791 1.00 0.00 N ATOM 0 H ASN B 20 -18.260 18.124 -3.529 1.00 0.00 H new ATOM 0 HA ASN B 20 -16.616 15.823 -3.687 1.00 0.00 H new ATOM 0 HB2 ASN B 20 -18.776 14.649 -3.170 1.00 0.00 H new ATOM 0 HB3 ASN B 20 -18.461 15.993 -2.091 1.00 0.00 H new ATOM 0 HD21 ASN B 20 -21.961 16.624 -3.060 1.00 0.00 H new ATOM 0 HD22 ASN B 20 -21.012 15.642 -1.940 1.00 0.00 H new ATOM 535 N ASP B 21 -18.477 16.502 -6.277 1.00 0.00 N ATOM 536 CA ASP B 21 -18.766 16.114 -7.653 1.00 0.00 C ATOM 537 C ASP B 21 -17.474 15.916 -8.439 1.00 0.00 C ATOM 538 O ASP B 21 -17.340 14.961 -9.203 1.00 0.00 O ATOM 539 CB ASP B 21 -19.616 17.191 -8.331 1.00 0.00 C ATOM 540 CG ASP B 21 -21.036 17.164 -7.775 1.00 0.00 C ATOM 541 OD1 ASP B 21 -21.377 16.193 -7.121 1.00 0.00 O ATOM 542 OD2 ASP B 21 -21.761 18.117 -8.011 1.00 0.00 O ATOM 0 H ASP B 21 -18.825 17.424 -6.013 1.00 0.00 H new ATOM 0 HA ASP B 21 -19.315 15.173 -7.636 1.00 0.00 H new ATOM 0 HB2 ASP B 21 -19.172 18.173 -8.167 1.00 0.00 H new ATOM 0 HB3 ASP B 21 -19.636 17.025 -9.408 1.00 0.00 H new ATOM 547 N SER B 22 -16.525 16.826 -8.246 1.00 0.00 N ATOM 548 CA SER B 22 -15.249 16.739 -8.942 1.00 0.00 C ATOM 549 C SER B 22 -14.517 15.458 -8.555 1.00 0.00 C ATOM 550 O SER B 22 -13.950 14.775 -9.408 1.00 0.00 O ATOM 551 CB SER B 22 -14.382 17.950 -8.599 1.00 0.00 C ATOM 552 OG SER B 22 -13.162 17.877 -9.326 1.00 0.00 O ATOM 0 H SER B 22 -16.615 17.625 -7.619 1.00 0.00 H new ATOM 0 HA SER B 22 -15.441 16.725 -10.015 1.00 0.00 H new ATOM 0 HB2 SER B 22 -14.910 18.871 -8.845 1.00 0.00 H new ATOM 0 HB3 SER B 22 -14.179 17.975 -7.528 1.00 0.00 H new ATOM 0 HG SER B 22 -12.605 18.653 -9.109 1.00 0.00 H new ATOM 558 N SER B 23 -14.530 15.138 -7.263 1.00 0.00 N ATOM 559 CA SER B 23 -13.859 13.936 -6.777 1.00 0.00 C ATOM 560 C SER B 23 -12.475 13.812 -7.411 1.00 0.00 C ATOM 561 O SER B 23 -12.327 13.239 -8.489 1.00 0.00 O ATOM 562 CB SER B 23 -14.692 12.698 -7.115 1.00 0.00 C ATOM 563 OG SER B 23 -13.841 11.561 -7.173 1.00 0.00 O ATOM 0 H SER B 23 -14.993 15.689 -6.540 1.00 0.00 H new ATOM 0 HA SER B 23 -13.750 14.011 -5.695 1.00 0.00 H new ATOM 0 HB2 SER B 23 -15.466 12.549 -6.362 1.00 0.00 H new ATOM 0 HB3 SER B 23 -15.199 12.836 -8.070 1.00 0.00 H new ATOM 0 HG SER B 23 -13.240 11.641 -7.943 1.00 0.00 H new ATOM 569 N ASP B 24 -11.468 14.362 -6.739 1.00 0.00 N ATOM 570 CA ASP B 24 -10.102 14.317 -7.254 1.00 0.00 C ATOM 571 C ASP B 24 -9.721 12.884 -7.647 1.00 0.00 C ATOM 572 O ASP B 24 -10.196 11.923 -7.040 1.00 0.00 O ATOM 573 CB ASP B 24 -9.127 14.837 -6.189 1.00 0.00 C ATOM 574 CG ASP B 24 -9.172 16.362 -6.134 1.00 0.00 C ATOM 575 OD1 ASP B 24 -8.594 16.983 -7.010 1.00 0.00 O ATOM 576 OD2 ASP B 24 -9.780 16.885 -5.215 1.00 0.00 O ATOM 0 H ASP B 24 -11.570 14.840 -5.844 1.00 0.00 H new ATOM 0 HA ASP B 24 -10.044 14.950 -8.140 1.00 0.00 H new ATOM 0 HB2 ASP B 24 -9.386 14.423 -5.215 1.00 0.00 H new ATOM 0 HB3 ASP B 24 -8.115 14.504 -6.418 1.00 0.00 H new ATOM 581 N PRO B 25 -8.875 12.719 -8.640 1.00 0.00 N ATOM 582 CA PRO B 25 -8.432 11.366 -9.102 1.00 0.00 C ATOM 583 C PRO B 25 -7.551 10.667 -8.066 1.00 0.00 C ATOM 584 O PRO B 25 -7.346 9.456 -8.131 1.00 0.00 O ATOM 585 CB PRO B 25 -7.653 11.657 -10.397 1.00 0.00 C ATOM 586 CG PRO B 25 -7.173 13.065 -10.247 1.00 0.00 C ATOM 587 CD PRO B 25 -8.244 13.792 -9.432 1.00 0.00 C ATOM 0 HA PRO B 25 -9.271 10.688 -9.256 1.00 0.00 H new ATOM 0 HB2 PRO B 25 -6.819 10.966 -10.520 1.00 0.00 H new ATOM 0 HB3 PRO B 25 -8.290 11.548 -11.275 1.00 0.00 H new ATOM 0 HG2 PRO B 25 -6.209 13.096 -9.740 1.00 0.00 H new ATOM 0 HG3 PRO B 25 -7.037 13.536 -11.220 1.00 0.00 H new ATOM 0 HD2 PRO B 25 -7.807 14.558 -8.791 1.00 0.00 H new ATOM 0 HD3 PRO B 25 -8.967 14.291 -10.077 1.00 0.00 H new ATOM 595 N LEU B 26 -7.024 11.439 -7.120 1.00 0.00 N ATOM 596 CA LEU B 26 -6.157 10.879 -6.088 1.00 0.00 C ATOM 597 C LEU B 26 -6.917 9.854 -5.245 1.00 0.00 C ATOM 598 O LEU B 26 -6.391 8.785 -4.934 1.00 0.00 O ATOM 599 CB LEU B 26 -5.630 12.009 -5.187 1.00 0.00 C ATOM 600 CG LEU B 26 -4.450 12.711 -5.866 1.00 0.00 C ATOM 601 CD1 LEU B 26 -4.874 13.190 -7.256 1.00 0.00 C ATOM 602 CD2 LEU B 26 -4.019 13.915 -5.024 1.00 0.00 C ATOM 0 H LEU B 26 -7.180 12.444 -7.046 1.00 0.00 H new ATOM 0 HA LEU B 26 -5.318 10.377 -6.570 1.00 0.00 H new ATOM 0 HB2 LEU B 26 -6.425 12.727 -4.987 1.00 0.00 H new ATOM 0 HB3 LEU B 26 -5.318 11.603 -4.225 1.00 0.00 H new ATOM 0 HG LEU B 26 -3.617 12.014 -5.958 1.00 0.00 H new ATOM 0 HD11 LEU B 26 -4.035 13.690 -7.740 1.00 0.00 H new ATOM 0 HD12 LEU B 26 -5.183 12.335 -7.857 1.00 0.00 H new ATOM 0 HD13 LEU B 26 -5.707 13.887 -7.162 1.00 0.00 H new ATOM 0 HD21 LEU B 26 -3.179 14.415 -5.507 1.00 0.00 H new ATOM 0 HD22 LEU B 26 -4.852 14.612 -4.932 1.00 0.00 H new ATOM 0 HD23 LEU B 26 -3.718 13.577 -4.032 1.00 0.00 H new ATOM 614 N VAL B 27 -8.153 10.185 -4.879 1.00 0.00 N ATOM 615 CA VAL B 27 -8.965 9.279 -4.073 1.00 0.00 C ATOM 616 C VAL B 27 -9.269 7.994 -4.842 1.00 0.00 C ATOM 617 O VAL B 27 -9.096 6.888 -4.324 1.00 0.00 O ATOM 618 CB VAL B 27 -10.277 9.967 -3.687 1.00 0.00 C ATOM 619 CG1 VAL B 27 -11.180 8.979 -2.944 1.00 0.00 C ATOM 620 CG2 VAL B 27 -9.977 11.165 -2.784 1.00 0.00 C ATOM 0 H VAL B 27 -8.610 11.063 -5.125 1.00 0.00 H new ATOM 0 HA VAL B 27 -8.406 9.022 -3.173 1.00 0.00 H new ATOM 0 HB VAL B 27 -10.785 10.309 -4.589 1.00 0.00 H new ATOM 0 HG11 VAL B 27 -12.113 9.473 -2.671 1.00 0.00 H new ATOM 0 HG12 VAL B 27 -11.396 8.127 -3.589 1.00 0.00 H new ATOM 0 HG13 VAL B 27 -10.676 8.633 -2.042 1.00 0.00 H new ATOM 0 HG21 VAL B 27 -10.910 11.656 -2.508 1.00 0.00 H new ATOM 0 HG22 VAL B 27 -9.467 10.823 -1.883 1.00 0.00 H new ATOM 0 HG23 VAL B 27 -9.339 11.871 -3.316 1.00 0.00 H new ATOM 630 N VAL B 28 -9.722 8.151 -6.082 1.00 0.00 N ATOM 631 CA VAL B 28 -10.048 7.002 -6.918 1.00 0.00 C ATOM 632 C VAL B 28 -8.792 6.199 -7.229 1.00 0.00 C ATOM 633 O VAL B 28 -8.794 4.970 -7.162 1.00 0.00 O ATOM 634 CB VAL B 28 -10.701 7.470 -8.220 1.00 0.00 C ATOM 635 CG1 VAL B 28 -10.945 6.266 -9.133 1.00 0.00 C ATOM 636 CG2 VAL B 28 -12.035 8.147 -7.905 1.00 0.00 C ATOM 0 H VAL B 28 -9.871 9.056 -6.527 1.00 0.00 H new ATOM 0 HA VAL B 28 -10.747 6.365 -6.376 1.00 0.00 H new ATOM 0 HB VAL B 28 -10.041 8.178 -8.722 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -11.410 6.601 -10.060 1.00 0.00 H new ATOM 0 HG12 VAL B 28 -9.995 5.782 -9.358 1.00 0.00 H new ATOM 0 HG13 VAL B 28 -11.604 5.557 -8.632 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -12.501 8.481 -8.832 1.00 0.00 H new ATOM 0 HG22 VAL B 28 -12.693 7.438 -7.403 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -11.863 9.005 -7.256 1.00 0.00 H new ATOM 646 N ALA B 29 -7.719 6.905 -7.569 1.00 0.00 N ATOM 647 CA ALA B 29 -6.458 6.254 -7.892 1.00 0.00 C ATOM 648 C ALA B 29 -5.927 5.496 -6.681 1.00 0.00 C ATOM 649 O ALA B 29 -5.405 4.392 -6.812 1.00 0.00 O ATOM 650 CB ALA B 29 -5.429 7.296 -8.333 1.00 0.00 C ATOM 0 H ALA B 29 -7.698 7.923 -7.627 1.00 0.00 H new ATOM 0 HA ALA B 29 -6.631 5.549 -8.705 1.00 0.00 H new ATOM 0 HB1 ALA B 29 -4.489 6.800 -8.573 1.00 0.00 H new ATOM 0 HB2 ALA B 29 -5.797 7.821 -9.214 1.00 0.00 H new ATOM 0 HB3 ALA B 29 -5.267 8.011 -7.527 1.00 0.00 H new ATOM 656 N ALA B 30 -6.066 6.090 -5.501 1.00 0.00 N ATOM 657 CA ALA B 30 -5.590 5.447 -4.284 1.00 0.00 C ATOM 658 C ALA B 30 -6.191 4.052 -4.152 1.00 0.00 C ATOM 659 O ALA B 30 -5.474 3.076 -3.933 1.00 0.00 O ATOM 660 CB ALA B 30 -5.969 6.290 -3.065 1.00 0.00 C ATOM 0 H ALA B 30 -6.498 7.003 -5.362 1.00 0.00 H new ATOM 0 HA ALA B 30 -4.505 5.360 -4.338 1.00 0.00 H new ATOM 0 HB1 ALA B 30 -5.609 5.802 -2.159 1.00 0.00 H new ATOM 0 HB2 ALA B 30 -5.515 7.277 -3.150 1.00 0.00 H new ATOM 0 HB3 ALA B 30 -7.053 6.392 -3.016 1.00 0.00 H new ATOM 666 N SER B 31 -7.509 3.963 -4.298 1.00 0.00 N ATOM 667 CA SER B 31 -8.189 2.674 -4.202 1.00 0.00 C ATOM 668 C SER B 31 -7.711 1.725 -5.301 1.00 0.00 C ATOM 669 O SER B 31 -7.476 0.542 -5.055 1.00 0.00 O ATOM 670 CB SER B 31 -9.702 2.870 -4.314 1.00 0.00 C ATOM 671 OG SER B 31 -10.320 1.613 -4.554 1.00 0.00 O ATOM 0 H SER B 31 -8.122 4.757 -4.481 1.00 0.00 H new ATOM 0 HA SER B 31 -7.951 2.234 -3.234 1.00 0.00 H new ATOM 0 HB2 SER B 31 -10.092 3.311 -3.397 1.00 0.00 H new ATOM 0 HB3 SER B 31 -9.932 3.562 -5.124 1.00 0.00 H new ATOM 0 HG SER B 31 -11.290 1.734 -4.625 1.00 0.00 H new ATOM 677 N ILE B 32 -7.575 2.253 -6.516 1.00 0.00 N ATOM 678 CA ILE B 32 -7.133 1.448 -7.653 1.00 0.00 C ATOM 679 C ILE B 32 -5.715 0.924 -7.426 1.00 0.00 C ATOM 680 O ILE B 32 -5.421 -0.230 -7.723 1.00 0.00 O ATOM 681 CB ILE B 32 -7.182 2.276 -8.941 1.00 0.00 C ATOM 682 CG1 ILE B 32 -8.642 2.588 -9.285 1.00 0.00 C ATOM 683 CG2 ILE B 32 -6.552 1.481 -10.091 1.00 0.00 C ATOM 684 CD1 ILE B 32 -8.691 3.623 -10.410 1.00 0.00 C ATOM 0 H ILE B 32 -7.764 3.231 -6.738 1.00 0.00 H new ATOM 0 HA ILE B 32 -7.807 0.597 -7.750 1.00 0.00 H new ATOM 0 HB ILE B 32 -6.629 3.204 -8.796 1.00 0.00 H new ATOM 0 HG12 ILE B 32 -9.157 1.678 -9.591 1.00 0.00 H new ATOM 0 HG13 ILE B 32 -9.161 2.967 -8.405 1.00 0.00 H new ATOM 0 HG21 ILE B 32 -6.589 2.073 -11.005 1.00 0.00 H new ATOM 0 HG22 ILE B 32 -5.514 1.251 -9.849 1.00 0.00 H new ATOM 0 HG23 ILE B 32 -7.105 0.553 -10.237 1.00 0.00 H new ATOM 0 HD11 ILE B 32 -9.730 3.845 -10.655 1.00 0.00 H new ATOM 0 HD12 ILE B 32 -8.191 4.536 -10.086 1.00 0.00 H new ATOM 0 HD13 ILE B 32 -8.187 3.226 -11.291 1.00 0.00 H new ATOM 696 N ILE B 33 -4.843 1.778 -6.908 1.00 0.00 N ATOM 697 CA ILE B 33 -3.463 1.379 -6.659 1.00 0.00 C ATOM 698 C ILE B 33 -3.403 0.225 -5.660 1.00 0.00 C ATOM 699 O ILE B 33 -2.662 -0.738 -5.860 1.00 0.00 O ATOM 700 CB ILE B 33 -2.669 2.576 -6.115 1.00 0.00 C ATOM 701 CG1 ILE B 33 -2.468 3.609 -7.230 1.00 0.00 C ATOM 702 CG2 ILE B 33 -1.301 2.116 -5.583 1.00 0.00 C ATOM 703 CD1 ILE B 33 -2.005 4.929 -6.613 1.00 0.00 C ATOM 0 H ILE B 33 -5.062 2.741 -6.654 1.00 0.00 H new ATOM 0 HA ILE B 33 -3.025 1.045 -7.599 1.00 0.00 H new ATOM 0 HB ILE B 33 -3.230 3.027 -5.296 1.00 0.00 H new ATOM 0 HG12 ILE B 33 -1.729 3.250 -7.947 1.00 0.00 H new ATOM 0 HG13 ILE B 33 -3.399 3.756 -7.778 1.00 0.00 H new ATOM 0 HG21 ILE B 33 -0.751 2.976 -5.201 1.00 0.00 H new ATOM 0 HG22 ILE B 33 -1.447 1.393 -4.780 1.00 0.00 H new ATOM 0 HG23 ILE B 33 -0.734 1.652 -6.390 1.00 0.00 H new ATOM 0 HD11 ILE B 33 -1.860 5.668 -7.401 1.00 0.00 H new ATOM 0 HD12 ILE B 33 -2.760 5.288 -5.913 1.00 0.00 H new ATOM 0 HD13 ILE B 33 -1.065 4.773 -6.084 1.00 0.00 H new ATOM 715 N GLY B 34 -4.178 0.321 -4.588 1.00 0.00 N ATOM 716 CA GLY B 34 -4.182 -0.729 -3.579 1.00 0.00 C ATOM 717 C GLY B 34 -4.739 -2.036 -4.141 1.00 0.00 C ATOM 718 O GLY B 34 -4.107 -3.086 -4.028 1.00 0.00 O ATOM 0 H GLY B 34 -4.804 1.103 -4.396 1.00 0.00 H new ATOM 0 HA2 GLY B 34 -3.167 -0.890 -3.215 1.00 0.00 H new ATOM 0 HA3 GLY B 34 -4.781 -0.413 -2.725 1.00 0.00 H new ATOM 722 N ILE B 35 -5.924 -1.967 -4.739 1.00 0.00 N ATOM 723 CA ILE B 35 -6.555 -3.159 -5.305 1.00 0.00 C ATOM 724 C ILE B 35 -5.747 -3.704 -6.487 1.00 0.00 C ATOM 725 O ILE B 35 -5.538 -4.912 -6.601 1.00 0.00 O ATOM 726 CB ILE B 35 -7.978 -2.825 -5.762 1.00 0.00 C ATOM 727 CG1 ILE B 35 -8.843 -2.502 -4.539 1.00 0.00 C ATOM 728 CG2 ILE B 35 -8.580 -4.029 -6.498 1.00 0.00 C ATOM 729 CD1 ILE B 35 -10.172 -1.900 -4.997 1.00 0.00 C ATOM 0 H ILE B 35 -6.464 -1.108 -4.845 1.00 0.00 H new ATOM 0 HA ILE B 35 -6.589 -3.926 -4.531 1.00 0.00 H new ATOM 0 HB ILE B 35 -7.948 -1.965 -6.431 1.00 0.00 H new ATOM 0 HG12 ILE B 35 -9.023 -3.407 -3.959 1.00 0.00 H new ATOM 0 HG13 ILE B 35 -8.321 -1.803 -3.886 1.00 0.00 H new ATOM 0 HG21 ILE B 35 -9.593 -3.788 -6.822 1.00 0.00 H new ATOM 0 HG22 ILE B 35 -7.968 -4.267 -7.368 1.00 0.00 H new ATOM 0 HG23 ILE B 35 -8.608 -4.888 -5.828 1.00 0.00 H new ATOM 0 HD11 ILE B 35 -10.787 -1.671 -4.127 1.00 0.00 H new ATOM 0 HD12 ILE B 35 -9.983 -0.985 -5.559 1.00 0.00 H new ATOM 0 HD13 ILE B 35 -10.695 -2.614 -5.633 1.00 0.00 H new ATOM 741 N LEU B 36 -5.310 -2.808 -7.368 1.00 0.00 N ATOM 742 CA LEU B 36 -4.541 -3.213 -8.545 1.00 0.00 C ATOM 743 C LEU B 36 -3.223 -3.858 -8.132 1.00 0.00 C ATOM 744 O LEU B 36 -2.845 -4.909 -8.650 1.00 0.00 O ATOM 745 CB LEU B 36 -4.263 -1.988 -9.425 1.00 0.00 C ATOM 746 CG LEU B 36 -3.527 -2.404 -10.710 1.00 0.00 C ATOM 747 CD1 LEU B 36 -4.415 -3.338 -11.555 1.00 0.00 C ATOM 748 CD2 LEU B 36 -3.189 -1.145 -11.515 1.00 0.00 C ATOM 0 H LEU B 36 -5.473 -1.804 -7.292 1.00 0.00 H new ATOM 0 HA LEU B 36 -5.123 -3.943 -9.107 1.00 0.00 H new ATOM 0 HB2 LEU B 36 -5.201 -1.495 -9.680 1.00 0.00 H new ATOM 0 HB3 LEU B 36 -3.663 -1.265 -8.873 1.00 0.00 H new ATOM 0 HG LEU B 36 -2.613 -2.937 -10.449 1.00 0.00 H new ATOM 0 HD11 LEU B 36 -3.882 -3.625 -12.462 1.00 0.00 H new ATOM 0 HD12 LEU B 36 -4.656 -4.231 -10.978 1.00 0.00 H new ATOM 0 HD13 LEU B 36 -5.336 -2.820 -11.824 1.00 0.00 H new ATOM 0 HD21 LEU B 36 -2.667 -1.427 -12.429 1.00 0.00 H new ATOM 0 HD22 LEU B 36 -4.109 -0.619 -11.770 1.00 0.00 H new ATOM 0 HD23 LEU B 36 -2.551 -0.492 -10.919 1.00 0.00 H new ATOM 760 N HIS B 37 -2.532 -3.226 -7.193 1.00 0.00 N ATOM 761 CA HIS B 37 -1.262 -3.754 -6.718 1.00 0.00 C ATOM 762 C HIS B 37 -1.458 -5.139 -6.119 1.00 0.00 C ATOM 763 O HIS B 37 -0.634 -6.032 -6.316 1.00 0.00 O ATOM 764 CB HIS B 37 -0.655 -2.825 -5.666 1.00 0.00 C ATOM 765 CG HIS B 37 0.664 -3.391 -5.215 1.00 0.00 C ATOM 766 ND1 HIS B 37 1.864 -2.732 -5.416 1.00 0.00 N ATOM 767 CD2 HIS B 37 0.986 -4.566 -4.589 1.00 0.00 C ATOM 768 CE1 HIS B 37 2.842 -3.513 -4.918 1.00 0.00 C ATOM 769 NE2 HIS B 37 2.359 -4.641 -4.402 1.00 0.00 N ATOM 0 H HIS B 37 -2.826 -2.356 -6.749 1.00 0.00 H new ATOM 0 HA HIS B 37 -0.582 -3.822 -7.567 1.00 0.00 H new ATOM 0 HB2 HIS B 37 -0.514 -1.827 -6.081 1.00 0.00 H new ATOM 0 HB3 HIS B 37 -1.331 -2.724 -4.817 1.00 0.00 H new ATOM 0 HD2 HIS B 37 0.277 -5.322 -4.286 1.00 0.00 H new ATOM 0 HE1 HIS B 37 3.891 -3.255 -4.935 1.00 0.00 H new ATOM 0 HE2 HIS B 37 2.885 -5.397 -3.964 1.00 0.00 H new ATOM 777 N LEU B 38 -2.548 -5.309 -5.380 1.00 0.00 N ATOM 778 CA LEU B 38 -2.828 -6.589 -4.740 1.00 0.00 C ATOM 779 C LEU B 38 -2.970 -7.700 -5.772 1.00 0.00 C ATOM 780 O LEU B 38 -2.510 -8.811 -5.541 1.00 0.00 O ATOM 781 CB LEU B 38 -4.119 -6.493 -3.896 1.00 0.00 C ATOM 782 CG LEU B 38 -3.801 -6.020 -2.465 1.00 0.00 C ATOM 783 CD1 LEU B 38 -5.088 -5.516 -1.791 1.00 0.00 C ATOM 784 CD2 LEU B 38 -3.218 -7.184 -1.637 1.00 0.00 C ATOM 0 H LEU B 38 -3.246 -4.585 -5.210 1.00 0.00 H new ATOM 0 HA LEU B 38 -1.987 -6.829 -4.089 1.00 0.00 H new ATOM 0 HB2 LEU B 38 -4.816 -5.800 -4.367 1.00 0.00 H new ATOM 0 HB3 LEU B 38 -4.610 -7.465 -3.862 1.00 0.00 H new ATOM 0 HG LEU B 38 -3.070 -5.213 -2.516 1.00 0.00 H new ATOM 0 HD11 LEU B 38 -4.862 -5.182 -0.779 1.00 0.00 H new ATOM 0 HD12 LEU B 38 -5.498 -4.685 -2.365 1.00 0.00 H new ATOM 0 HD13 LEU B 38 -5.818 -6.324 -1.751 1.00 0.00 H new ATOM 0 HD21 LEU B 38 -2.997 -6.837 -0.627 1.00 0.00 H new ATOM 0 HD22 LEU B 38 -3.943 -7.997 -1.591 1.00 0.00 H new ATOM 0 HD23 LEU B 38 -2.301 -7.541 -2.107 1.00 0.00 H new ATOM 796 N ILE B 39 -3.616 -7.410 -6.891 1.00 0.00 N ATOM 797 CA ILE B 39 -3.803 -8.428 -7.915 1.00 0.00 C ATOM 798 C ILE B 39 -2.448 -8.890 -8.450 1.00 0.00 C ATOM 799 O ILE B 39 -2.207 -10.086 -8.609 1.00 0.00 O ATOM 800 CB ILE B 39 -4.645 -7.858 -9.054 1.00 0.00 C ATOM 801 CG1 ILE B 39 -6.052 -7.554 -8.532 1.00 0.00 C ATOM 802 CG2 ILE B 39 -4.741 -8.887 -10.183 1.00 0.00 C ATOM 803 CD1 ILE B 39 -6.815 -6.716 -9.560 1.00 0.00 C ATOM 0 H ILE B 39 -4.013 -6.497 -7.112 1.00 0.00 H new ATOM 0 HA ILE B 39 -4.318 -9.284 -7.479 1.00 0.00 H new ATOM 0 HB ILE B 39 -4.182 -6.946 -9.430 1.00 0.00 H new ATOM 0 HG12 ILE B 39 -6.587 -8.484 -8.338 1.00 0.00 H new ATOM 0 HG13 ILE B 39 -5.991 -7.018 -7.585 1.00 0.00 H new ATOM 0 HG21 ILE B 39 -5.342 -8.480 -10.996 1.00 0.00 H new ATOM 0 HG22 ILE B 39 -3.741 -9.118 -10.551 1.00 0.00 H new ATOM 0 HG23 ILE B 39 -5.208 -9.797 -9.807 1.00 0.00 H new ATOM 0 HD11 ILE B 39 -7.816 -6.502 -9.184 1.00 0.00 H new ATOM 0 HD12 ILE B 39 -6.284 -5.780 -9.732 1.00 0.00 H new ATOM 0 HD13 ILE B 39 -6.889 -7.268 -10.497 1.00 0.00 H new ATOM 815 N LEU B 40 -1.562 -7.938 -8.722 1.00 0.00 N ATOM 816 CA LEU B 40 -0.233 -8.273 -9.226 1.00 0.00 C ATOM 817 C LEU B 40 0.623 -8.931 -8.139 1.00 0.00 C ATOM 818 O LEU B 40 1.322 -9.910 -8.398 1.00 0.00 O ATOM 819 CB LEU B 40 0.460 -7.003 -9.750 1.00 0.00 C ATOM 820 CG LEU B 40 0.003 -6.704 -11.192 1.00 0.00 C ATOM 821 CD1 LEU B 40 0.564 -7.762 -12.171 1.00 0.00 C ATOM 822 CD2 LEU B 40 -1.535 -6.704 -11.252 1.00 0.00 C ATOM 0 H LEU B 40 -1.735 -6.940 -8.604 1.00 0.00 H new ATOM 0 HA LEU B 40 -0.346 -8.987 -10.042 1.00 0.00 H new ATOM 0 HB2 LEU B 40 0.224 -6.158 -9.103 1.00 0.00 H new ATOM 0 HB3 LEU B 40 1.542 -7.133 -9.723 1.00 0.00 H new ATOM 0 HG LEU B 40 0.382 -5.725 -11.486 1.00 0.00 H new ATOM 0 HD11 LEU B 40 0.231 -7.534 -13.183 1.00 0.00 H new ATOM 0 HD12 LEU B 40 1.653 -7.749 -12.136 1.00 0.00 H new ATOM 0 HD13 LEU B 40 0.204 -8.750 -11.884 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -1.859 -6.493 -12.271 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -1.911 -7.680 -10.947 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -1.925 -5.939 -10.581 1.00 0.00 H new ATOM 834 N TRP B 41 0.576 -8.379 -6.928 1.00 0.00 N ATOM 835 CA TRP B 41 1.364 -8.914 -5.817 1.00 0.00 C ATOM 836 C TRP B 41 0.850 -10.284 -5.369 1.00 0.00 C ATOM 837 O TRP B 41 1.634 -11.216 -5.182 1.00 0.00 O ATOM 838 CB TRP B 41 1.352 -7.918 -4.648 1.00 0.00 C ATOM 839 CG TRP B 41 1.974 -8.533 -3.432 1.00 0.00 C ATOM 840 CD1 TRP B 41 3.301 -8.582 -3.174 1.00 0.00 C ATOM 841 CD2 TRP B 41 1.313 -9.129 -2.281 1.00 0.00 C ATOM 842 NE1 TRP B 41 3.496 -9.216 -1.960 1.00 0.00 N ATOM 843 CE2 TRP B 41 2.300 -9.562 -1.369 1.00 0.00 C ATOM 844 CE3 TRP B 41 -0.036 -9.348 -1.950 1.00 0.00 C ATOM 845 CZ2 TRP B 41 1.962 -10.185 -0.174 1.00 0.00 C ATOM 846 CZ3 TRP B 41 -0.376 -9.968 -0.737 1.00 0.00 C ATOM 847 CH2 TRP B 41 0.621 -10.386 0.146 1.00 0.00 C ATOM 0 H TRP B 41 0.005 -7.567 -6.691 1.00 0.00 H new ATOM 0 HA TRP B 41 2.389 -9.052 -6.160 1.00 0.00 H new ATOM 0 HB2 TRP B 41 1.896 -7.015 -4.925 1.00 0.00 H new ATOM 0 HB3 TRP B 41 0.327 -7.618 -4.428 1.00 0.00 H new ATOM 0 HD1 TRP B 41 4.080 -8.190 -3.811 1.00 0.00 H new ATOM 0 HE1 TRP B 41 4.412 -9.404 -1.553 1.00 0.00 H new ATOM 0 HE3 TRP B 41 -0.814 -9.038 -2.632 1.00 0.00 H new ATOM 0 HZ2 TRP B 41 2.736 -10.512 0.504 1.00 0.00 H new ATOM 0 HZ3 TRP B 41 -1.415 -10.122 -0.486 1.00 0.00 H new ATOM 0 HH2 TRP B 41 0.353 -10.865 1.076 1.00 0.00 H new ATOM 858 N ILE B 42 -0.460 -10.401 -5.195 1.00 0.00 N ATOM 859 CA ILE B 42 -1.046 -11.666 -4.761 1.00 0.00 C ATOM 860 C ILE B 42 -0.840 -12.740 -5.830 1.00 0.00 C ATOM 861 O ILE B 42 -0.530 -13.889 -5.518 1.00 0.00 O ATOM 862 CB ILE B 42 -2.548 -11.484 -4.473 1.00 0.00 C ATOM 863 CG1 ILE B 42 -3.061 -12.656 -3.630 1.00 0.00 C ATOM 864 CG2 ILE B 42 -3.344 -11.427 -5.786 1.00 0.00 C ATOM 865 CD1 ILE B 42 -4.497 -12.370 -3.188 1.00 0.00 C ATOM 0 H ILE B 42 -1.131 -9.647 -5.345 1.00 0.00 H new ATOM 0 HA ILE B 42 -0.549 -11.985 -3.845 1.00 0.00 H new ATOM 0 HB ILE B 42 -2.683 -10.549 -3.930 1.00 0.00 H new ATOM 0 HG12 ILE B 42 -3.023 -13.579 -4.209 1.00 0.00 H new ATOM 0 HG13 ILE B 42 -2.422 -12.800 -2.759 1.00 0.00 H new ATOM 0 HG21 ILE B 42 -4.403 -11.298 -5.564 1.00 0.00 H new ATOM 0 HG22 ILE B 42 -2.995 -10.588 -6.387 1.00 0.00 H new ATOM 0 HG23 ILE B 42 -3.200 -12.355 -6.340 1.00 0.00 H new ATOM 0 HD11 ILE B 42 -4.865 -13.202 -2.588 1.00 0.00 H new ATOM 0 HD12 ILE B 42 -4.520 -11.456 -2.594 1.00 0.00 H new ATOM 0 HD13 ILE B 42 -5.131 -12.248 -4.066 1.00 0.00 H new ATOM 877 N LEU B 43 -1.009 -12.352 -7.091 1.00 0.00 N ATOM 878 CA LEU B 43 -0.840 -13.283 -8.199 1.00 0.00 C ATOM 879 C LEU B 43 0.595 -13.793 -8.251 1.00 0.00 C ATOM 880 O LEU B 43 0.835 -14.974 -8.502 1.00 0.00 O ATOM 881 CB LEU B 43 -1.195 -12.593 -9.524 1.00 0.00 C ATOM 882 CG LEU B 43 -0.952 -13.543 -10.708 1.00 0.00 C ATOM 883 CD1 LEU B 43 -1.748 -14.845 -10.523 1.00 0.00 C ATOM 884 CD2 LEU B 43 -1.400 -12.851 -12.000 1.00 0.00 C ATOM 0 H LEU B 43 -1.262 -11.404 -7.369 1.00 0.00 H new ATOM 0 HA LEU B 43 -1.508 -14.130 -8.045 1.00 0.00 H new ATOM 0 HB2 LEU B 43 -2.239 -12.280 -9.510 1.00 0.00 H new ATOM 0 HB3 LEU B 43 -0.594 -11.692 -9.644 1.00 0.00 H new ATOM 0 HG LEU B 43 0.109 -13.787 -10.760 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -1.565 -15.507 -11.370 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -1.432 -15.337 -9.603 1.00 0.00 H new ATOM 0 HD13 LEU B 43 -2.812 -14.616 -10.465 1.00 0.00 H new ATOM 0 HD21 LEU B 43 -1.232 -13.517 -12.847 1.00 0.00 H new ATOM 0 HD22 LEU B 43 -2.461 -12.609 -11.934 1.00 0.00 H new ATOM 0 HD23 LEU B 43 -0.827 -11.935 -12.140 1.00 0.00 H new ATOM 896 N ASP B 44 1.546 -12.895 -8.020 1.00 0.00 N ATOM 897 CA ASP B 44 2.953 -13.268 -8.055 1.00 0.00 C ATOM 898 C ASP B 44 3.226 -14.400 -7.073 1.00 0.00 C ATOM 899 O ASP B 44 3.902 -15.375 -7.406 1.00 0.00 O ATOM 900 CB ASP B 44 3.825 -12.064 -7.697 1.00 0.00 C ATOM 901 CG ASP B 44 5.298 -12.439 -7.813 1.00 0.00 C ATOM 902 OD1 ASP B 44 5.574 -13.606 -8.034 1.00 0.00 O ATOM 903 OD2 ASP B 44 6.126 -11.553 -7.684 1.00 0.00 O ATOM 0 H ASP B 44 1.370 -11.913 -7.808 1.00 0.00 H new ATOM 0 HA ASP B 44 3.195 -13.604 -9.063 1.00 0.00 H new ATOM 0 HB2 ASP B 44 3.599 -11.230 -8.361 1.00 0.00 H new ATOM 0 HB3 ASP B 44 3.604 -11.732 -6.683 1.00 0.00 H new ATOM 908 N ARG B 45 2.692 -14.274 -5.863 1.00 0.00 N ATOM 909 CA ARG B 45 2.885 -15.302 -4.848 1.00 0.00 C ATOM 910 C ARG B 45 2.227 -16.612 -5.275 1.00 0.00 C ATOM 911 O ARG B 45 2.567 -17.681 -4.768 1.00 0.00 O ATOM 912 CB ARG B 45 2.291 -14.849 -3.513 1.00 0.00 C ATOM 913 CG ARG B 45 3.122 -13.702 -2.939 1.00 0.00 C ATOM 914 CD ARG B 45 2.469 -13.204 -1.648 1.00 0.00 C ATOM 915 NE ARG B 45 2.493 -14.257 -0.638 1.00 0.00 N ATOM 916 CZ ARG B 45 1.693 -14.212 0.422 1.00 0.00 C ATOM 917 NH1 ARG B 45 0.861 -13.217 0.571 1.00 0.00 N ATOM 918 NH2 ARG B 45 1.739 -15.164 1.312 1.00 0.00 N ATOM 0 H ARG B 45 2.128 -13.479 -5.563 1.00 0.00 H new ATOM 0 HA ARG B 45 3.957 -15.464 -4.732 1.00 0.00 H new ATOM 0 HB2 ARG B 45 1.259 -14.527 -3.654 1.00 0.00 H new ATOM 0 HB3 ARG B 45 2.272 -15.683 -2.811 1.00 0.00 H new ATOM 0 HG2 ARG B 45 4.139 -14.039 -2.740 1.00 0.00 H new ATOM 0 HG3 ARG B 45 3.191 -12.890 -3.662 1.00 0.00 H new ATOM 0 HD2 ARG B 45 2.996 -12.324 -1.280 1.00 0.00 H new ATOM 0 HD3 ARG B 45 1.441 -12.901 -1.844 1.00 0.00 H new ATOM 0 HE ARG B 45 3.135 -15.042 -0.748 1.00 0.00 H new ATOM 0 HH11 ARG B 45 0.825 -12.474 -0.126 1.00 0.00 H new ATOM 0 HH12 ARG B 45 0.247 -13.183 1.385 1.00 0.00 H new ATOM 0 HH21 ARG B 45 2.388 -15.942 1.194 1.00 0.00 H new ATOM 0 HH22 ARG B 45 1.126 -15.131 2.126 1.00 0.00 H new ATOM 932 N LEU B 46 1.273 -16.523 -6.196 1.00 0.00 N ATOM 933 CA LEU B 46 0.569 -17.714 -6.664 1.00 0.00 C ATOM 934 C LEU B 46 1.556 -18.687 -7.320 1.00 0.00 C ATOM 935 O LEU B 46 1.531 -19.888 -7.053 1.00 0.00 O ATOM 936 CB LEU B 46 -0.518 -17.296 -7.672 1.00 0.00 C ATOM 937 CG LEU B 46 -1.654 -18.330 -7.710 1.00 0.00 C ATOM 938 CD1 LEU B 46 -2.731 -17.850 -8.687 1.00 0.00 C ATOM 939 CD2 LEU B 46 -1.122 -19.701 -8.159 1.00 0.00 C ATOM 0 H LEU B 46 0.971 -15.650 -6.629 1.00 0.00 H new ATOM 0 HA LEU B 46 0.102 -18.217 -5.817 1.00 0.00 H new ATOM 0 HB2 LEU B 46 -0.918 -16.320 -7.398 1.00 0.00 H new ATOM 0 HB3 LEU B 46 -0.080 -17.194 -8.665 1.00 0.00 H new ATOM 0 HG LEU B 46 -2.076 -18.435 -6.710 1.00 0.00 H new ATOM 0 HD11 LEU B 46 -3.542 -18.578 -8.721 1.00 0.00 H new ATOM 0 HD12 LEU B 46 -3.121 -16.888 -8.355 1.00 0.00 H new ATOM 0 HD13 LEU B 46 -2.298 -17.743 -9.682 1.00 0.00 H new ATOM 0 HD21 LEU B 46 -1.941 -20.420 -8.180 1.00 0.00 H new ATOM 0 HD22 LEU B 46 -0.689 -19.615 -9.156 1.00 0.00 H new ATOM 0 HD23 LEU B 46 -0.358 -20.041 -7.460 1.00 0.00 H new ATOM 951 N PHE B 47 2.432 -18.160 -8.172 1.00 0.00 N ATOM 952 CA PHE B 47 3.420 -18.997 -8.848 1.00 0.00 C ATOM 953 C PHE B 47 4.354 -19.653 -7.839 1.00 0.00 C ATOM 954 O PHE B 47 4.641 -20.847 -7.928 1.00 0.00 O ATOM 955 CB PHE B 47 4.237 -18.160 -9.837 1.00 0.00 C ATOM 956 CG PHE B 47 3.366 -17.776 -11.011 1.00 0.00 C ATOM 957 CD1 PHE B 47 3.101 -18.712 -12.018 1.00 0.00 C ATOM 958 CD2 PHE B 47 2.822 -16.488 -11.091 1.00 0.00 C ATOM 959 CE1 PHE B 47 2.292 -18.361 -13.104 1.00 0.00 C ATOM 960 CE2 PHE B 47 2.013 -16.138 -12.177 1.00 0.00 C ATOM 961 CZ PHE B 47 1.747 -17.075 -13.183 1.00 0.00 C ATOM 0 H PHE B 47 2.479 -17.169 -8.409 1.00 0.00 H new ATOM 0 HA PHE B 47 2.887 -19.778 -9.391 1.00 0.00 H new ATOM 0 HB2 PHE B 47 4.618 -17.265 -9.345 1.00 0.00 H new ATOM 0 HB3 PHE B 47 5.102 -18.727 -10.182 1.00 0.00 H new ATOM 0 HD1 PHE B 47 3.521 -19.705 -11.956 1.00 0.00 H new ATOM 0 HD2 PHE B 47 3.027 -15.766 -10.315 1.00 0.00 H new ATOM 0 HE1 PHE B 47 2.088 -19.083 -13.881 1.00 0.00 H new ATOM 0 HE2 PHE B 47 1.593 -15.145 -12.240 1.00 0.00 H new ATOM 0 HZ PHE B 47 1.121 -16.805 -14.020 1.00 0.00 H new ATOM 971 N PHE B 48 4.828 -18.864 -6.873 1.00 0.00 N ATOM 972 CA PHE B 48 5.733 -19.376 -5.840 1.00 0.00 C ATOM 973 C PHE B 48 5.249 -18.965 -4.455 1.00 0.00 C ATOM 974 O PHE B 48 4.860 -17.818 -4.238 1.00 0.00 O ATOM 975 CB PHE B 48 7.142 -18.830 -6.075 1.00 0.00 C ATOM 976 CG PHE B 48 7.686 -19.395 -7.366 1.00 0.00 C ATOM 977 CD1 PHE B 48 8.365 -20.620 -7.364 1.00 0.00 C ATOM 978 CD2 PHE B 48 7.509 -18.695 -8.566 1.00 0.00 C ATOM 979 CE1 PHE B 48 8.868 -21.143 -8.561 1.00 0.00 C ATOM 980 CE2 PHE B 48 8.011 -19.221 -9.763 1.00 0.00 C ATOM 981 CZ PHE B 48 8.691 -20.444 -9.760 1.00 0.00 C ATOM 0 H PHE B 48 4.602 -17.873 -6.784 1.00 0.00 H new ATOM 0 HA PHE B 48 5.748 -20.464 -5.896 1.00 0.00 H new ATOM 0 HB2 PHE B 48 7.120 -17.741 -6.122 1.00 0.00 H new ATOM 0 HB3 PHE B 48 7.793 -19.100 -5.243 1.00 0.00 H new ATOM 0 HD1 PHE B 48 8.500 -21.161 -6.439 1.00 0.00 H new ATOM 0 HD2 PHE B 48 6.986 -17.750 -8.568 1.00 0.00 H new ATOM 0 HE1 PHE B 48 9.393 -22.087 -8.559 1.00 0.00 H new ATOM 0 HE2 PHE B 48 7.873 -18.682 -10.689 1.00 0.00 H new ATOM 0 HZ PHE B 48 9.079 -20.848 -10.683 1.00 0.00 H new ATOM 991 N LYS B 49 5.277 -19.909 -3.520 1.00 0.00 N ATOM 992 CA LYS B 49 4.836 -19.636 -2.156 1.00 0.00 C ATOM 993 C LYS B 49 5.935 -18.925 -1.370 1.00 0.00 C ATOM 994 O LYS B 49 5.731 -18.683 -0.192 1.00 0.00 O ATOM 995 CB LYS B 49 4.468 -20.944 -1.455 1.00 0.00 C ATOM 996 CG LYS B 49 3.235 -21.553 -2.126 1.00 0.00 C ATOM 997 CD LYS B 49 2.873 -22.868 -1.434 1.00 0.00 C ATOM 998 CE LYS B 49 1.642 -23.478 -2.106 1.00 0.00 C ATOM 999 NZ LYS B 49 1.295 -24.763 -1.435 1.00 0.00 N ATOM 1000 OXT LYS B 49 6.963 -18.635 -1.959 1.00 0.00 O ATOM 0 H LYS B 49 5.598 -20.864 -3.680 1.00 0.00 H new ATOM 0 HA LYS B 49 3.960 -18.989 -2.199 1.00 0.00 H new ATOM 0 HB2 LYS B 49 5.304 -21.642 -1.503 1.00 0.00 H new ATOM 0 HB3 LYS B 49 4.267 -20.759 -0.400 1.00 0.00 H new ATOM 0 HG2 LYS B 49 2.397 -20.858 -2.070 1.00 0.00 H new ATOM 0 HG3 LYS B 49 3.433 -21.729 -3.183 1.00 0.00 H new ATOM 0 HD2 LYS B 49 3.711 -23.562 -1.489 1.00 0.00 H new ATOM 0 HD3 LYS B 49 2.673 -22.692 -0.377 1.00 0.00 H new ATOM 0 HE2 LYS B 49 0.802 -22.786 -2.047 1.00 0.00 H new ATOM 0 HE3 LYS B 49 1.840 -23.650 -3.164 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 0.458 -25.178 -1.892 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 2.095 -25.423 -1.513 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 1.089 -24.586 -0.431 1.00 0.00 H new TER 1014 LYS B 49 ATOM 1015 N SER C 19 -11.513 24.140 3.061 1.00 0.00 N ATOM 1016 CA SER C 19 -10.040 24.062 3.279 1.00 0.00 C ATOM 1017 C SER C 19 -9.412 23.209 2.183 1.00 0.00 C ATOM 1018 O SER C 19 -8.325 22.660 2.358 1.00 0.00 O ATOM 1019 CB SER C 19 -9.762 23.441 4.647 1.00 0.00 C ATOM 1020 OG SER C 19 -10.510 22.237 4.777 1.00 0.00 O ATOM 0 HA SER C 19 -9.609 25.063 3.246 1.00 0.00 H new ATOM 0 HB2 SER C 19 -8.697 23.235 4.756 1.00 0.00 H new ATOM 0 HB3 SER C 19 -10.034 24.139 5.438 1.00 0.00 H new ATOM 0 HG SER C 19 -11.260 22.248 4.147 1.00 0.00 H new ATOM 1028 N ASN C 20 -10.102 23.105 1.053 1.00 0.00 N ATOM 1029 CA ASN C 20 -9.602 22.316 -0.066 1.00 0.00 C ATOM 1030 C ASN C 20 -8.329 22.936 -0.632 1.00 0.00 C ATOM 1031 O ASN C 20 -7.478 22.237 -1.182 1.00 0.00 O ATOM 1032 CB ASN C 20 -10.667 22.233 -1.163 1.00 0.00 C ATOM 1033 CG ASN C 20 -11.092 23.635 -1.587 1.00 0.00 C ATOM 1034 OD1 ASN C 20 -10.501 24.623 -1.150 1.00 0.00 O ATOM 1035 ND2 ASN C 20 -12.088 23.783 -2.417 1.00 0.00 N ATOM 0 H ASN C 20 -11.003 23.554 0.888 1.00 0.00 H new ATOM 0 HA ASN C 20 -9.373 21.313 0.293 1.00 0.00 H new ATOM 0 HB2 ASN C 20 -10.274 21.688 -2.022 1.00 0.00 H new ATOM 0 HB3 ASN C 20 -11.531 21.676 -0.800 1.00 0.00 H new ATOM 0 HD21 ASN C 20 -12.378 24.718 -2.704 1.00 0.00 H new ATOM 0 HD22 ASN C 20 -12.577 22.964 -2.778 1.00 0.00 H new ATOM 1042 N ASP C 21 -8.205 24.253 -0.495 1.00 0.00 N ATOM 1043 CA ASP C 21 -7.030 24.956 -0.996 1.00 0.00 C ATOM 1044 C ASP C 21 -5.772 24.476 -0.282 1.00 0.00 C ATOM 1045 O ASP C 21 -4.734 24.262 -0.910 1.00 0.00 O ATOM 1046 CB ASP C 21 -7.193 26.463 -0.783 1.00 0.00 C ATOM 1047 CG ASP C 21 -8.234 27.018 -1.751 1.00 0.00 C ATOM 1048 OD1 ASP C 21 -8.575 26.319 -2.690 1.00 0.00 O ATOM 1049 OD2 ASP C 21 -8.673 28.136 -1.539 1.00 0.00 O ATOM 0 H ASP C 21 -8.898 24.850 -0.045 1.00 0.00 H new ATOM 0 HA ASP C 21 -6.933 24.746 -2.061 1.00 0.00 H new ATOM 0 HB2 ASP C 21 -7.497 26.662 0.245 1.00 0.00 H new ATOM 0 HB3 ASP C 21 -6.238 26.966 -0.936 1.00 0.00 H new ATOM 1054 N SER C 22 -5.870 24.307 1.031 1.00 0.00 N ATOM 1055 CA SER C 22 -4.731 23.851 1.817 1.00 0.00 C ATOM 1056 C SER C 22 -4.299 22.460 1.369 1.00 0.00 C ATOM 1057 O SER C 22 -3.107 22.182 1.233 1.00 0.00 O ATOM 1058 CB SER C 22 -5.097 23.824 3.301 1.00 0.00 C ATOM 1059 OG SER C 22 -3.960 23.426 4.058 1.00 0.00 O ATOM 0 H SER C 22 -6.719 24.477 1.570 1.00 0.00 H new ATOM 0 HA SER C 22 -3.904 24.544 1.663 1.00 0.00 H new ATOM 0 HB2 SER C 22 -5.435 24.809 3.622 1.00 0.00 H new ATOM 0 HB3 SER C 22 -5.922 23.132 3.471 1.00 0.00 H new ATOM 0 HG SER C 22 -4.191 23.409 5.010 1.00 0.00 H new ATOM 1065 N SER C 23 -5.276 21.582 1.144 1.00 0.00 N ATOM 1066 CA SER C 23 -4.980 20.217 0.715 1.00 0.00 C ATOM 1067 C SER C 23 -3.838 19.639 1.546 1.00 0.00 C ATOM 1068 O SER C 23 -2.667 19.807 1.208 1.00 0.00 O ATOM 1069 CB SER C 23 -4.596 20.206 -0.767 1.00 0.00 C ATOM 1070 OG SER C 23 -3.798 19.061 -1.035 1.00 0.00 O ATOM 0 H SER C 23 -6.269 21.789 1.250 1.00 0.00 H new ATOM 0 HA SER C 23 -5.870 19.605 0.860 1.00 0.00 H new ATOM 0 HB2 SER C 23 -5.492 20.192 -1.387 1.00 0.00 H new ATOM 0 HB3 SER C 23 -4.047 21.113 -1.020 1.00 0.00 H new ATOM 0 HG SER C 23 -2.933 19.152 -0.584 1.00 0.00 H new ATOM 1076 N ASP C 24 -4.185 18.971 2.641 1.00 0.00 N ATOM 1077 CA ASP C 24 -3.179 18.384 3.521 1.00 0.00 C ATOM 1078 C ASP C 24 -2.180 17.543 2.714 1.00 0.00 C ATOM 1079 O ASP C 24 -2.541 16.959 1.692 1.00 0.00 O ATOM 1080 CB ASP C 24 -3.860 17.503 4.578 1.00 0.00 C ATOM 1081 CG ASP C 24 -4.468 18.373 5.676 1.00 0.00 C ATOM 1082 OD1 ASP C 24 -3.715 18.850 6.509 1.00 0.00 O ATOM 1083 OD2 ASP C 24 -5.675 18.543 5.670 1.00 0.00 O ATOM 0 H ASP C 24 -5.149 18.823 2.940 1.00 0.00 H new ATOM 0 HA ASP C 24 -2.638 19.191 4.015 1.00 0.00 H new ATOM 0 HB2 ASP C 24 -4.637 16.897 4.112 1.00 0.00 H new ATOM 0 HB3 ASP C 24 -3.135 16.814 5.010 1.00 0.00 H new ATOM 1088 N PRO C 25 -0.941 17.468 3.149 1.00 0.00 N ATOM 1089 CA PRO C 25 0.110 16.674 2.441 1.00 0.00 C ATOM 1090 C PRO C 25 -0.151 15.168 2.532 1.00 0.00 C ATOM 1091 O PRO C 25 0.419 14.385 1.774 1.00 0.00 O ATOM 1092 CB PRO C 25 1.412 17.062 3.163 1.00 0.00 C ATOM 1093 CG PRO C 25 0.979 17.489 4.529 1.00 0.00 C ATOM 1094 CD PRO C 25 -0.402 18.122 4.355 1.00 0.00 C ATOM 0 HA PRO C 25 0.139 16.888 1.373 1.00 0.00 H new ATOM 0 HB2 PRO C 25 2.103 16.220 3.212 1.00 0.00 H new ATOM 0 HB3 PRO C 25 1.928 17.868 2.642 1.00 0.00 H new ATOM 0 HG2 PRO C 25 0.935 16.638 5.208 1.00 0.00 H new ATOM 0 HG3 PRO C 25 1.684 18.202 4.957 1.00 0.00 H new ATOM 0 HD2 PRO C 25 -1.036 17.944 5.224 1.00 0.00 H new ATOM 0 HD3 PRO C 25 -0.333 19.202 4.227 1.00 0.00 H new ATOM 1102 N LEU C 26 -1.003 14.772 3.473 1.00 0.00 N ATOM 1103 CA LEU C 26 -1.316 13.359 3.657 1.00 0.00 C ATOM 1104 C LEU C 26 -1.969 12.784 2.400 1.00 0.00 C ATOM 1105 O LEU C 26 -1.634 11.679 1.970 1.00 0.00 O ATOM 1106 CB LEU C 26 -2.260 13.191 4.860 1.00 0.00 C ATOM 1107 CG LEU C 26 -1.458 13.237 6.164 1.00 0.00 C ATOM 1108 CD1 LEU C 26 -0.635 14.525 6.212 1.00 0.00 C ATOM 1109 CD2 LEU C 26 -2.420 13.203 7.354 1.00 0.00 C ATOM 0 H LEU C 26 -1.485 15.402 4.114 1.00 0.00 H new ATOM 0 HA LEU C 26 -0.389 12.817 3.844 1.00 0.00 H new ATOM 0 HB2 LEU C 26 -3.011 13.981 4.857 1.00 0.00 H new ATOM 0 HB3 LEU C 26 -2.794 12.244 4.785 1.00 0.00 H new ATOM 0 HG LEU C 26 -0.790 12.377 6.210 1.00 0.00 H new ATOM 0 HD11 LEU C 26 -0.064 14.558 7.140 1.00 0.00 H new ATOM 0 HD12 LEU C 26 0.049 14.551 5.364 1.00 0.00 H new ATOM 0 HD13 LEU C 26 -1.303 15.385 6.166 1.00 0.00 H new ATOM 0 HD21 LEU C 26 -1.851 13.236 8.283 1.00 0.00 H new ATOM 0 HD22 LEU C 26 -3.088 14.063 7.307 1.00 0.00 H new ATOM 0 HD23 LEU C 26 -3.008 12.286 7.321 1.00 0.00 H new ATOM 1121 N VAL C 27 -2.899 13.533 1.818 1.00 0.00 N ATOM 1122 CA VAL C 27 -3.586 13.077 0.614 1.00 0.00 C ATOM 1123 C VAL C 27 -2.607 12.948 -0.551 1.00 0.00 C ATOM 1124 O VAL C 27 -2.574 11.926 -1.242 1.00 0.00 O ATOM 1125 CB VAL C 27 -4.692 14.068 0.243 1.00 0.00 C ATOM 1126 CG1 VAL C 27 -5.335 13.656 -1.084 1.00 0.00 C ATOM 1127 CG2 VAL C 27 -5.756 14.081 1.344 1.00 0.00 C ATOM 0 H VAL C 27 -3.193 14.450 2.156 1.00 0.00 H new ATOM 0 HA VAL C 27 -4.021 12.098 0.815 1.00 0.00 H new ATOM 0 HB VAL C 27 -4.262 15.064 0.139 1.00 0.00 H new ATOM 0 HG11 VAL C 27 -6.121 14.365 -1.343 1.00 0.00 H new ATOM 0 HG12 VAL C 27 -4.578 13.651 -1.869 1.00 0.00 H new ATOM 0 HG13 VAL C 27 -5.764 12.659 -0.986 1.00 0.00 H new ATOM 0 HG21 VAL C 27 -6.544 14.787 1.080 1.00 0.00 H new ATOM 0 HG22 VAL C 27 -6.183 13.084 1.450 1.00 0.00 H new ATOM 0 HG23 VAL C 27 -5.300 14.382 2.287 1.00 0.00 H new ATOM 1137 N VAL C 28 -1.807 13.989 -0.760 1.00 0.00 N ATOM 1138 CA VAL C 28 -0.828 13.986 -1.839 1.00 0.00 C ATOM 1139 C VAL C 28 0.235 12.923 -1.589 1.00 0.00 C ATOM 1140 O VAL C 28 0.617 12.184 -2.497 1.00 0.00 O ATOM 1141 CB VAL C 28 -0.169 15.363 -1.954 1.00 0.00 C ATOM 1142 CG1 VAL C 28 0.929 15.320 -3.018 1.00 0.00 C ATOM 1143 CG2 VAL C 28 -1.222 16.399 -2.349 1.00 0.00 C ATOM 0 H VAL C 28 -1.818 14.841 -0.199 1.00 0.00 H new ATOM 0 HA VAL C 28 -1.341 13.756 -2.773 1.00 0.00 H new ATOM 0 HB VAL C 28 0.269 15.636 -0.994 1.00 0.00 H new ATOM 0 HG11 VAL C 28 1.397 16.301 -3.098 1.00 0.00 H new ATOM 0 HG12 VAL C 28 1.680 14.582 -2.736 1.00 0.00 H new ATOM 0 HG13 VAL C 28 0.494 15.046 -3.979 1.00 0.00 H new ATOM 0 HG21 VAL C 28 -0.754 17.380 -2.431 1.00 0.00 H new ATOM 0 HG22 VAL C 28 -1.661 16.124 -3.308 1.00 0.00 H new ATOM 0 HG23 VAL C 28 -2.003 16.432 -1.589 1.00 0.00 H new ATOM 1153 N ALA C 29 0.708 12.853 -0.350 1.00 0.00 N ATOM 1154 CA ALA C 29 1.727 11.878 0.015 1.00 0.00 C ATOM 1155 C ALA C 29 1.199 10.462 -0.170 1.00 0.00 C ATOM 1156 O ALA C 29 1.917 9.579 -0.635 1.00 0.00 O ATOM 1157 CB ALA C 29 2.149 12.079 1.471 1.00 0.00 C ATOM 0 H ALA C 29 0.404 13.456 0.414 1.00 0.00 H new ATOM 0 HA ALA C 29 2.590 12.023 -0.635 1.00 0.00 H new ATOM 0 HB1 ALA C 29 2.911 11.345 1.734 1.00 0.00 H new ATOM 0 HB2 ALA C 29 2.554 13.083 1.597 1.00 0.00 H new ATOM 0 HB3 ALA C 29 1.284 11.952 2.121 1.00 0.00 H new ATOM 1163 N ALA C 30 -0.061 10.246 0.192 1.00 0.00 N ATOM 1164 CA ALA C 30 -0.658 8.923 0.056 1.00 0.00 C ATOM 1165 C ALA C 30 -0.516 8.426 -1.377 1.00 0.00 C ATOM 1166 O ALA C 30 -0.059 7.308 -1.613 1.00 0.00 O ATOM 1167 CB ALA C 30 -2.137 8.974 0.442 1.00 0.00 C ATOM 0 H ALA C 30 -0.681 10.959 0.576 1.00 0.00 H new ATOM 0 HA ALA C 30 -0.138 8.235 0.722 1.00 0.00 H new ATOM 0 HB1 ALA C 30 -2.575 7.981 0.337 1.00 0.00 H new ATOM 0 HB2 ALA C 30 -2.232 9.305 1.476 1.00 0.00 H new ATOM 0 HB3 ALA C 30 -2.660 9.672 -0.212 1.00 0.00 H new ATOM 1173 N SER C 31 -0.904 9.265 -2.334 1.00 0.00 N ATOM 1174 CA SER C 31 -0.802 8.894 -3.743 1.00 0.00 C ATOM 1175 C SER C 31 0.655 8.654 -4.137 1.00 0.00 C ATOM 1176 O SER C 31 0.965 7.698 -4.848 1.00 0.00 O ATOM 1177 CB SER C 31 -1.397 9.998 -4.619 1.00 0.00 C ATOM 1178 OG SER C 31 -1.000 9.791 -5.967 1.00 0.00 O ATOM 0 H SER C 31 -1.287 10.195 -2.164 1.00 0.00 H new ATOM 0 HA SER C 31 -1.360 7.970 -3.895 1.00 0.00 H new ATOM 0 HB2 SER C 31 -2.484 9.993 -4.543 1.00 0.00 H new ATOM 0 HB3 SER C 31 -1.058 10.975 -4.274 1.00 0.00 H new ATOM 0 HG SER C 31 -1.381 10.496 -6.532 1.00 0.00 H new ATOM 1184 N ILE C 32 1.542 9.531 -3.675 1.00 0.00 N ATOM 1185 CA ILE C 32 2.966 9.415 -3.986 1.00 0.00 C ATOM 1186 C ILE C 32 3.543 8.120 -3.416 1.00 0.00 C ATOM 1187 O ILE C 32 4.324 7.440 -4.074 1.00 0.00 O ATOM 1188 CB ILE C 32 3.732 10.619 -3.427 1.00 0.00 C ATOM 1189 CG1 ILE C 32 3.313 11.881 -4.184 1.00 0.00 C ATOM 1190 CG2 ILE C 32 5.238 10.400 -3.607 1.00 0.00 C ATOM 1191 CD1 ILE C 32 3.866 13.116 -3.469 1.00 0.00 C ATOM 0 H ILE C 32 1.302 10.328 -3.086 1.00 0.00 H new ATOM 0 HA ILE C 32 3.076 9.395 -5.070 1.00 0.00 H new ATOM 0 HB ILE C 32 3.505 10.732 -2.367 1.00 0.00 H new ATOM 0 HG12 ILE C 32 3.686 11.844 -5.208 1.00 0.00 H new ATOM 0 HG13 ILE C 32 2.226 11.938 -4.242 1.00 0.00 H new ATOM 0 HG21 ILE C 32 5.781 11.257 -3.209 1.00 0.00 H new ATOM 0 HG22 ILE C 32 5.541 9.499 -3.073 1.00 0.00 H new ATOM 0 HG23 ILE C 32 5.465 10.287 -4.667 1.00 0.00 H new ATOM 0 HD11 ILE C 32 3.567 14.014 -4.010 1.00 0.00 H new ATOM 0 HD12 ILE C 32 3.472 13.155 -2.454 1.00 0.00 H new ATOM 0 HD13 ILE C 32 4.954 13.059 -3.434 1.00 0.00 H new ATOM 1203 N ILE C 33 3.161 7.791 -2.188 1.00 0.00 N ATOM 1204 CA ILE C 33 3.661 6.577 -1.549 1.00 0.00 C ATOM 1205 C ILE C 33 3.257 5.338 -2.346 1.00 0.00 C ATOM 1206 O ILE C 33 4.070 4.439 -2.562 1.00 0.00 O ATOM 1207 CB ILE C 33 3.107 6.479 -0.118 1.00 0.00 C ATOM 1208 CG1 ILE C 33 3.760 7.556 0.755 1.00 0.00 C ATOM 1209 CG2 ILE C 33 3.396 5.091 0.476 1.00 0.00 C ATOM 1210 CD1 ILE C 33 2.964 7.699 2.055 1.00 0.00 C ATOM 0 H ILE C 33 2.515 8.339 -1.620 1.00 0.00 H new ATOM 0 HA ILE C 33 4.749 6.626 -1.517 1.00 0.00 H new ATOM 0 HB ILE C 33 2.028 6.630 -0.146 1.00 0.00 H new ATOM 0 HG12 ILE C 33 4.793 7.286 0.975 1.00 0.00 H new ATOM 0 HG13 ILE C 33 3.785 8.507 0.223 1.00 0.00 H new ATOM 0 HG21 ILE C 33 2.997 5.039 1.489 1.00 0.00 H new ATOM 0 HG22 ILE C 33 2.923 4.326 -0.140 1.00 0.00 H new ATOM 0 HG23 ILE C 33 4.473 4.923 0.501 1.00 0.00 H new ATOM 0 HD11 ILE C 33 3.424 8.464 2.681 1.00 0.00 H new ATOM 0 HD12 ILE C 33 1.938 7.987 1.824 1.00 0.00 H new ATOM 0 HD13 ILE C 33 2.962 6.748 2.587 1.00 0.00 H new ATOM 1222 N GLY C 34 2.005 5.289 -2.781 1.00 0.00 N ATOM 1223 CA GLY C 34 1.528 4.145 -3.548 1.00 0.00 C ATOM 1224 C GLY C 34 2.239 4.044 -4.897 1.00 0.00 C ATOM 1225 O GLY C 34 2.778 2.995 -5.246 1.00 0.00 O ATOM 0 H GLY C 34 1.309 6.017 -2.619 1.00 0.00 H new ATOM 0 HA2 GLY C 34 1.692 3.230 -2.979 1.00 0.00 H new ATOM 0 HA3 GLY C 34 0.453 4.234 -3.707 1.00 0.00 H new ATOM 1229 N ILE C 35 2.232 5.138 -5.654 1.00 0.00 N ATOM 1230 CA ILE C 35 2.874 5.150 -6.967 1.00 0.00 C ATOM 1231 C ILE C 35 4.392 4.983 -6.843 1.00 0.00 C ATOM 1232 O ILE C 35 5.004 4.226 -7.596 1.00 0.00 O ATOM 1233 CB ILE C 35 2.556 6.465 -7.687 1.00 0.00 C ATOM 1234 CG1 ILE C 35 1.061 6.516 -8.013 1.00 0.00 C ATOM 1235 CG2 ILE C 35 3.358 6.546 -8.993 1.00 0.00 C ATOM 1236 CD1 ILE C 35 0.686 7.929 -8.471 1.00 0.00 C ATOM 0 H ILE C 35 1.794 6.019 -5.386 1.00 0.00 H new ATOM 0 HA ILE C 35 2.484 4.311 -7.544 1.00 0.00 H new ATOM 0 HB ILE C 35 2.823 7.302 -7.043 1.00 0.00 H new ATOM 0 HG12 ILE C 35 0.823 5.794 -8.794 1.00 0.00 H new ATOM 0 HG13 ILE C 35 0.477 6.240 -7.135 1.00 0.00 H new ATOM 0 HG21 ILE C 35 3.130 7.482 -9.503 1.00 0.00 H new ATOM 0 HG22 ILE C 35 4.424 6.506 -8.769 1.00 0.00 H new ATOM 0 HG23 ILE C 35 3.091 5.708 -9.637 1.00 0.00 H new ATOM 0 HD11 ILE C 35 -0.378 7.966 -8.703 1.00 0.00 H new ATOM 0 HD12 ILE C 35 0.909 8.640 -7.676 1.00 0.00 H new ATOM 0 HD13 ILE C 35 1.261 8.188 -9.360 1.00 0.00 H new ATOM 1248 N LEU C 36 4.991 5.705 -5.899 1.00 0.00 N ATOM 1249 CA LEU C 36 6.438 5.639 -5.697 1.00 0.00 C ATOM 1250 C LEU C 36 6.861 4.237 -5.278 1.00 0.00 C ATOM 1251 O LEU C 36 7.825 3.682 -5.808 1.00 0.00 O ATOM 1252 CB LEU C 36 6.856 6.647 -4.620 1.00 0.00 C ATOM 1253 CG LEU C 36 8.384 6.653 -4.450 1.00 0.00 C ATOM 1254 CD1 LEU C 36 9.062 7.122 -5.750 1.00 0.00 C ATOM 1255 CD2 LEU C 36 8.749 7.605 -3.306 1.00 0.00 C ATOM 0 H LEU C 36 4.502 6.338 -5.266 1.00 0.00 H new ATOM 0 HA LEU C 36 6.930 5.883 -6.638 1.00 0.00 H new ATOM 0 HB2 LEU C 36 6.511 7.644 -4.894 1.00 0.00 H new ATOM 0 HB3 LEU C 36 6.380 6.394 -3.673 1.00 0.00 H new ATOM 0 HG LEU C 36 8.729 5.644 -4.222 1.00 0.00 H new ATOM 0 HD11 LEU C 36 10.144 7.122 -5.617 1.00 0.00 H new ATOM 0 HD12 LEU C 36 8.797 6.446 -6.563 1.00 0.00 H new ATOM 0 HD13 LEU C 36 8.726 8.130 -5.992 1.00 0.00 H new ATOM 0 HD21 LEU C 36 9.831 7.618 -3.175 1.00 0.00 H new ATOM 0 HD22 LEU C 36 8.400 8.610 -3.543 1.00 0.00 H new ATOM 0 HD23 LEU C 36 8.276 7.265 -2.385 1.00 0.00 H new ATOM 1267 N HIS C 37 6.130 3.664 -4.329 1.00 0.00 N ATOM 1268 CA HIS C 37 6.441 2.324 -3.855 1.00 0.00 C ATOM 1269 C HIS C 37 6.354 1.327 -5.001 1.00 0.00 C ATOM 1270 O HIS C 37 7.177 0.417 -5.108 1.00 0.00 O ATOM 1271 CB HIS C 37 5.473 1.909 -2.746 1.00 0.00 C ATOM 1272 CG HIS C 37 5.841 0.530 -2.267 1.00 0.00 C ATOM 1273 ND1 HIS C 37 6.270 0.278 -0.974 1.00 0.00 N ATOM 1274 CD2 HIS C 37 5.865 -0.679 -2.909 1.00 0.00 C ATOM 1275 CE1 HIS C 37 6.533 -1.038 -0.886 1.00 0.00 C ATOM 1276 NE2 HIS C 37 6.300 -1.668 -2.037 1.00 0.00 N ATOM 0 H HIS C 37 5.327 4.102 -3.878 1.00 0.00 H new ATOM 0 HA HIS C 37 7.456 2.330 -3.458 1.00 0.00 H new ATOM 0 HB2 HIS C 37 5.519 2.619 -1.921 1.00 0.00 H new ATOM 0 HB3 HIS C 37 4.448 1.918 -3.117 1.00 0.00 H new ATOM 0 HD2 HIS C 37 5.587 -0.840 -3.940 1.00 0.00 H new ATOM 0 HE1 HIS C 37 6.890 -1.525 0.009 1.00 0.00 H new ATOM 0 HE2 HIS C 37 6.416 -2.662 -2.235 1.00 0.00 H new ATOM 1284 N LEU C 38 5.349 1.498 -5.852 1.00 0.00 N ATOM 1285 CA LEU C 38 5.154 0.592 -6.979 1.00 0.00 C ATOM 1286 C LEU C 38 6.359 0.604 -7.912 1.00 0.00 C ATOM 1287 O LEU C 38 6.748 -0.439 -8.420 1.00 0.00 O ATOM 1288 CB LEU C 38 3.886 0.984 -7.767 1.00 0.00 C ATOM 1289 CG LEU C 38 2.642 0.286 -7.184 1.00 0.00 C ATOM 1290 CD1 LEU C 38 1.376 1.009 -7.665 1.00 0.00 C ATOM 1291 CD2 LEU C 38 2.592 -1.184 -7.647 1.00 0.00 C ATOM 0 H LEU C 38 4.662 2.249 -5.785 1.00 0.00 H new ATOM 0 HA LEU C 38 5.037 -0.415 -6.579 1.00 0.00 H new ATOM 0 HB2 LEU C 38 3.751 2.065 -7.733 1.00 0.00 H new ATOM 0 HB3 LEU C 38 4.005 0.710 -8.815 1.00 0.00 H new ATOM 0 HG LEU C 38 2.697 0.318 -6.096 1.00 0.00 H new ATOM 0 HD11 LEU C 38 0.496 0.515 -7.253 1.00 0.00 H new ATOM 0 HD12 LEU C 38 1.400 2.046 -7.331 1.00 0.00 H new ATOM 0 HD13 LEU C 38 1.332 0.980 -8.754 1.00 0.00 H new ATOM 0 HD21 LEU C 38 1.709 -1.667 -7.229 1.00 0.00 H new ATOM 0 HD22 LEU C 38 2.545 -1.221 -8.735 1.00 0.00 H new ATOM 0 HD23 LEU C 38 3.487 -1.704 -7.304 1.00 0.00 H new ATOM 1303 N ILE C 39 6.930 1.773 -8.149 1.00 0.00 N ATOM 1304 CA ILE C 39 8.074 1.863 -9.044 1.00 0.00 C ATOM 1305 C ILE C 39 9.242 1.053 -8.482 1.00 0.00 C ATOM 1306 O ILE C 39 9.901 0.308 -9.205 1.00 0.00 O ATOM 1307 CB ILE C 39 8.484 3.326 -9.208 1.00 0.00 C ATOM 1308 CG1 ILE C 39 7.362 4.081 -9.923 1.00 0.00 C ATOM 1309 CG2 ILE C 39 9.759 3.409 -10.051 1.00 0.00 C ATOM 1310 CD1 ILE C 39 7.612 5.587 -9.832 1.00 0.00 C ATOM 0 H ILE C 39 6.628 2.659 -7.743 1.00 0.00 H new ATOM 0 HA ILE C 39 7.800 1.456 -10.018 1.00 0.00 H new ATOM 0 HB ILE C 39 8.666 3.767 -8.228 1.00 0.00 H new ATOM 0 HG12 ILE C 39 7.312 3.774 -10.968 1.00 0.00 H new ATOM 0 HG13 ILE C 39 6.401 3.835 -9.472 1.00 0.00 H new ATOM 0 HG21 ILE C 39 10.051 4.453 -10.168 1.00 0.00 H new ATOM 0 HG22 ILE C 39 10.560 2.862 -9.554 1.00 0.00 H new ATOM 0 HG23 ILE C 39 9.575 2.972 -11.032 1.00 0.00 H new ATOM 0 HD11 ILE C 39 6.810 6.120 -10.343 1.00 0.00 H new ATOM 0 HD12 ILE C 39 7.639 5.889 -8.785 1.00 0.00 H new ATOM 0 HD13 ILE C 39 8.565 5.827 -10.303 1.00 0.00 H new ATOM 1322 N LEU C 40 9.494 1.203 -7.185 1.00 0.00 N ATOM 1323 CA LEU C 40 10.582 0.466 -6.545 1.00 0.00 C ATOM 1324 C LEU C 40 10.253 -1.027 -6.439 1.00 0.00 C ATOM 1325 O LEU C 40 11.106 -1.876 -6.692 1.00 0.00 O ATOM 1326 CB LEU C 40 10.851 1.048 -5.147 1.00 0.00 C ATOM 1327 CG LEU C 40 11.768 2.284 -5.255 1.00 0.00 C ATOM 1328 CD1 LEU C 40 13.198 1.866 -5.672 1.00 0.00 C ATOM 1329 CD2 LEU C 40 11.188 3.263 -6.292 1.00 0.00 C ATOM 0 H LEU C 40 8.969 1.818 -6.563 1.00 0.00 H new ATOM 0 HA LEU C 40 11.475 0.570 -7.161 1.00 0.00 H new ATOM 0 HB2 LEU C 40 9.910 1.324 -4.672 1.00 0.00 H new ATOM 0 HB3 LEU C 40 11.318 0.293 -4.514 1.00 0.00 H new ATOM 0 HG LEU C 40 11.820 2.770 -4.281 1.00 0.00 H new ATOM 0 HD11 LEU C 40 13.830 2.751 -5.743 1.00 0.00 H new ATOM 0 HD12 LEU C 40 13.610 1.185 -4.927 1.00 0.00 H new ATOM 0 HD13 LEU C 40 13.163 1.367 -6.640 1.00 0.00 H new ATOM 0 HD21 LEU C 40 11.835 4.137 -6.369 1.00 0.00 H new ATOM 0 HD22 LEU C 40 11.126 2.771 -7.262 1.00 0.00 H new ATOM 0 HD23 LEU C 40 10.192 3.576 -5.980 1.00 0.00 H new ATOM 1341 N TRP C 41 9.018 -1.340 -6.050 1.00 0.00 N ATOM 1342 CA TRP C 41 8.599 -2.732 -5.898 1.00 0.00 C ATOM 1343 C TRP C 41 8.500 -3.443 -7.247 1.00 0.00 C ATOM 1344 O TRP C 41 8.994 -4.561 -7.405 1.00 0.00 O ATOM 1345 CB TRP C 41 7.259 -2.793 -5.150 1.00 0.00 C ATOM 1346 CG TRP C 41 6.711 -4.187 -5.168 1.00 0.00 C ATOM 1347 CD1 TRP C 41 7.056 -5.174 -4.309 1.00 0.00 C ATOM 1348 CD2 TRP C 41 5.686 -4.744 -6.038 1.00 0.00 C ATOM 1349 NE1 TRP C 41 6.339 -6.314 -4.629 1.00 0.00 N ATOM 1350 CE2 TRP C 41 5.476 -6.093 -5.680 1.00 0.00 C ATOM 1351 CE3 TRP C 41 4.933 -4.216 -7.101 1.00 0.00 C ATOM 1352 CZ2 TRP C 41 4.553 -6.888 -6.352 1.00 0.00 C ATOM 1353 CZ3 TRP C 41 3.993 -5.015 -7.771 1.00 0.00 C ATOM 1354 CH2 TRP C 41 3.808 -6.348 -7.397 1.00 0.00 C ATOM 0 H TRP C 41 8.295 -0.654 -5.836 1.00 0.00 H new ATOM 0 HA TRP C 41 9.358 -3.254 -5.315 1.00 0.00 H new ATOM 0 HB2 TRP C 41 7.395 -2.463 -4.120 1.00 0.00 H new ATOM 0 HB3 TRP C 41 6.546 -2.110 -5.612 1.00 0.00 H new ATOM 0 HD1 TRP C 41 7.773 -5.087 -3.506 1.00 0.00 H new ATOM 0 HE1 TRP C 41 6.437 -7.207 -4.146 1.00 0.00 H new ATOM 0 HE3 TRP C 41 5.078 -3.190 -7.404 1.00 0.00 H new ATOM 0 HZ2 TRP C 41 4.415 -7.920 -6.064 1.00 0.00 H new ATOM 0 HZ3 TRP C 41 3.411 -4.597 -8.579 1.00 0.00 H new ATOM 0 HH2 TRP C 41 3.087 -6.960 -7.919 1.00 0.00 H new ATOM 1365 N ILE C 42 7.860 -2.799 -8.213 1.00 0.00 N ATOM 1366 CA ILE C 42 7.708 -3.397 -9.535 1.00 0.00 C ATOM 1367 C ILE C 42 9.072 -3.558 -10.204 1.00 0.00 C ATOM 1368 O ILE C 42 9.348 -4.574 -10.841 1.00 0.00 O ATOM 1369 CB ILE C 42 6.786 -2.525 -10.407 1.00 0.00 C ATOM 1370 CG1 ILE C 42 6.286 -3.336 -11.607 1.00 0.00 C ATOM 1371 CG2 ILE C 42 7.543 -1.290 -10.921 1.00 0.00 C ATOM 1372 CD1 ILE C 42 5.224 -2.529 -12.355 1.00 0.00 C ATOM 0 H ILE C 42 7.442 -1.874 -8.111 1.00 0.00 H new ATOM 0 HA ILE C 42 7.257 -4.383 -9.424 1.00 0.00 H new ATOM 0 HB ILE C 42 5.941 -2.202 -9.798 1.00 0.00 H new ATOM 0 HG12 ILE C 42 7.116 -3.571 -12.273 1.00 0.00 H new ATOM 0 HG13 ILE C 42 5.868 -4.285 -11.271 1.00 0.00 H new ATOM 0 HG21 ILE C 42 6.877 -0.685 -11.536 1.00 0.00 H new ATOM 0 HG22 ILE C 42 7.893 -0.699 -10.074 1.00 0.00 H new ATOM 0 HG23 ILE C 42 8.397 -1.609 -11.518 1.00 0.00 H new ATOM 0 HD11 ILE C 42 4.866 -3.103 -13.210 1.00 0.00 H new ATOM 0 HD12 ILE C 42 4.390 -2.316 -11.686 1.00 0.00 H new ATOM 0 HD13 ILE C 42 5.658 -1.592 -12.704 1.00 0.00 H new ATOM 1384 N LEU C 43 9.924 -2.548 -10.048 1.00 0.00 N ATOM 1385 CA LEU C 43 11.256 -2.583 -10.638 1.00 0.00 C ATOM 1386 C LEU C 43 12.069 -3.730 -10.050 1.00 0.00 C ATOM 1387 O LEU C 43 12.803 -4.414 -10.762 1.00 0.00 O ATOM 1388 CB LEU C 43 11.978 -1.252 -10.385 1.00 0.00 C ATOM 1389 CG LEU C 43 13.412 -1.300 -10.942 1.00 0.00 C ATOM 1390 CD1 LEU C 43 13.393 -1.655 -12.437 1.00 0.00 C ATOM 1391 CD2 LEU C 43 14.065 0.071 -10.750 1.00 0.00 C ATOM 0 H LEU C 43 9.716 -1.700 -9.521 1.00 0.00 H new ATOM 0 HA LEU C 43 11.155 -2.739 -11.712 1.00 0.00 H new ATOM 0 HB2 LEU C 43 11.426 -0.438 -10.855 1.00 0.00 H new ATOM 0 HB3 LEU C 43 12.004 -1.044 -9.315 1.00 0.00 H new ATOM 0 HG LEU C 43 13.980 -2.063 -10.409 1.00 0.00 H new ATOM 0 HD11 LEU C 43 14.414 -1.685 -12.817 1.00 0.00 H new ATOM 0 HD12 LEU C 43 12.926 -2.630 -12.573 1.00 0.00 H new ATOM 0 HD13 LEU C 43 12.825 -0.901 -12.983 1.00 0.00 H new ATOM 0 HD21 LEU C 43 15.082 0.048 -11.142 1.00 0.00 H new ATOM 0 HD22 LEU C 43 13.488 0.827 -11.283 1.00 0.00 H new ATOM 0 HD23 LEU C 43 14.091 0.316 -9.688 1.00 0.00 H new ATOM 1403 N ASP C 44 11.942 -3.927 -8.742 1.00 0.00 N ATOM 1404 CA ASP C 44 12.680 -4.987 -8.069 1.00 0.00 C ATOM 1405 C ASP C 44 12.373 -6.334 -8.708 1.00 0.00 C ATOM 1406 O ASP C 44 13.278 -7.124 -8.978 1.00 0.00 O ATOM 1407 CB ASP C 44 12.302 -5.030 -6.589 1.00 0.00 C ATOM 1408 CG ASP C 44 13.143 -6.079 -5.870 1.00 0.00 C ATOM 1409 OD1 ASP C 44 13.863 -6.795 -6.545 1.00 0.00 O ATOM 1410 OD2 ASP C 44 13.056 -6.151 -4.656 1.00 0.00 O ATOM 0 H ASP C 44 11.341 -3.372 -8.133 1.00 0.00 H new ATOM 0 HA ASP C 44 13.746 -4.780 -8.166 1.00 0.00 H new ATOM 0 HB2 ASP C 44 12.460 -4.051 -6.136 1.00 0.00 H new ATOM 0 HB3 ASP C 44 11.243 -5.264 -6.482 1.00 0.00 H new ATOM 1415 N ARG C 45 11.094 -6.591 -8.956 1.00 0.00 N ATOM 1416 CA ARG C 45 10.688 -7.848 -9.571 1.00 0.00 C ATOM 1417 C ARG C 45 11.245 -7.959 -10.989 1.00 0.00 C ATOM 1418 O ARG C 45 11.340 -9.054 -11.543 1.00 0.00 O ATOM 1419 CB ARG C 45 9.161 -7.949 -9.618 1.00 0.00 C ATOM 1420 CG ARG C 45 8.609 -8.115 -8.202 1.00 0.00 C ATOM 1421 CD ARG C 45 7.081 -8.129 -8.255 1.00 0.00 C ATOM 1422 NE ARG C 45 6.618 -9.294 -9.002 1.00 0.00 N ATOM 1423 CZ ARG C 45 5.384 -9.352 -9.490 1.00 0.00 C ATOM 1424 NH1 ARG C 45 4.564 -8.352 -9.313 1.00 0.00 N ATOM 1425 NH2 ARG C 45 4.991 -10.408 -10.147 1.00 0.00 N ATOM 0 H ARG C 45 10.327 -5.953 -8.743 1.00 0.00 H new ATOM 0 HA ARG C 45 11.087 -8.663 -8.967 1.00 0.00 H new ATOM 0 HB2 ARG C 45 8.742 -7.054 -10.079 1.00 0.00 H new ATOM 0 HB3 ARG C 45 8.862 -8.796 -10.236 1.00 0.00 H new ATOM 0 HG2 ARG C 45 8.978 -9.041 -7.762 1.00 0.00 H new ATOM 0 HG3 ARG C 45 8.955 -7.300 -7.566 1.00 0.00 H new ATOM 0 HD2 ARG C 45 6.674 -8.150 -7.244 1.00 0.00 H new ATOM 0 HD3 ARG C 45 6.717 -7.216 -8.726 1.00 0.00 H new ATOM 0 HE ARG C 45 7.253 -10.078 -9.152 1.00 0.00 H new ATOM 0 HH11 ARG C 45 4.871 -7.526 -8.800 1.00 0.00 H new ATOM 0 HH12 ARG C 45 3.616 -8.397 -9.688 1.00 0.00 H new ATOM 0 HH21 ARG C 45 5.631 -11.190 -10.286 1.00 0.00 H new ATOM 0 HH22 ARG C 45 4.043 -10.452 -10.522 1.00 0.00 H new ATOM 1439 N LEU C 46 11.596 -6.821 -11.578 1.00 0.00 N ATOM 1440 CA LEU C 46 12.126 -6.814 -12.938 1.00 0.00 C ATOM 1441 C LEU C 46 13.428 -7.622 -13.002 1.00 0.00 C ATOM 1442 O LEU C 46 13.622 -8.438 -13.902 1.00 0.00 O ATOM 1443 CB LEU C 46 12.378 -5.359 -13.377 1.00 0.00 C ATOM 1444 CG LEU C 46 12.315 -5.231 -14.908 1.00 0.00 C ATOM 1445 CD1 LEU C 46 12.521 -3.765 -15.292 1.00 0.00 C ATOM 1446 CD2 LEU C 46 13.399 -6.097 -15.567 1.00 0.00 C ATOM 0 H LEU C 46 11.525 -5.902 -11.142 1.00 0.00 H new ATOM 0 HA LEU C 46 11.403 -7.274 -13.612 1.00 0.00 H new ATOM 0 HB2 LEU C 46 11.635 -4.704 -12.922 1.00 0.00 H new ATOM 0 HB3 LEU C 46 13.354 -5.031 -13.020 1.00 0.00 H new ATOM 0 HG LEU C 46 11.341 -5.575 -15.257 1.00 0.00 H new ATOM 0 HD11 LEU C 46 12.478 -3.663 -16.376 1.00 0.00 H new ATOM 0 HD12 LEU C 46 11.738 -3.157 -14.839 1.00 0.00 H new ATOM 0 HD13 LEU C 46 13.494 -3.428 -14.934 1.00 0.00 H new ATOM 0 HD21 LEU C 46 13.339 -5.993 -16.650 1.00 0.00 H new ATOM 0 HD22 LEU C 46 14.382 -5.772 -15.226 1.00 0.00 H new ATOM 0 HD23 LEU C 46 13.247 -7.141 -15.293 1.00 0.00 H new ATOM 1458 N PHE C 47 14.314 -7.396 -12.035 1.00 0.00 N ATOM 1459 CA PHE C 47 15.585 -8.116 -11.997 1.00 0.00 C ATOM 1460 C PHE C 47 15.354 -9.614 -11.837 1.00 0.00 C ATOM 1461 O PHE C 47 15.973 -10.424 -12.527 1.00 0.00 O ATOM 1462 CB PHE C 47 16.451 -7.605 -10.842 1.00 0.00 C ATOM 1463 CG PHE C 47 16.943 -6.212 -11.160 1.00 0.00 C ATOM 1464 CD1 PHE C 47 18.014 -6.036 -12.046 1.00 0.00 C ATOM 1465 CD2 PHE C 47 16.328 -5.097 -10.576 1.00 0.00 C ATOM 1466 CE1 PHE C 47 18.471 -4.749 -12.347 1.00 0.00 C ATOM 1467 CE2 PHE C 47 16.784 -3.809 -10.878 1.00 0.00 C ATOM 1468 CZ PHE C 47 17.856 -3.635 -11.764 1.00 0.00 C ATOM 0 H PHE C 47 14.179 -6.729 -11.276 1.00 0.00 H new ATOM 0 HA PHE C 47 16.101 -7.939 -12.941 1.00 0.00 H new ATOM 0 HB2 PHE C 47 15.874 -7.596 -9.917 1.00 0.00 H new ATOM 0 HB3 PHE C 47 17.297 -8.274 -10.684 1.00 0.00 H new ATOM 0 HD1 PHE C 47 18.487 -6.896 -12.497 1.00 0.00 H new ATOM 0 HD2 PHE C 47 15.502 -5.231 -9.893 1.00 0.00 H new ATOM 0 HE1 PHE C 47 19.298 -4.615 -13.029 1.00 0.00 H new ATOM 0 HE2 PHE C 47 16.310 -2.949 -10.428 1.00 0.00 H new ATOM 0 HZ PHE C 47 18.208 -2.641 -11.997 1.00 0.00 H new ATOM 1478 N PHE C 48 14.455 -9.979 -10.922 1.00 0.00 N ATOM 1479 CA PHE C 48 14.142 -11.390 -10.676 1.00 0.00 C ATOM 1480 C PHE C 48 12.633 -11.608 -10.677 1.00 0.00 C ATOM 1481 O PHE C 48 11.882 -10.832 -10.089 1.00 0.00 O ATOM 1482 CB PHE C 48 14.721 -11.816 -9.325 1.00 0.00 C ATOM 1483 CG PHE C 48 16.229 -11.772 -9.394 1.00 0.00 C ATOM 1484 CD1 PHE C 48 16.942 -12.892 -9.841 1.00 0.00 C ATOM 1485 CD2 PHE C 48 16.914 -10.613 -9.015 1.00 0.00 C ATOM 1486 CE1 PHE C 48 18.340 -12.852 -9.907 1.00 0.00 C ATOM 1487 CE2 PHE C 48 18.313 -10.571 -9.080 1.00 0.00 C ATOM 1488 CZ PHE C 48 19.025 -11.691 -9.526 1.00 0.00 C ATOM 0 H PHE C 48 13.933 -9.323 -10.341 1.00 0.00 H new ATOM 0 HA PHE C 48 14.584 -11.991 -11.470 1.00 0.00 H new ATOM 0 HB2 PHE C 48 14.362 -11.154 -8.537 1.00 0.00 H new ATOM 0 HB3 PHE C 48 14.386 -12.822 -9.073 1.00 0.00 H new ATOM 0 HD1 PHE C 48 16.413 -13.787 -10.135 1.00 0.00 H new ATOM 0 HD2 PHE C 48 16.364 -9.749 -8.672 1.00 0.00 H new ATOM 0 HE1 PHE C 48 18.890 -13.715 -10.251 1.00 0.00 H new ATOM 0 HE2 PHE C 48 18.841 -9.676 -8.786 1.00 0.00 H new ATOM 0 HZ PHE C 48 20.103 -11.660 -9.576 1.00 0.00 H new ATOM 1498 N LYS C 49 12.197 -12.673 -11.343 1.00 0.00 N ATOM 1499 CA LYS C 49 10.773 -12.985 -11.418 1.00 0.00 C ATOM 1500 C LYS C 49 10.310 -13.681 -10.142 1.00 0.00 C ATOM 1501 O LYS C 49 9.150 -14.056 -10.082 1.00 0.00 O ATOM 1502 CB LYS C 49 10.501 -13.887 -12.623 1.00 0.00 C ATOM 1503 CG LYS C 49 10.777 -13.111 -13.913 1.00 0.00 C ATOM 1504 CD LYS C 49 10.517 -14.017 -15.119 1.00 0.00 C ATOM 1505 CE LYS C 49 10.796 -13.243 -16.410 1.00 0.00 C ATOM 1506 NZ LYS C 49 10.549 -14.128 -17.582 1.00 0.00 N ATOM 1507 OXT LYS C 49 11.121 -13.829 -9.244 1.00 0.00 O ATOM 0 H LYS C 49 12.803 -13.330 -11.835 1.00 0.00 H new ATOM 0 HA LYS C 49 10.219 -12.053 -11.530 1.00 0.00 H new ATOM 0 HB2 LYS C 49 11.133 -14.774 -12.577 1.00 0.00 H new ATOM 0 HB3 LYS C 49 9.467 -14.231 -12.607 1.00 0.00 H new ATOM 0 HG2 LYS C 49 10.139 -12.229 -13.963 1.00 0.00 H new ATOM 0 HG3 LYS C 49 11.809 -12.759 -13.925 1.00 0.00 H new ATOM 0 HD2 LYS C 49 11.154 -14.900 -15.067 1.00 0.00 H new ATOM 0 HD3 LYS C 49 9.485 -14.367 -15.108 1.00 0.00 H new ATOM 0 HE2 LYS C 49 10.156 -12.362 -16.464 1.00 0.00 H new ATOM 0 HE3 LYS C 49 11.827 -12.889 -16.419 1.00 0.00 H new ATOM 0 HZ1 LYS C 49 10.738 -13.603 -18.460 1.00 0.00 H new ATOM 0 HZ2 LYS C 49 11.177 -14.955 -17.531 1.00 0.00 H new ATOM 0 HZ3 LYS C 49 9.558 -14.445 -17.575 1.00 0.00 H new TER 1521 LYS C 49 ATOM 1522 N SER D 19 -15.931 18.812 10.828 1.00 0.00 N ATOM 1523 CA SER D 19 -15.460 17.729 11.734 1.00 0.00 C ATOM 1524 C SER D 19 -13.978 17.468 11.484 1.00 0.00 C ATOM 1525 O SER D 19 -13.469 16.388 11.783 1.00 0.00 O ATOM 1526 CB SER D 19 -16.265 16.457 11.466 1.00 0.00 C ATOM 1527 OG SER D 19 -16.269 16.188 10.070 1.00 0.00 O ATOM 0 HA SER D 19 -15.601 18.031 12.772 1.00 0.00 H new ATOM 0 HB2 SER D 19 -15.831 15.617 12.008 1.00 0.00 H new ATOM 0 HB3 SER D 19 -17.286 16.576 11.828 1.00 0.00 H new ATOM 0 HG SER D 19 -16.322 17.032 9.574 1.00 0.00 H new ATOM 1535 N ASN D 20 -13.293 18.465 10.935 1.00 0.00 N ATOM 1536 CA ASN D 20 -11.869 18.333 10.650 1.00 0.00 C ATOM 1537 C ASN D 20 -11.073 18.190 11.945 1.00 0.00 C ATOM 1538 O ASN D 20 -10.008 17.573 11.964 1.00 0.00 O ATOM 1539 CB ASN D 20 -11.377 19.557 9.873 1.00 0.00 C ATOM 1540 CG ASN D 20 -11.695 20.832 10.648 1.00 0.00 C ATOM 1541 OD1 ASN D 20 -12.154 20.768 11.790 1.00 0.00 O ATOM 1542 ND2 ASN D 20 -11.476 21.992 10.095 1.00 0.00 N ATOM 0 H ASN D 20 -13.696 19.366 10.680 1.00 0.00 H new ATOM 0 HA ASN D 20 -11.719 17.437 10.047 1.00 0.00 H new ATOM 0 HB2 ASN D 20 -10.303 19.483 9.705 1.00 0.00 H new ATOM 0 HB3 ASN D 20 -11.852 19.590 8.892 1.00 0.00 H new ATOM 0 HD21 ASN D 20 -11.685 22.849 10.608 1.00 0.00 H new ATOM 0 HD22 ASN D 20 -11.096 22.043 9.150 1.00 0.00 H new ATOM 1549 N ASP D 21 -11.597 18.766 13.023 1.00 0.00 N ATOM 1550 CA ASP D 21 -10.926 18.697 14.316 1.00 0.00 C ATOM 1551 C ASP D 21 -10.819 17.252 14.787 1.00 0.00 C ATOM 1552 O ASP D 21 -9.780 16.830 15.296 1.00 0.00 O ATOM 1553 CB ASP D 21 -11.701 19.514 15.351 1.00 0.00 C ATOM 1554 CG ASP D 21 -11.530 21.005 15.075 1.00 0.00 C ATOM 1555 OD1 ASP D 21 -10.646 21.348 14.309 1.00 0.00 O ATOM 1556 OD2 ASP D 21 -12.287 21.781 15.637 1.00 0.00 O ATOM 0 H ASP D 21 -12.477 19.282 13.027 1.00 0.00 H new ATOM 0 HA ASP D 21 -9.922 19.108 14.205 1.00 0.00 H new ATOM 0 HB2 ASP D 21 -12.758 19.249 15.318 1.00 0.00 H new ATOM 0 HB3 ASP D 21 -11.344 19.278 16.354 1.00 0.00 H new ATOM 1561 N SER D 22 -11.897 16.496 14.615 1.00 0.00 N ATOM 1562 CA SER D 22 -11.910 15.098 15.028 1.00 0.00 C ATOM 1563 C SER D 22 -10.864 14.305 14.252 1.00 0.00 C ATOM 1564 O SER D 22 -10.148 13.480 14.820 1.00 0.00 O ATOM 1565 CB SER D 22 -13.296 14.495 14.792 1.00 0.00 C ATOM 1566 OG SER D 22 -13.303 13.147 15.248 1.00 0.00 O ATOM 0 H SER D 22 -12.767 16.824 14.196 1.00 0.00 H new ATOM 0 HA SER D 22 -11.673 15.048 16.091 1.00 0.00 H new ATOM 0 HB2 SER D 22 -14.053 15.074 15.321 1.00 0.00 H new ATOM 0 HB3 SER D 22 -13.547 14.534 13.732 1.00 0.00 H new ATOM 0 HG SER D 22 -14.190 12.756 15.100 1.00 0.00 H new ATOM 1572 N SER D 23 -10.784 14.555 12.947 1.00 0.00 N ATOM 1573 CA SER D 23 -9.823 13.852 12.102 1.00 0.00 C ATOM 1574 C SER D 23 -9.827 12.360 12.423 1.00 0.00 C ATOM 1575 O SER D 23 -9.104 11.907 13.312 1.00 0.00 O ATOM 1576 CB SER D 23 -8.419 14.422 12.320 1.00 0.00 C ATOM 1577 OG SER D 23 -7.454 13.439 11.969 1.00 0.00 O ATOM 0 H SER D 23 -11.367 15.232 12.456 1.00 0.00 H new ATOM 0 HA SER D 23 -10.110 13.991 11.060 1.00 0.00 H new ATOM 0 HB2 SER D 23 -8.280 15.318 11.715 1.00 0.00 H new ATOM 0 HB3 SER D 23 -8.292 14.718 13.361 1.00 0.00 H new ATOM 0 HG SER D 23 -7.514 12.685 12.592 1.00 0.00 H new ATOM 1583 N ASP D 24 -10.655 11.605 11.709 1.00 0.00 N ATOM 1584 CA ASP D 24 -10.755 10.167 11.939 1.00 0.00 C ATOM 1585 C ASP D 24 -9.363 9.522 11.942 1.00 0.00 C ATOM 1586 O ASP D 24 -8.459 9.987 11.247 1.00 0.00 O ATOM 1587 CB ASP D 24 -11.619 9.525 10.844 1.00 0.00 C ATOM 1588 CG ASP D 24 -13.097 9.783 11.119 1.00 0.00 C ATOM 1589 OD1 ASP D 24 -13.645 9.115 11.983 1.00 0.00 O ATOM 1590 OD2 ASP D 24 -13.660 10.642 10.463 1.00 0.00 O ATOM 0 H ASP D 24 -11.263 11.961 10.971 1.00 0.00 H new ATOM 0 HA ASP D 24 -11.218 10.003 12.912 1.00 0.00 H new ATOM 0 HB2 ASP D 24 -11.346 9.932 9.870 1.00 0.00 H new ATOM 0 HB3 ASP D 24 -11.431 8.452 10.805 1.00 0.00 H new ATOM 1595 N PRO D 25 -9.172 8.467 12.702 1.00 0.00 N ATOM 1596 CA PRO D 25 -7.855 7.760 12.777 1.00 0.00 C ATOM 1597 C PRO D 25 -7.517 7.041 11.471 1.00 0.00 C ATOM 1598 O PRO D 25 -6.367 6.668 11.238 1.00 0.00 O ATOM 1599 CB PRO D 25 -8.042 6.762 13.934 1.00 0.00 C ATOM 1600 CG PRO D 25 -9.514 6.516 13.999 1.00 0.00 C ATOM 1601 CD PRO D 25 -10.179 7.826 13.570 1.00 0.00 C ATOM 0 HA PRO D 25 -7.025 8.447 12.940 1.00 0.00 H new ATOM 0 HB2 PRO D 25 -7.495 5.837 13.750 1.00 0.00 H new ATOM 0 HB3 PRO D 25 -7.669 7.172 14.873 1.00 0.00 H new ATOM 0 HG2 PRO D 25 -9.802 5.698 13.339 1.00 0.00 H new ATOM 0 HG3 PRO D 25 -9.819 6.235 15.007 1.00 0.00 H new ATOM 0 HD2 PRO D 25 -11.111 7.644 13.034 1.00 0.00 H new ATOM 0 HD3 PRO D 25 -10.422 8.451 14.429 1.00 0.00 H new ATOM 1609 N LEU D 26 -8.524 6.837 10.628 1.00 0.00 N ATOM 1610 CA LEU D 26 -8.317 6.149 9.359 1.00 0.00 C ATOM 1611 C LEU D 26 -7.346 6.932 8.476 1.00 0.00 C ATOM 1612 O LEU D 26 -6.456 6.352 7.851 1.00 0.00 O ATOM 1613 CB LEU D 26 -9.664 5.988 8.633 1.00 0.00 C ATOM 1614 CG LEU D 26 -10.427 4.792 9.211 1.00 0.00 C ATOM 1615 CD1 LEU D 26 -10.568 4.961 10.726 1.00 0.00 C ATOM 1616 CD2 LEU D 26 -11.818 4.718 8.578 1.00 0.00 C ATOM 0 H LEU D 26 -9.484 7.136 10.799 1.00 0.00 H new ATOM 0 HA LEU D 26 -7.890 5.166 9.559 1.00 0.00 H new ATOM 0 HB2 LEU D 26 -10.257 6.896 8.742 1.00 0.00 H new ATOM 0 HB3 LEU D 26 -9.497 5.843 7.566 1.00 0.00 H new ATOM 0 HG LEU D 26 -9.879 3.875 8.995 1.00 0.00 H new ATOM 0 HD11 LEU D 26 -11.111 4.110 11.138 1.00 0.00 H new ATOM 0 HD12 LEU D 26 -9.578 5.014 11.180 1.00 0.00 H new ATOM 0 HD13 LEU D 26 -11.115 5.879 10.940 1.00 0.00 H new ATOM 0 HD21 LEU D 26 -12.360 3.867 8.990 1.00 0.00 H new ATOM 0 HD22 LEU D 26 -12.365 5.636 8.794 1.00 0.00 H new ATOM 0 HD23 LEU D 26 -11.721 4.599 7.499 1.00 0.00 H new ATOM 1628 N VAL D 27 -7.518 8.250 8.425 1.00 0.00 N ATOM 1629 CA VAL D 27 -6.645 9.092 7.612 1.00 0.00 C ATOM 1630 C VAL D 27 -5.210 9.047 8.136 1.00 0.00 C ATOM 1631 O VAL D 27 -4.262 8.841 7.373 1.00 0.00 O ATOM 1632 CB VAL D 27 -7.151 10.537 7.636 1.00 0.00 C ATOM 1633 CG1 VAL D 27 -6.174 11.440 6.879 1.00 0.00 C ATOM 1634 CG2 VAL D 27 -8.530 10.607 6.976 1.00 0.00 C ATOM 0 H VAL D 27 -8.246 8.754 8.931 1.00 0.00 H new ATOM 0 HA VAL D 27 -6.657 8.715 6.589 1.00 0.00 H new ATOM 0 HB VAL D 27 -7.225 10.875 8.670 1.00 0.00 H new ATOM 0 HG11 VAL D 27 -6.538 12.467 6.899 1.00 0.00 H new ATOM 0 HG12 VAL D 27 -5.194 11.393 7.353 1.00 0.00 H new ATOM 0 HG13 VAL D 27 -6.094 11.103 5.845 1.00 0.00 H new ATOM 0 HG21 VAL D 27 -8.890 11.636 6.993 1.00 0.00 H new ATOM 0 HG22 VAL D 27 -8.457 10.265 5.943 1.00 0.00 H new ATOM 0 HG23 VAL D 27 -9.227 9.970 7.521 1.00 0.00 H new ATOM 1644 N VAL D 28 -5.060 9.238 9.442 1.00 0.00 N ATOM 1645 CA VAL D 28 -3.741 9.219 10.064 1.00 0.00 C ATOM 1646 C VAL D 28 -3.126 7.830 9.959 1.00 0.00 C ATOM 1647 O VAL D 28 -1.946 7.682 9.636 1.00 0.00 O ATOM 1648 CB VAL D 28 -3.848 9.629 11.533 1.00 0.00 C ATOM 1649 CG1 VAL D 28 -2.477 9.508 12.202 1.00 0.00 C ATOM 1650 CG2 VAL D 28 -4.331 11.077 11.623 1.00 0.00 C ATOM 0 H VAL D 28 -5.831 9.407 10.088 1.00 0.00 H new ATOM 0 HA VAL D 28 -3.100 9.928 9.541 1.00 0.00 H new ATOM 0 HB VAL D 28 -4.557 8.975 12.040 1.00 0.00 H new ATOM 0 HG11 VAL D 28 -2.556 9.801 13.249 1.00 0.00 H new ATOM 0 HG12 VAL D 28 -2.131 8.476 12.139 1.00 0.00 H new ATOM 0 HG13 VAL D 28 -1.766 10.161 11.695 1.00 0.00 H new ATOM 0 HG21 VAL D 28 -4.408 11.371 12.670 1.00 0.00 H new ATOM 0 HG22 VAL D 28 -3.621 11.730 11.114 1.00 0.00 H new ATOM 0 HG23 VAL D 28 -5.309 11.165 11.149 1.00 0.00 H new ATOM 1660 N ALA D 29 -3.933 6.812 10.236 1.00 0.00 N ATOM 1661 CA ALA D 29 -3.463 5.436 10.172 1.00 0.00 C ATOM 1662 C ALA D 29 -3.038 5.084 8.752 1.00 0.00 C ATOM 1663 O ALA D 29 -2.035 4.405 8.549 1.00 0.00 O ATOM 1664 CB ALA D 29 -4.571 4.483 10.624 1.00 0.00 C ATOM 0 H ALA D 29 -4.911 6.914 10.506 1.00 0.00 H new ATOM 0 HA ALA D 29 -2.604 5.334 10.835 1.00 0.00 H new ATOM 0 HB1 ALA D 29 -4.211 3.456 10.573 1.00 0.00 H new ATOM 0 HB2 ALA D 29 -4.856 4.717 11.650 1.00 0.00 H new ATOM 0 HB3 ALA D 29 -5.437 4.597 9.972 1.00 0.00 H new ATOM 1670 N ALA D 30 -3.799 5.552 7.772 1.00 0.00 N ATOM 1671 CA ALA D 30 -3.478 5.269 6.379 1.00 0.00 C ATOM 1672 C ALA D 30 -2.047 5.696 6.070 1.00 0.00 C ATOM 1673 O ALA D 30 -1.264 4.921 5.519 1.00 0.00 O ATOM 1674 CB ALA D 30 -4.446 6.012 5.457 1.00 0.00 C ATOM 0 H ALA D 30 -4.633 6.122 7.912 1.00 0.00 H new ATOM 0 HA ALA D 30 -3.573 4.196 6.211 1.00 0.00 H new ATOM 0 HB1 ALA D 30 -4.198 5.794 4.418 1.00 0.00 H new ATOM 0 HB2 ALA D 30 -5.466 5.687 5.663 1.00 0.00 H new ATOM 0 HB3 ALA D 30 -4.365 7.085 5.632 1.00 0.00 H new ATOM 1680 N SER D 31 -1.706 6.927 6.437 1.00 0.00 N ATOM 1681 CA SER D 31 -0.358 7.436 6.200 1.00 0.00 C ATOM 1682 C SER D 31 0.675 6.609 6.966 1.00 0.00 C ATOM 1683 O SER D 31 1.737 6.280 6.436 1.00 0.00 O ATOM 1684 CB SER D 31 -0.267 8.900 6.631 1.00 0.00 C ATOM 1685 OG SER D 31 1.101 9.281 6.711 1.00 0.00 O ATOM 0 H SER D 31 -2.336 7.585 6.895 1.00 0.00 H new ATOM 0 HA SER D 31 -0.146 7.359 5.134 1.00 0.00 H new ATOM 0 HB2 SER D 31 -0.792 9.535 5.917 1.00 0.00 H new ATOM 0 HB3 SER D 31 -0.752 9.038 7.597 1.00 0.00 H new ATOM 0 HG SER D 31 1.164 10.220 6.986 1.00 0.00 H new ATOM 1691 N ILE D 32 0.359 6.284 8.217 1.00 0.00 N ATOM 1692 CA ILE D 32 1.267 5.504 9.055 1.00 0.00 C ATOM 1693 C ILE D 32 1.488 4.114 8.463 1.00 0.00 C ATOM 1694 O ILE D 32 2.609 3.611 8.449 1.00 0.00 O ATOM 1695 CB ILE D 32 0.705 5.381 10.476 1.00 0.00 C ATOM 1696 CG1 ILE D 32 0.716 6.760 11.143 1.00 0.00 C ATOM 1697 CG2 ILE D 32 1.572 4.418 11.293 1.00 0.00 C ATOM 1698 CD1 ILE D 32 -0.078 6.700 12.450 1.00 0.00 C ATOM 0 H ILE D 32 -0.515 6.547 8.672 1.00 0.00 H new ATOM 0 HA ILE D 32 2.225 6.023 9.094 1.00 0.00 H new ATOM 0 HB ILE D 32 -0.315 4.999 10.431 1.00 0.00 H new ATOM 0 HG12 ILE D 32 1.741 7.072 11.342 1.00 0.00 H new ATOM 0 HG13 ILE D 32 0.281 7.503 10.474 1.00 0.00 H new ATOM 0 HG21 ILE D 32 1.169 4.333 12.302 1.00 0.00 H new ATOM 0 HG22 ILE D 32 1.572 3.437 10.819 1.00 0.00 H new ATOM 0 HG23 ILE D 32 2.593 4.798 11.340 1.00 0.00 H new ATOM 0 HD11 ILE D 32 -0.071 7.681 12.925 1.00 0.00 H new ATOM 0 HD12 ILE D 32 -1.106 6.407 12.238 1.00 0.00 H new ATOM 0 HD13 ILE D 32 0.377 5.969 13.119 1.00 0.00 H new ATOM 1710 N ILE D 33 0.418 3.495 7.984 1.00 0.00 N ATOM 1711 CA ILE D 33 0.522 2.161 7.402 1.00 0.00 C ATOM 1712 C ILE D 33 1.451 2.166 6.190 1.00 0.00 C ATOM 1713 O ILE D 33 2.290 1.279 6.040 1.00 0.00 O ATOM 1714 CB ILE D 33 -0.873 1.672 6.984 1.00 0.00 C ATOM 1715 CG1 ILE D 33 -1.706 1.370 8.235 1.00 0.00 C ATOM 1716 CG2 ILE D 33 -0.760 0.404 6.120 1.00 0.00 C ATOM 1717 CD1 ILE D 33 -3.177 1.231 7.834 1.00 0.00 C ATOM 0 H ILE D 33 -0.523 3.888 7.986 1.00 0.00 H new ATOM 0 HA ILE D 33 0.939 1.488 8.151 1.00 0.00 H new ATOM 0 HB ILE D 33 -1.360 2.453 6.399 1.00 0.00 H new ATOM 0 HG12 ILE D 33 -1.356 0.452 8.707 1.00 0.00 H new ATOM 0 HG13 ILE D 33 -1.589 2.169 8.967 1.00 0.00 H new ATOM 0 HG21 ILE D 33 -1.757 0.070 5.832 1.00 0.00 H new ATOM 0 HG22 ILE D 33 -0.178 0.624 5.225 1.00 0.00 H new ATOM 0 HG23 ILE D 33 -0.265 -0.382 6.690 1.00 0.00 H new ATOM 0 HD11 ILE D 33 -3.777 1.016 8.719 1.00 0.00 H new ATOM 0 HD12 ILE D 33 -3.520 2.161 7.380 1.00 0.00 H new ATOM 0 HD13 ILE D 33 -3.283 0.417 7.117 1.00 0.00 H new ATOM 1729 N GLY D 34 1.299 3.162 5.326 1.00 0.00 N ATOM 1730 CA GLY D 34 2.138 3.246 4.137 1.00 0.00 C ATOM 1731 C GLY D 34 3.599 3.488 4.505 1.00 0.00 C ATOM 1732 O GLY D 34 4.487 2.760 4.059 1.00 0.00 O ATOM 0 H GLY D 34 0.614 3.912 5.423 1.00 0.00 H new ATOM 0 HA2 GLY D 34 2.053 2.323 3.564 1.00 0.00 H new ATOM 0 HA3 GLY D 34 1.784 4.053 3.496 1.00 0.00 H new ATOM 1736 N ILE D 35 3.846 4.513 5.315 1.00 0.00 N ATOM 1737 CA ILE D 35 5.209 4.841 5.724 1.00 0.00 C ATOM 1738 C ILE D 35 5.808 3.733 6.594 1.00 0.00 C ATOM 1739 O ILE D 35 6.963 3.346 6.411 1.00 0.00 O ATOM 1740 CB ILE D 35 5.214 6.166 6.498 1.00 0.00 C ATOM 1741 CG1 ILE D 35 4.831 7.307 5.551 1.00 0.00 C ATOM 1742 CG2 ILE D 35 6.613 6.428 7.065 1.00 0.00 C ATOM 1743 CD1 ILE D 35 4.558 8.575 6.362 1.00 0.00 C ATOM 0 H ILE D 35 3.127 5.127 5.699 1.00 0.00 H new ATOM 0 HA ILE D 35 5.819 4.937 4.826 1.00 0.00 H new ATOM 0 HB ILE D 35 4.496 6.109 7.317 1.00 0.00 H new ATOM 0 HG12 ILE D 35 5.635 7.486 4.837 1.00 0.00 H new ATOM 0 HG13 ILE D 35 3.947 7.034 4.975 1.00 0.00 H new ATOM 0 HG21 ILE D 35 6.613 7.370 7.614 1.00 0.00 H new ATOM 0 HG22 ILE D 35 6.891 5.616 7.737 1.00 0.00 H new ATOM 0 HG23 ILE D 35 7.332 6.485 6.248 1.00 0.00 H new ATOM 0 HD11 ILE D 35 4.285 9.387 5.687 1.00 0.00 H new ATOM 0 HD12 ILE D 35 3.740 8.392 7.059 1.00 0.00 H new ATOM 0 HD13 ILE D 35 5.454 8.851 6.918 1.00 0.00 H new ATOM 1755 N LEU D 36 5.023 3.237 7.547 1.00 0.00 N ATOM 1756 CA LEU D 36 5.493 2.184 8.447 1.00 0.00 C ATOM 1757 C LEU D 36 5.816 0.914 7.669 1.00 0.00 C ATOM 1758 O LEU D 36 6.864 0.299 7.872 1.00 0.00 O ATOM 1759 CB LEU D 36 4.416 1.885 9.497 1.00 0.00 C ATOM 1760 CG LEU D 36 4.921 0.841 10.505 1.00 0.00 C ATOM 1761 CD1 LEU D 36 6.131 1.392 11.284 1.00 0.00 C ATOM 1762 CD2 LEU D 36 3.788 0.509 11.482 1.00 0.00 C ATOM 0 H LEU D 36 4.065 3.544 7.717 1.00 0.00 H new ATOM 0 HA LEU D 36 6.401 2.529 8.941 1.00 0.00 H new ATOM 0 HB2 LEU D 36 4.145 2.802 10.020 1.00 0.00 H new ATOM 0 HB3 LEU D 36 3.514 1.519 9.007 1.00 0.00 H new ATOM 0 HG LEU D 36 5.231 -0.058 9.971 1.00 0.00 H new ATOM 0 HD11 LEU D 36 6.478 0.642 11.995 1.00 0.00 H new ATOM 0 HD12 LEU D 36 6.934 1.631 10.587 1.00 0.00 H new ATOM 0 HD13 LEU D 36 5.837 2.293 11.822 1.00 0.00 H new ATOM 0 HD21 LEU D 36 4.134 -0.232 12.203 1.00 0.00 H new ATOM 0 HD22 LEU D 36 3.485 1.414 12.009 1.00 0.00 H new ATOM 0 HD23 LEU D 36 2.938 0.108 10.930 1.00 0.00 H new ATOM 1774 N HIS D 37 4.916 0.532 6.772 1.00 0.00 N ATOM 1775 CA HIS D 37 5.123 -0.663 5.969 1.00 0.00 C ATOM 1776 C HIS D 37 6.390 -0.526 5.139 1.00 0.00 C ATOM 1777 O HIS D 37 7.149 -1.483 4.983 1.00 0.00 O ATOM 1778 CB HIS D 37 3.929 -0.899 5.042 1.00 0.00 C ATOM 1779 CG HIS D 37 4.170 -2.150 4.245 1.00 0.00 C ATOM 1780 ND1 HIS D 37 3.363 -3.271 4.357 1.00 0.00 N ATOM 1781 CD2 HIS D 37 5.139 -2.482 3.334 1.00 0.00 C ATOM 1782 CE1 HIS D 37 3.862 -4.211 3.533 1.00 0.00 C ATOM 1783 NE2 HIS D 37 4.943 -3.781 2.886 1.00 0.00 N ATOM 0 H HIS D 37 4.044 1.028 6.584 1.00 0.00 H new ATOM 0 HA HIS D 37 5.224 -1.514 6.643 1.00 0.00 H new ATOM 0 HB2 HIS D 37 3.013 -0.994 5.625 1.00 0.00 H new ATOM 0 HB3 HIS D 37 3.796 -0.047 4.375 1.00 0.00 H new ATOM 0 HD2 HIS D 37 5.937 -1.829 3.012 1.00 0.00 H new ATOM 0 HE1 HIS D 37 3.436 -5.196 3.411 1.00 0.00 H new ATOM 0 HE2 HIS D 37 5.505 -4.295 2.208 1.00 0.00 H new ATOM 1791 N LEU D 38 6.609 0.667 4.595 1.00 0.00 N ATOM 1792 CA LEU D 38 7.782 0.909 3.764 1.00 0.00 C ATOM 1793 C LEU D 38 9.069 0.675 4.547 1.00 0.00 C ATOM 1794 O LEU D 38 10.024 0.134 4.004 1.00 0.00 O ATOM 1795 CB LEU D 38 7.759 2.352 3.211 1.00 0.00 C ATOM 1796 CG LEU D 38 6.988 2.414 1.877 1.00 0.00 C ATOM 1797 CD1 LEU D 38 6.600 3.869 1.572 1.00 0.00 C ATOM 1798 CD2 LEU D 38 7.868 1.873 0.731 1.00 0.00 C ATOM 0 H LEU D 38 5.996 1.474 4.713 1.00 0.00 H new ATOM 0 HA LEU D 38 7.754 0.205 2.932 1.00 0.00 H new ATOM 0 HB2 LEU D 38 7.292 3.017 3.937 1.00 0.00 H new ATOM 0 HB3 LEU D 38 8.779 2.706 3.064 1.00 0.00 H new ATOM 0 HG LEU D 38 6.089 1.803 1.961 1.00 0.00 H new ATOM 0 HD11 LEU D 38 6.055 3.910 0.629 1.00 0.00 H new ATOM 0 HD12 LEU D 38 5.968 4.253 2.373 1.00 0.00 H new ATOM 0 HD13 LEU D 38 7.501 4.478 1.497 1.00 0.00 H new ATOM 0 HD21 LEU D 38 7.314 1.921 -0.207 1.00 0.00 H new ATOM 0 HD22 LEU D 38 8.772 2.477 0.650 1.00 0.00 H new ATOM 0 HD23 LEU D 38 8.140 0.838 0.939 1.00 0.00 H new ATOM 1810 N ILE D 39 9.101 1.093 5.803 1.00 0.00 N ATOM 1811 CA ILE D 39 10.304 0.918 6.605 1.00 0.00 C ATOM 1812 C ILE D 39 10.614 -0.571 6.769 1.00 0.00 C ATOM 1813 O ILE D 39 11.760 -0.997 6.623 1.00 0.00 O ATOM 1814 CB ILE D 39 10.102 1.560 7.977 1.00 0.00 C ATOM 1815 CG1 ILE D 39 9.958 3.074 7.803 1.00 0.00 C ATOM 1816 CG2 ILE D 39 11.317 1.271 8.861 1.00 0.00 C ATOM 1817 CD1 ILE D 39 9.460 3.699 9.107 1.00 0.00 C ATOM 0 H ILE D 39 8.324 1.548 6.283 1.00 0.00 H new ATOM 0 HA ILE D 39 11.142 1.399 6.101 1.00 0.00 H new ATOM 0 HB ILE D 39 9.206 1.151 8.444 1.00 0.00 H new ATOM 0 HG12 ILE D 39 10.917 3.510 7.523 1.00 0.00 H new ATOM 0 HG13 ILE D 39 9.260 3.292 6.995 1.00 0.00 H new ATOM 0 HG21 ILE D 39 11.172 1.729 9.839 1.00 0.00 H new ATOM 0 HG22 ILE D 39 11.433 0.194 8.978 1.00 0.00 H new ATOM 0 HG23 ILE D 39 12.212 1.684 8.396 1.00 0.00 H new ATOM 0 HD11 ILE D 39 9.359 4.777 8.979 1.00 0.00 H new ATOM 0 HD12 ILE D 39 8.492 3.272 9.368 1.00 0.00 H new ATOM 0 HD13 ILE D 39 10.174 3.494 9.905 1.00 0.00 H new ATOM 1829 N LEU D 40 9.586 -1.360 7.067 1.00 0.00 N ATOM 1830 CA LEU D 40 9.771 -2.800 7.232 1.00 0.00 C ATOM 1831 C LEU D 40 10.068 -3.478 5.891 1.00 0.00 C ATOM 1832 O LEU D 40 10.940 -4.342 5.803 1.00 0.00 O ATOM 1833 CB LEU D 40 8.516 -3.418 7.873 1.00 0.00 C ATOM 1834 CG LEU D 40 8.563 -3.248 9.405 1.00 0.00 C ATOM 1835 CD1 LEU D 40 9.666 -4.145 10.017 1.00 0.00 C ATOM 1836 CD2 LEU D 40 8.840 -1.775 9.750 1.00 0.00 C ATOM 0 H LEU D 40 8.629 -1.034 7.198 1.00 0.00 H new ATOM 0 HA LEU D 40 10.627 -2.962 7.887 1.00 0.00 H new ATOM 0 HB2 LEU D 40 7.622 -2.940 7.474 1.00 0.00 H new ATOM 0 HB3 LEU D 40 8.452 -4.476 7.619 1.00 0.00 H new ATOM 0 HG LEU D 40 7.601 -3.547 9.822 1.00 0.00 H new ATOM 0 HD11 LEU D 40 9.685 -4.012 11.099 1.00 0.00 H new ATOM 0 HD12 LEU D 40 9.457 -5.189 9.783 1.00 0.00 H new ATOM 0 HD13 LEU D 40 10.634 -3.867 9.601 1.00 0.00 H new ATOM 0 HD21 LEU D 40 8.873 -1.655 10.833 1.00 0.00 H new ATOM 0 HD22 LEU D 40 9.797 -1.475 9.322 1.00 0.00 H new ATOM 0 HD23 LEU D 40 8.047 -1.150 9.340 1.00 0.00 H new ATOM 1848 N TRP D 41 9.325 -3.092 4.854 1.00 0.00 N ATOM 1849 CA TRP D 41 9.509 -3.684 3.530 1.00 0.00 C ATOM 1850 C TRP D 41 10.842 -3.272 2.905 1.00 0.00 C ATOM 1851 O TRP D 41 11.575 -4.115 2.381 1.00 0.00 O ATOM 1852 CB TRP D 41 8.335 -3.288 2.620 1.00 0.00 C ATOM 1853 CG TRP D 41 8.607 -3.708 1.208 1.00 0.00 C ATOM 1854 CD1 TRP D 41 8.380 -4.945 0.706 1.00 0.00 C ATOM 1855 CD2 TRP D 41 9.093 -2.900 0.101 1.00 0.00 C ATOM 1856 NE1 TRP D 41 8.744 -4.956 -0.628 1.00 0.00 N ATOM 1857 CE2 TRP D 41 9.179 -3.716 -1.047 1.00 0.00 C ATOM 1858 CE3 TRP D 41 9.475 -1.551 -0.014 1.00 0.00 C ATOM 1859 CZ2 TRP D 41 9.627 -3.214 -2.263 1.00 0.00 C ATOM 1860 CZ3 TRP D 41 9.916 -1.043 -1.247 1.00 0.00 C ATOM 1861 CH2 TRP D 41 9.993 -1.874 -2.366 1.00 0.00 C ATOM 0 H TRP D 41 8.597 -2.379 4.904 1.00 0.00 H new ATOM 0 HA TRP D 41 9.530 -4.768 3.641 1.00 0.00 H new ATOM 0 HB2 TRP D 41 7.417 -3.756 2.975 1.00 0.00 H new ATOM 0 HB3 TRP D 41 8.181 -2.210 2.663 1.00 0.00 H new ATOM 0 HD1 TRP D 41 7.981 -5.784 1.256 1.00 0.00 H new ATOM 0 HE1 TRP D 41 8.697 -5.779 -1.228 1.00 0.00 H new ATOM 0 HE3 TRP D 41 9.429 -0.903 0.849 1.00 0.00 H new ATOM 0 HZ2 TRP D 41 9.691 -3.861 -3.125 1.00 0.00 H new ATOM 0 HZ3 TRP D 41 10.197 -0.004 -1.330 1.00 0.00 H new ATOM 0 HH2 TRP D 41 10.336 -1.478 -3.311 1.00 0.00 H new ATOM 1872 N ILE D 42 11.151 -1.984 2.957 1.00 0.00 N ATOM 1873 CA ILE D 42 12.399 -1.493 2.383 1.00 0.00 C ATOM 1874 C ILE D 42 13.595 -2.068 3.143 1.00 0.00 C ATOM 1875 O ILE D 42 14.598 -2.452 2.545 1.00 0.00 O ATOM 1876 CB ILE D 42 12.430 0.046 2.424 1.00 0.00 C ATOM 1877 CG1 ILE D 42 13.505 0.569 1.465 1.00 0.00 C ATOM 1878 CG2 ILE D 42 12.748 0.537 3.846 1.00 0.00 C ATOM 1879 CD1 ILE D 42 13.396 2.091 1.369 1.00 0.00 C ATOM 0 H ILE D 42 10.565 -1.267 3.384 1.00 0.00 H new ATOM 0 HA ILE D 42 12.459 -1.818 1.344 1.00 0.00 H new ATOM 0 HB ILE D 42 11.451 0.420 2.124 1.00 0.00 H new ATOM 0 HG12 ILE D 42 14.496 0.285 1.820 1.00 0.00 H new ATOM 0 HG13 ILE D 42 13.379 0.121 0.479 1.00 0.00 H new ATOM 0 HG21 ILE D 42 12.766 1.627 3.859 1.00 0.00 H new ATOM 0 HG22 ILE D 42 11.982 0.179 4.534 1.00 0.00 H new ATOM 0 HG23 ILE D 42 13.721 0.154 4.154 1.00 0.00 H new ATOM 0 HD11 ILE D 42 14.159 2.468 0.688 1.00 0.00 H new ATOM 0 HD12 ILE D 42 12.409 2.362 0.995 1.00 0.00 H new ATOM 0 HD13 ILE D 42 13.542 2.529 2.356 1.00 0.00 H new ATOM 1891 N LEU D 43 13.474 -2.126 4.467 1.00 0.00 N ATOM 1892 CA LEU D 43 14.544 -2.656 5.302 1.00 0.00 C ATOM 1893 C LEU D 43 14.799 -4.122 4.978 1.00 0.00 C ATOM 1894 O LEU D 43 15.946 -4.566 4.928 1.00 0.00 O ATOM 1895 CB LEU D 43 14.174 -2.509 6.786 1.00 0.00 C ATOM 1896 CG LEU D 43 15.265 -3.125 7.678 1.00 0.00 C ATOM 1897 CD1 LEU D 43 16.628 -2.487 7.376 1.00 0.00 C ATOM 1898 CD2 LEU D 43 14.901 -2.882 9.145 1.00 0.00 C ATOM 0 H LEU D 43 12.650 -1.814 4.981 1.00 0.00 H new ATOM 0 HA LEU D 43 15.453 -2.090 5.099 1.00 0.00 H new ATOM 0 HB2 LEU D 43 14.047 -1.455 7.032 1.00 0.00 H new ATOM 0 HB3 LEU D 43 13.219 -2.998 6.979 1.00 0.00 H new ATOM 0 HG LEU D 43 15.330 -4.195 7.479 1.00 0.00 H new ATOM 0 HD11 LEU D 43 17.389 -2.934 8.016 1.00 0.00 H new ATOM 0 HD12 LEU D 43 16.886 -2.658 6.331 1.00 0.00 H new ATOM 0 HD13 LEU D 43 16.578 -1.415 7.567 1.00 0.00 H new ATOM 0 HD21 LEU D 43 15.668 -3.315 9.787 1.00 0.00 H new ATOM 0 HD22 LEU D 43 14.835 -1.810 9.331 1.00 0.00 H new ATOM 0 HD23 LEU D 43 13.940 -3.348 9.363 1.00 0.00 H new ATOM 1910 N ASP D 44 13.722 -4.872 4.767 1.00 0.00 N ATOM 1911 CA ASP D 44 13.846 -6.290 4.461 1.00 0.00 C ATOM 1912 C ASP D 44 14.720 -6.492 3.229 1.00 0.00 C ATOM 1913 O ASP D 44 15.606 -7.347 3.219 1.00 0.00 O ATOM 1914 CB ASP D 44 12.465 -6.897 4.208 1.00 0.00 C ATOM 1915 CG ASP D 44 12.593 -8.395 3.966 1.00 0.00 C ATOM 1916 OD1 ASP D 44 13.715 -8.867 3.881 1.00 0.00 O ATOM 1917 OD2 ASP D 44 11.568 -9.051 3.871 1.00 0.00 O ATOM 0 H ASP D 44 12.764 -4.525 4.802 1.00 0.00 H new ATOM 0 HA ASP D 44 14.309 -6.786 5.314 1.00 0.00 H new ATOM 0 HB2 ASP D 44 11.815 -6.712 5.063 1.00 0.00 H new ATOM 0 HB3 ASP D 44 12.001 -6.419 3.345 1.00 0.00 H new ATOM 1922 N ARG D 45 14.474 -5.696 2.195 1.00 0.00 N ATOM 1923 CA ARG D 45 15.256 -5.799 0.968 1.00 0.00 C ATOM 1924 C ARG D 45 16.715 -5.428 1.226 1.00 0.00 C ATOM 1925 O ARG D 45 17.602 -5.788 0.450 1.00 0.00 O ATOM 1926 CB ARG D 45 14.682 -4.875 -0.108 1.00 0.00 C ATOM 1927 CG ARG D 45 13.323 -5.402 -0.572 1.00 0.00 C ATOM 1928 CD ARG D 45 12.724 -4.422 -1.582 1.00 0.00 C ATOM 1929 NE ARG D 45 13.559 -4.365 -2.777 1.00 0.00 N ATOM 1930 CZ ARG D 45 13.466 -3.354 -3.634 1.00 0.00 C ATOM 1931 NH1 ARG D 45 12.620 -2.386 -3.412 1.00 0.00 N ATOM 1932 NH2 ARG D 45 14.223 -3.327 -4.697 1.00 0.00 N ATOM 0 H ARG D 45 13.748 -4.980 2.180 1.00 0.00 H new ATOM 0 HA ARG D 45 15.207 -6.832 0.623 1.00 0.00 H new ATOM 0 HB2 ARG D 45 14.575 -3.865 0.287 1.00 0.00 H new ATOM 0 HB3 ARG D 45 15.368 -4.816 -0.953 1.00 0.00 H new ATOM 0 HG2 ARG D 45 13.437 -6.387 -1.025 1.00 0.00 H new ATOM 0 HG3 ARG D 45 12.654 -5.519 0.281 1.00 0.00 H new ATOM 0 HD2 ARG D 45 11.714 -4.734 -1.849 1.00 0.00 H new ATOM 0 HD3 ARG D 45 12.645 -3.431 -1.136 1.00 0.00 H new ATOM 0 HE ARG D 45 14.226 -5.115 -2.958 1.00 0.00 H new ATOM 0 HH11 ARG D 45 12.030 -2.405 -2.580 1.00 0.00 H new ATOM 0 HH12 ARG D 45 12.549 -1.610 -4.070 1.00 0.00 H new ATOM 0 HH21 ARG D 45 14.886 -4.082 -4.870 1.00 0.00 H new ATOM 0 HH22 ARG D 45 14.151 -2.551 -5.355 1.00 0.00 H new ATOM 1946 N LEU D 46 16.957 -4.694 2.306 1.00 0.00 N ATOM 1947 CA LEU D 46 18.315 -4.272 2.636 1.00 0.00 C ATOM 1948 C LEU D 46 19.206 -5.498 2.875 1.00 0.00 C ATOM 1949 O LEU D 46 20.325 -5.575 2.371 1.00 0.00 O ATOM 1950 CB LEU D 46 18.280 -3.385 3.894 1.00 0.00 C ATOM 1951 CG LEU D 46 19.484 -2.431 3.925 1.00 0.00 C ATOM 1952 CD1 LEU D 46 19.378 -1.538 5.163 1.00 0.00 C ATOM 1953 CD2 LEU D 46 20.800 -3.225 3.969 1.00 0.00 C ATOM 0 H LEU D 46 16.241 -4.381 2.962 1.00 0.00 H new ATOM 0 HA LEU D 46 18.729 -3.702 1.805 1.00 0.00 H new ATOM 0 HB2 LEU D 46 17.354 -2.810 3.913 1.00 0.00 H new ATOM 0 HB3 LEU D 46 18.284 -4.011 4.786 1.00 0.00 H new ATOM 0 HG LEU D 46 19.481 -1.820 3.023 1.00 0.00 H new ATOM 0 HD11 LEU D 46 20.228 -0.857 5.194 1.00 0.00 H new ATOM 0 HD12 LEU D 46 18.453 -0.962 5.118 1.00 0.00 H new ATOM 0 HD13 LEU D 46 19.376 -2.158 6.060 1.00 0.00 H new ATOM 0 HD21 LEU D 46 21.642 -2.533 3.991 1.00 0.00 H new ATOM 0 HD22 LEU D 46 20.819 -3.848 4.863 1.00 0.00 H new ATOM 0 HD23 LEU D 46 20.873 -3.858 3.084 1.00 0.00 H new ATOM 1965 N PHE D 47 18.695 -6.462 3.640 1.00 0.00 N ATOM 1966 CA PHE D 47 19.457 -7.674 3.929 1.00 0.00 C ATOM 1967 C PHE D 47 19.749 -8.445 2.648 1.00 0.00 C ATOM 1968 O PHE D 47 20.873 -8.901 2.430 1.00 0.00 O ATOM 1969 CB PHE D 47 18.682 -8.569 4.901 1.00 0.00 C ATOM 1970 CG PHE D 47 18.668 -7.931 6.271 1.00 0.00 C ATOM 1971 CD1 PHE D 47 19.801 -8.017 7.090 1.00 0.00 C ATOM 1972 CD2 PHE D 47 17.530 -7.251 6.719 1.00 0.00 C ATOM 1973 CE1 PHE D 47 19.793 -7.424 8.358 1.00 0.00 C ATOM 1974 CE2 PHE D 47 17.523 -6.658 7.987 1.00 0.00 C ATOM 1975 CZ PHE D 47 18.655 -6.743 8.807 1.00 0.00 C ATOM 0 H PHE D 47 17.769 -6.428 4.066 1.00 0.00 H new ATOM 0 HA PHE D 47 20.402 -7.380 4.386 1.00 0.00 H new ATOM 0 HB2 PHE D 47 17.662 -8.713 4.545 1.00 0.00 H new ATOM 0 HB3 PHE D 47 19.144 -9.555 4.952 1.00 0.00 H new ATOM 0 HD1 PHE D 47 20.680 -8.540 6.744 1.00 0.00 H new ATOM 0 HD2 PHE D 47 16.657 -7.184 6.087 1.00 0.00 H new ATOM 0 HE1 PHE D 47 20.666 -7.492 8.991 1.00 0.00 H new ATOM 0 HE2 PHE D 47 16.644 -6.135 8.333 1.00 0.00 H new ATOM 0 HZ PHE D 47 18.650 -6.284 9.785 1.00 0.00 H new ATOM 1985 N PHE D 48 18.733 -8.588 1.798 1.00 0.00 N ATOM 1986 CA PHE D 48 18.887 -9.308 0.530 1.00 0.00 C ATOM 1987 C PHE D 48 18.325 -8.484 -0.622 1.00 0.00 C ATOM 1988 O PHE D 48 17.242 -7.909 -0.517 1.00 0.00 O ATOM 1989 CB PHE D 48 18.157 -10.649 0.608 1.00 0.00 C ATOM 1990 CG PHE D 48 18.840 -11.530 1.626 1.00 0.00 C ATOM 1991 CD1 PHE D 48 19.908 -12.350 1.240 1.00 0.00 C ATOM 1992 CD2 PHE D 48 18.407 -11.527 2.958 1.00 0.00 C ATOM 1993 CE1 PHE D 48 20.542 -13.164 2.184 1.00 0.00 C ATOM 1994 CE2 PHE D 48 19.043 -12.343 3.901 1.00 0.00 C ATOM 1995 CZ PHE D 48 20.110 -13.162 3.514 1.00 0.00 C ATOM 0 H PHE D 48 17.797 -8.217 1.961 1.00 0.00 H new ATOM 0 HA PHE D 48 19.948 -9.481 0.352 1.00 0.00 H new ATOM 0 HB2 PHE D 48 17.115 -10.493 0.886 1.00 0.00 H new ATOM 0 HB3 PHE D 48 18.158 -11.134 -0.368 1.00 0.00 H new ATOM 0 HD1 PHE D 48 20.242 -12.354 0.213 1.00 0.00 H new ATOM 0 HD2 PHE D 48 17.583 -10.896 3.257 1.00 0.00 H new ATOM 0 HE1 PHE D 48 21.366 -13.795 1.886 1.00 0.00 H new ATOM 0 HE2 PHE D 48 18.710 -12.341 4.928 1.00 0.00 H new ATOM 0 HZ PHE D 48 20.599 -13.792 4.242 1.00 0.00 H new ATOM 2005 N LYS D 49 19.068 -8.432 -1.723 1.00 0.00 N ATOM 2006 CA LYS D 49 18.635 -7.673 -2.891 1.00 0.00 C ATOM 2007 C LYS D 49 17.618 -8.471 -3.702 1.00 0.00 C ATOM 2008 O LYS D 49 17.205 -7.984 -4.742 1.00 0.00 O ATOM 2009 CB LYS D 49 19.841 -7.338 -3.769 1.00 0.00 C ATOM 2010 CG LYS D 49 20.763 -6.372 -3.024 1.00 0.00 C ATOM 2011 CD LYS D 49 21.976 -6.045 -3.897 1.00 0.00 C ATOM 2012 CE LYS D 49 22.899 -5.081 -3.150 1.00 0.00 C ATOM 2013 NZ LYS D 49 24.085 -4.770 -3.997 1.00 0.00 N ATOM 2014 OXT LYS D 49 17.266 -9.556 -3.269 1.00 0.00 O ATOM 0 H LYS D 49 19.966 -8.903 -1.831 1.00 0.00 H new ATOM 0 HA LYS D 49 18.166 -6.750 -2.550 1.00 0.00 H new ATOM 0 HB2 LYS D 49 20.382 -8.249 -4.025 1.00 0.00 H new ATOM 0 HB3 LYS D 49 19.509 -6.891 -4.706 1.00 0.00 H new ATOM 0 HG2 LYS D 49 20.224 -5.458 -2.775 1.00 0.00 H new ATOM 0 HG3 LYS D 49 21.088 -6.816 -2.083 1.00 0.00 H new ATOM 0 HD2 LYS D 49 22.514 -6.959 -4.147 1.00 0.00 H new ATOM 0 HD3 LYS D 49 21.651 -5.599 -4.837 1.00 0.00 H new ATOM 0 HE2 LYS D 49 22.363 -4.164 -2.906 1.00 0.00 H new ATOM 0 HE3 LYS D 49 23.219 -5.524 -2.207 1.00 0.00 H new ATOM 0 HZ1 LYS D 49 24.712 -4.114 -3.489 1.00 0.00 H new ATOM 0 HZ2 LYS D 49 24.600 -5.648 -4.209 1.00 0.00 H new ATOM 0 HZ3 LYS D 49 23.771 -4.330 -4.886 1.00 0.00 H new TER 2028 LYS D 49 HETATM 2029 S 3LW C 100 -3.194 5.233 -0.760 1.00 0.00 S HETATM 2030 BR 3LW C 100 -0.662 4.085 -1.802 1.00 0.00 BR HETATM 2031 C1 3LW C 100 -2.201 4.157 -0.690 1.00 0.00 C HETATM 2032 C2 3LW C 100 -2.504 3.243 0.237 1.00 0.00 C HETATM 2033 N2 3LW C 100 -5.001 6.701 1.394 1.00 0.00 N HETATM 2034 C3 3LW C 100 -3.648 3.603 0.827 1.00 0.00 C HETATM 2035 C5 3LW C 100 -5.360 5.455 0.706 1.00 0.00 C HETATM 2036 C10 3LW C 100 -6.039 7.743 1.582 1.00 0.00 C HETATM 2037 C12 3LW C 100 -4.103 4.749 0.297 1.00 0.00 C HETATM 2038 C61 3LW C 100 -5.445 8.986 2.301 1.00 0.00 C HETATM 2039 C62 3LW C 100 -7.225 7.237 2.457 1.00 0.00 C HETATM 2040 C63 3LW C 100 -6.636 8.243 0.231 1.00 0.00 C HETATM 2041 C71 3LW C 100 -6.510 10.085 2.514 1.00 0.00 C HETATM 2042 C72 3LW C 100 -8.283 8.342 2.666 1.00 0.00 C HETATM 2043 C73 3LW C 100 -7.697 9.341 0.455 1.00 0.00 C HETATM 2044 C81 3LW C 100 -7.651 9.543 3.379 1.00 0.00 C HETATM 2045 C82 3LW C 100 -8.845 8.791 1.311 1.00 0.00 C HETATM 2046 C83 3LW C 100 -7.071 10.544 1.163 1.00 0.00 C