USER MOD reduce.3.24.130724 H: found=0, std=0, add=1036, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 1065 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 180:sc= 0 USER MOD Single : A 20 ASN : amide:sc= -0.0524 K(o=-0.052,f=-1.9!) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot -24:sc= 1.5! USER MOD Single : A 31 ASN : amide:sc= -0.166 X(o=-0.17,f=-0.42) USER MOD Single : A 37 HIS : no HD1:sc= -9.46! C(o=-9.5!,f=-11!) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 19 SER OG : rot 180:sc= 0 USER MOD Single : B 20 ASN : amide:sc= -0.0559 K(o=-0.056,f=-2.1!) USER MOD Single : B 22 SER OG : rot 180:sc= 0 USER MOD Single : B 23 SER OG : rot -27:sc= 1.45! USER MOD Single : B 31 ASN : amide:sc= -0.588 X(o=-0.59,f=-0.43) USER MOD Single : B 37 HIS : no HD1:sc= -9.47! C(o=-9.5!,f=-11!) USER MOD Single : B 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 19 SER OG : rot 180:sc= 0 USER MOD Single : C 20 ASN : amide:sc= -0.0821 K(o=-0.082,f=-2!) USER MOD Single : C 22 SER OG : rot 180:sc= 0 USER MOD Single : C 23 SER OG : rot -29:sc= 1.52 USER MOD Single : C 31 ASN : amide:sc= -0.0711 X(o=-0.071,f=-0.43) USER MOD Single : C 37 HIS : no HD1:sc= -10.1! C(o=-10!,f=-12!) USER MOD Single : C 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 19 SER OG : rot 180:sc= 0 USER MOD Single : D 20 ASN : amide:sc= -0.0425 K(o=-0.042,f=-2!) USER MOD Single : D 22 SER OG : rot 180:sc= 0 USER MOD Single : D 23 SER OG : rot -27:sc= 1.34! USER MOD Single : D 31 ASN :FLIP amide:sc= -0.401 F(o=-1.6!,f=-0.4) USER MOD Single : D 37 HIS : no HD1:sc= -9.48! C(o=-9.5!,f=-11!) USER MOD Single : D 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 19 0.327 24.094 2.067 1.00 0.00 N ATOM 2 CA SER A 19 -0.863 23.195 2.068 1.00 0.00 C ATOM 3 C SER A 19 -2.121 24.023 2.313 1.00 0.00 C ATOM 4 O SER A 19 -2.201 24.777 3.282 1.00 0.00 O ATOM 5 CB SER A 19 -0.704 22.146 3.167 1.00 0.00 C ATOM 6 OG SER A 19 -1.976 21.584 3.466 1.00 0.00 O ATOM 0 HA SER A 19 -0.948 22.692 1.105 1.00 0.00 H new ATOM 0 HB2 SER A 19 -0.015 21.365 2.844 1.00 0.00 H new ATOM 0 HB3 SER A 19 -0.275 22.600 4.060 1.00 0.00 H new ATOM 0 HG SER A 19 -1.878 20.909 4.170 1.00 0.00 H new ATOM 14 N ASN A 20 -3.104 23.871 1.430 1.00 0.00 N ATOM 15 CA ASN A 20 -4.357 24.607 1.560 1.00 0.00 C ATOM 16 C ASN A 20 -5.256 23.954 2.605 1.00 0.00 C ATOM 17 O ASN A 20 -5.033 22.810 3.004 1.00 0.00 O ATOM 18 CB ASN A 20 -5.085 24.649 0.213 1.00 0.00 C ATOM 19 CG ASN A 20 -4.364 25.597 -0.739 1.00 0.00 C ATOM 20 OD1 ASN A 20 -3.559 26.421 -0.304 1.00 0.00 O ATOM 21 ND2 ASN A 20 -4.608 25.533 -2.019 1.00 0.00 N ATOM 0 H ASN A 20 -3.058 23.250 0.623 1.00 0.00 H new ATOM 0 HA ASN A 20 -4.126 25.624 1.878 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -5.127 23.649 -0.219 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -6.114 24.978 0.356 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -4.132 26.166 -2.661 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -5.275 24.850 -2.377 1.00 0.00 H new ATOM 28 N ASP A 21 -6.270 24.689 3.046 1.00 0.00 N ATOM 29 CA ASP A 21 -7.196 24.174 4.049 1.00 0.00 C ATOM 30 C ASP A 21 -7.925 22.942 3.520 1.00 0.00 C ATOM 31 O ASP A 21 -8.121 21.967 4.244 1.00 0.00 O ATOM 32 CB ASP A 21 -8.218 25.251 4.417 1.00 0.00 C ATOM 33 CG ASP A 21 -9.176 24.720 5.479 1.00 0.00 C ATOM 34 OD1 ASP A 21 -9.081 23.546 5.799 1.00 0.00 O ATOM 35 OD2 ASP A 21 -9.986 25.496 5.957 1.00 0.00 O ATOM 0 H ASP A 21 -6.472 25.637 2.728 1.00 0.00 H new ATOM 0 HA ASP A 21 -6.625 23.895 4.935 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -7.706 26.138 4.789 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -8.776 25.553 3.530 1.00 0.00 H new ATOM 40 N SER A 22 -8.319 22.993 2.253 1.00 0.00 N ATOM 41 CA SER A 22 -9.018 21.874 1.637 1.00 0.00 C ATOM 42 C SER A 22 -8.133 20.631 1.632 1.00 0.00 C ATOM 43 O SER A 22 -8.600 19.524 1.897 1.00 0.00 O ATOM 44 CB SER A 22 -9.416 22.228 0.203 1.00 0.00 C ATOM 45 OG SER A 22 -10.134 21.143 -0.368 1.00 0.00 O ATOM 0 H SER A 22 -8.167 23.792 1.637 1.00 0.00 H new ATOM 0 HA SER A 22 -9.916 21.666 2.218 1.00 0.00 H new ATOM 0 HB2 SER A 22 -10.030 23.129 0.196 1.00 0.00 H new ATOM 0 HB3 SER A 22 -8.527 22.443 -0.390 1.00 0.00 H new ATOM 0 HG SER A 22 -10.391 21.368 -1.286 1.00 0.00 H new ATOM 51 N SER A 23 -6.856 20.824 1.316 1.00 0.00 N ATOM 52 CA SER A 23 -5.913 19.713 1.268 1.00 0.00 C ATOM 53 C SER A 23 -6.308 18.742 0.163 1.00 0.00 C ATOM 54 O SER A 23 -7.464 18.331 0.076 1.00 0.00 O ATOM 55 CB SER A 23 -5.897 18.982 2.617 1.00 0.00 C ATOM 56 OG SER A 23 -6.856 17.935 2.598 1.00 0.00 O ATOM 0 H SER A 23 -6.453 21.733 1.091 1.00 0.00 H new ATOM 0 HA SER A 23 -4.917 20.104 1.061 1.00 0.00 H new ATOM 0 HB2 SER A 23 -4.904 18.577 2.812 1.00 0.00 H new ATOM 0 HB3 SER A 23 -6.120 19.680 3.424 1.00 0.00 H new ATOM 0 HG SER A 23 -7.548 18.138 1.935 1.00 0.00 H new ATOM 62 N ASP A 24 -5.346 18.384 -0.682 1.00 0.00 N ATOM 63 CA ASP A 24 -5.605 17.467 -1.788 1.00 0.00 C ATOM 64 C ASP A 24 -6.463 16.281 -1.311 1.00 0.00 C ATOM 65 O ASP A 24 -5.957 15.402 -0.612 1.00 0.00 O ATOM 66 CB ASP A 24 -4.276 16.948 -2.343 1.00 0.00 C ATOM 67 CG ASP A 24 -3.554 18.068 -3.087 1.00 0.00 C ATOM 68 OD1 ASP A 24 -4.020 18.441 -4.151 1.00 0.00 O ATOM 69 OD2 ASP A 24 -2.548 18.536 -2.582 1.00 0.00 O ATOM 0 H ASP A 24 -4.383 18.714 -0.623 1.00 0.00 H new ATOM 0 HA ASP A 24 -6.146 18.000 -2.569 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -3.652 16.578 -1.530 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -4.455 16.109 -3.015 1.00 0.00 H new ATOM 74 N PRO A 25 -7.740 16.225 -1.654 1.00 0.00 N ATOM 75 CA PRO A 25 -8.631 15.102 -1.218 1.00 0.00 C ATOM 76 C PRO A 25 -8.029 13.726 -1.516 1.00 0.00 C ATOM 77 O PRO A 25 -8.232 12.773 -0.763 1.00 0.00 O ATOM 78 CB PRO A 25 -9.921 15.316 -2.032 1.00 0.00 C ATOM 79 CG PRO A 25 -9.945 16.776 -2.344 1.00 0.00 C ATOM 80 CD PRO A 25 -8.481 17.210 -2.474 1.00 0.00 C ATOM 0 HA PRO A 25 -8.791 15.113 -0.140 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -9.916 14.718 -2.943 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -10.801 15.020 -1.461 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -10.491 16.968 -3.268 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -10.448 17.334 -1.555 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -8.151 17.193 -3.513 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -8.332 18.226 -2.108 1.00 0.00 H new ATOM 88 N LEU A 26 -7.305 13.632 -2.622 1.00 0.00 N ATOM 89 CA LEU A 26 -6.694 12.369 -3.017 1.00 0.00 C ATOM 90 C LEU A 26 -5.694 11.901 -1.964 1.00 0.00 C ATOM 91 O LEU A 26 -5.635 10.718 -1.633 1.00 0.00 O ATOM 92 CB LEU A 26 -5.981 12.535 -4.361 1.00 0.00 C ATOM 93 CG LEU A 26 -7.010 12.781 -5.476 1.00 0.00 C ATOM 94 CD1 LEU A 26 -6.273 13.220 -6.745 1.00 0.00 C ATOM 95 CD2 LEU A 26 -7.820 11.499 -5.766 1.00 0.00 C ATOM 0 H LEU A 26 -7.126 14.409 -3.259 1.00 0.00 H new ATOM 0 HA LEU A 26 -7.481 11.620 -3.110 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -5.281 13.369 -4.310 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -5.397 11.642 -4.585 1.00 0.00 H new ATOM 0 HG LEU A 26 -7.702 13.559 -5.154 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -6.995 13.397 -7.542 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -5.720 14.138 -6.546 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -5.579 12.438 -7.052 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -8.542 11.696 -6.558 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -7.143 10.705 -6.081 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -8.347 11.190 -4.863 1.00 0.00 H new ATOM 107 N VAL A 27 -4.910 12.837 -1.438 1.00 0.00 N ATOM 108 CA VAL A 27 -3.920 12.503 -0.419 1.00 0.00 C ATOM 109 C VAL A 27 -4.604 11.959 0.830 1.00 0.00 C ATOM 110 O VAL A 27 -4.178 10.952 1.397 1.00 0.00 O ATOM 111 CB VAL A 27 -3.100 13.747 -0.062 1.00 0.00 C ATOM 112 CG1 VAL A 27 -2.161 13.431 1.106 1.00 0.00 C ATOM 113 CG2 VAL A 27 -2.275 14.176 -1.278 1.00 0.00 C ATOM 0 H VAL A 27 -4.940 13.823 -1.697 1.00 0.00 H new ATOM 0 HA VAL A 27 -3.256 11.735 -0.816 1.00 0.00 H new ATOM 0 HB VAL A 27 -3.774 14.553 0.227 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -1.580 14.319 1.356 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -2.748 13.125 1.972 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -1.486 12.624 0.822 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -1.690 15.061 -1.027 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -1.603 13.367 -1.566 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -2.943 14.406 -2.108 1.00 0.00 H new ATOM 123 N VAL A 28 -5.672 12.630 1.253 1.00 0.00 N ATOM 124 CA VAL A 28 -6.410 12.203 2.436 1.00 0.00 C ATOM 125 C VAL A 28 -7.019 10.820 2.217 1.00 0.00 C ATOM 126 O VAL A 28 -6.935 9.951 3.084 1.00 0.00 O ATOM 127 CB VAL A 28 -7.521 13.211 2.748 1.00 0.00 C ATOM 128 CG1 VAL A 28 -8.385 12.689 3.898 1.00 0.00 C ATOM 129 CG2 VAL A 28 -6.895 14.549 3.151 1.00 0.00 C ATOM 0 H VAL A 28 -6.043 13.464 0.798 1.00 0.00 H new ATOM 0 HA VAL A 28 -5.718 12.153 3.277 1.00 0.00 H new ATOM 0 HB VAL A 28 -8.142 13.348 1.863 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -9.174 13.409 4.116 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -8.832 11.736 3.614 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -7.766 12.549 4.784 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -7.684 15.268 3.373 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -6.273 14.408 4.035 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -6.282 14.925 2.332 1.00 0.00 H new ATOM 139 N ALA A 29 -7.629 10.624 1.052 1.00 0.00 N ATOM 140 CA ALA A 29 -8.247 9.343 0.731 1.00 0.00 C ATOM 141 C ALA A 29 -7.199 8.240 0.664 1.00 0.00 C ATOM 142 O ALA A 29 -7.443 7.112 1.088 1.00 0.00 O ATOM 143 CB ALA A 29 -8.976 9.431 -0.610 1.00 0.00 C ATOM 0 H ALA A 29 -7.708 11.330 0.320 1.00 0.00 H new ATOM 0 HA ALA A 29 -8.961 9.105 1.519 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -9.434 8.469 -0.839 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -9.750 10.197 -0.554 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -8.265 9.691 -1.394 1.00 0.00 H new ATOM 149 N ALA A 30 -6.029 8.569 0.129 1.00 0.00 N ATOM 150 CA ALA A 30 -4.958 7.589 0.007 1.00 0.00 C ATOM 151 C ALA A 30 -4.606 7.005 1.371 1.00 0.00 C ATOM 152 O ALA A 30 -4.454 5.792 1.514 1.00 0.00 O ATOM 153 CB ALA A 30 -3.721 8.244 -0.604 1.00 0.00 C ATOM 0 H ALA A 30 -5.799 9.498 -0.224 1.00 0.00 H new ATOM 0 HA ALA A 30 -5.301 6.783 -0.642 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -2.924 7.505 -0.692 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -3.966 8.633 -1.592 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -3.389 9.062 0.036 1.00 0.00 H new ATOM 159 N ASN A 31 -4.478 7.870 2.370 1.00 0.00 N ATOM 160 CA ASN A 31 -4.144 7.415 3.714 1.00 0.00 C ATOM 161 C ASN A 31 -5.251 6.521 4.267 1.00 0.00 C ATOM 162 O ASN A 31 -4.982 5.485 4.876 1.00 0.00 O ATOM 163 CB ASN A 31 -3.953 8.620 4.638 1.00 0.00 C ATOM 164 CG ASN A 31 -3.660 8.148 6.058 1.00 0.00 C ATOM 165 OD1 ASN A 31 -4.509 8.276 6.942 1.00 0.00 O ATOM 166 ND2 ASN A 31 -2.506 7.605 6.330 1.00 0.00 N ATOM 0 H ASN A 31 -4.599 8.879 2.277 1.00 0.00 H new ATOM 0 HA ASN A 31 -3.218 6.842 3.665 1.00 0.00 H new ATOM 0 HB2 ASN A 31 -3.133 9.240 4.276 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -4.849 9.240 4.630 1.00 0.00 H new ATOM 0 HD21 ASN A 31 -2.304 7.285 7.277 1.00 0.00 H new ATOM 0 HD22 ASN A 31 -1.806 7.501 5.596 1.00 0.00 H new ATOM 173 N ILE A 32 -6.498 6.925 4.045 1.00 0.00 N ATOM 174 CA ILE A 32 -7.642 6.154 4.517 1.00 0.00 C ATOM 175 C ILE A 32 -7.707 4.801 3.813 1.00 0.00 C ATOM 176 O ILE A 32 -7.968 3.774 4.439 1.00 0.00 O ATOM 177 CB ILE A 32 -8.940 6.932 4.268 1.00 0.00 C ATOM 178 CG1 ILE A 32 -8.961 8.178 5.156 1.00 0.00 C ATOM 179 CG2 ILE A 32 -10.144 6.050 4.608 1.00 0.00 C ATOM 180 CD1 ILE A 32 -10.104 9.097 4.720 1.00 0.00 C ATOM 0 H ILE A 32 -6.741 7.779 3.543 1.00 0.00 H new ATOM 0 HA ILE A 32 -7.524 5.985 5.587 1.00 0.00 H new ATOM 0 HB ILE A 32 -8.990 7.225 3.219 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -9.089 7.891 6.200 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -8.009 8.705 5.084 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -11.064 6.606 4.430 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -10.131 5.159 3.980 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -10.095 5.756 5.656 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -10.119 9.984 5.353 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -9.956 9.394 3.682 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -11.052 8.568 4.815 1.00 0.00 H new ATOM 192 N ILE A 33 -7.477 4.813 2.504 1.00 0.00 N ATOM 193 CA ILE A 33 -7.526 3.589 1.716 1.00 0.00 C ATOM 194 C ILE A 33 -6.452 2.607 2.191 1.00 0.00 C ATOM 195 O ILE A 33 -6.712 1.413 2.335 1.00 0.00 O ATOM 196 CB ILE A 33 -7.307 3.921 0.231 1.00 0.00 C ATOM 197 CG1 ILE A 33 -8.506 4.737 -0.317 1.00 0.00 C ATOM 198 CG2 ILE A 33 -7.142 2.625 -0.571 1.00 0.00 C ATOM 199 CD1 ILE A 33 -9.645 3.815 -0.776 1.00 0.00 C ATOM 0 H ILE A 33 -7.256 5.653 1.969 1.00 0.00 H new ATOM 0 HA ILE A 33 -8.505 3.126 1.844 1.00 0.00 H new ATOM 0 HB ILE A 33 -6.402 4.520 0.131 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -8.872 5.413 0.456 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -8.177 5.355 -1.152 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -6.987 2.865 -1.623 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -6.282 2.071 -0.195 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -8.040 2.016 -0.466 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -10.471 4.417 -1.155 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -9.284 3.156 -1.566 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -9.990 3.216 0.067 1.00 0.00 H new ATOM 211 N GLY A 34 -5.247 3.116 2.429 1.00 0.00 N ATOM 212 CA GLY A 34 -4.149 2.268 2.885 1.00 0.00 C ATOM 213 C GLY A 34 -4.460 1.657 4.247 1.00 0.00 C ATOM 214 O GLY A 34 -4.261 0.461 4.463 1.00 0.00 O ATOM 0 H GLY A 34 -5.007 4.101 2.315 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -3.971 1.475 2.159 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -3.233 2.855 2.946 1.00 0.00 H new ATOM 218 N ILE A 35 -4.952 2.485 5.161 1.00 0.00 N ATOM 219 CA ILE A 35 -5.291 2.021 6.500 1.00 0.00 C ATOM 220 C ILE A 35 -6.429 1.002 6.438 1.00 0.00 C ATOM 221 O ILE A 35 -6.399 -0.020 7.126 1.00 0.00 O ATOM 222 CB ILE A 35 -5.699 3.208 7.380 1.00 0.00 C ATOM 223 CG1 ILE A 35 -4.478 4.106 7.614 1.00 0.00 C ATOM 224 CG2 ILE A 35 -6.213 2.696 8.728 1.00 0.00 C ATOM 225 CD1 ILE A 35 -4.927 5.425 8.247 1.00 0.00 C ATOM 0 H ILE A 35 -5.124 3.477 5.000 1.00 0.00 H new ATOM 0 HA ILE A 35 -4.414 1.541 6.934 1.00 0.00 H new ATOM 0 HB ILE A 35 -6.486 3.775 6.883 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -3.763 3.603 8.265 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -3.969 4.299 6.670 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -6.502 3.542 9.352 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -7.077 2.051 8.567 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -5.426 2.130 9.226 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -4.059 6.063 8.413 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -5.626 5.930 7.580 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -5.417 5.223 9.200 1.00 0.00 H new ATOM 237 N LEU A 36 -7.431 1.290 5.614 1.00 0.00 N ATOM 238 CA LEU A 36 -8.576 0.394 5.475 1.00 0.00 C ATOM 239 C LEU A 36 -8.121 -0.968 4.971 1.00 0.00 C ATOM 240 O LEU A 36 -8.593 -2.005 5.442 1.00 0.00 O ATOM 241 CB LEU A 36 -9.596 0.993 4.497 1.00 0.00 C ATOM 242 CG LEU A 36 -10.805 0.055 4.337 1.00 0.00 C ATOM 243 CD1 LEU A 36 -11.486 -0.177 5.698 1.00 0.00 C ATOM 244 CD2 LEU A 36 -11.801 0.692 3.364 1.00 0.00 C ATOM 0 H LEU A 36 -7.475 2.129 5.036 1.00 0.00 H new ATOM 0 HA LEU A 36 -9.044 0.272 6.452 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -9.928 1.966 4.860 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -9.126 1.158 3.528 1.00 0.00 H new ATOM 0 HG LEU A 36 -10.468 -0.906 3.950 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -12.340 -0.842 5.569 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -10.774 -0.629 6.389 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -11.827 0.776 6.101 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -12.662 0.035 3.243 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -12.130 1.653 3.758 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -11.320 0.841 2.397 1.00 0.00 H new ATOM 256 N HIS A 37 -7.204 -0.962 4.013 1.00 0.00 N ATOM 257 CA HIS A 37 -6.697 -2.208 3.456 1.00 0.00 C ATOM 258 C HIS A 37 -6.076 -3.059 4.555 1.00 0.00 C ATOM 259 O HIS A 37 -6.255 -4.276 4.587 1.00 0.00 O ATOM 260 CB HIS A 37 -5.641 -1.919 2.390 1.00 0.00 C ATOM 261 CG HIS A 37 -5.173 -3.218 1.800 1.00 0.00 C ATOM 262 ND1 HIS A 37 -5.363 -3.543 0.468 1.00 0.00 N ATOM 263 CD2 HIS A 37 -4.532 -4.294 2.356 1.00 0.00 C ATOM 264 CE1 HIS A 37 -4.846 -4.770 0.275 1.00 0.00 C ATOM 265 NE2 HIS A 37 -4.328 -5.271 1.394 1.00 0.00 N ATOM 0 H HIS A 37 -6.800 -0.117 3.609 1.00 0.00 H new ATOM 0 HA HIS A 37 -7.530 -2.747 3.005 1.00 0.00 H new ATOM 0 HB2 HIS A 37 -6.057 -1.280 1.611 1.00 0.00 H new ATOM 0 HB3 HIS A 37 -4.801 -1.380 2.829 1.00 0.00 H new ATOM 0 HD2 HIS A 37 -4.230 -4.370 3.390 1.00 0.00 H new ATOM 0 HE1 HIS A 37 -4.851 -5.286 -0.674 1.00 0.00 H new ATOM 0 HE2 HIS A 37 -3.878 -6.178 1.517 1.00 0.00 H new ATOM 273 N LEU A 38 -5.343 -2.412 5.453 1.00 0.00 N ATOM 274 CA LEU A 38 -4.692 -3.122 6.547 1.00 0.00 C ATOM 275 C LEU A 38 -5.719 -3.820 7.430 1.00 0.00 C ATOM 276 O LEU A 38 -5.480 -4.930 7.891 1.00 0.00 O ATOM 277 CB LEU A 38 -3.850 -2.136 7.385 1.00 0.00 C ATOM 278 CG LEU A 38 -2.423 -2.025 6.801 1.00 0.00 C ATOM 279 CD1 LEU A 38 -1.793 -0.694 7.208 1.00 0.00 C ATOM 280 CD2 LEU A 38 -1.545 -3.175 7.326 1.00 0.00 C ATOM 0 H LEU A 38 -5.185 -1.404 5.446 1.00 0.00 H new ATOM 0 HA LEU A 38 -4.036 -3.883 6.123 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -4.325 -1.155 7.392 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -3.802 -2.475 8.420 1.00 0.00 H new ATOM 0 HG LEU A 38 -2.489 -2.083 5.715 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -0.788 -0.625 6.792 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -2.400 0.127 6.828 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -1.741 -0.634 8.295 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -0.542 -3.087 6.908 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -1.491 -3.124 8.413 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -1.979 -4.129 7.029 1.00 0.00 H new ATOM 292 N ILE A 39 -6.847 -3.172 7.670 1.00 0.00 N ATOM 293 CA ILE A 39 -7.874 -3.770 8.512 1.00 0.00 C ATOM 294 C ILE A 39 -8.385 -5.069 7.889 1.00 0.00 C ATOM 295 O ILE A 39 -8.562 -6.074 8.575 1.00 0.00 O ATOM 296 CB ILE A 39 -9.036 -2.787 8.684 1.00 0.00 C ATOM 297 CG1 ILE A 39 -8.555 -1.582 9.500 1.00 0.00 C ATOM 298 CG2 ILE A 39 -10.191 -3.473 9.424 1.00 0.00 C ATOM 299 CD1 ILE A 39 -9.619 -0.481 9.483 1.00 0.00 C ATOM 0 H ILE A 39 -7.074 -2.248 7.302 1.00 0.00 H new ATOM 0 HA ILE A 39 -7.441 -3.996 9.487 1.00 0.00 H new ATOM 0 HB ILE A 39 -9.383 -2.458 7.704 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -8.350 -1.886 10.527 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -7.620 -1.202 9.087 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -11.015 -2.770 9.544 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -10.530 -4.335 8.850 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -9.850 -3.803 10.405 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -9.270 0.372 10.065 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -9.802 -0.168 8.455 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -10.544 -0.862 9.917 1.00 0.00 H new ATOM 311 N LEU A 40 -8.627 -5.047 6.587 1.00 0.00 N ATOM 312 CA LEU A 40 -9.113 -6.239 5.901 1.00 0.00 C ATOM 313 C LEU A 40 -8.000 -7.277 5.739 1.00 0.00 C ATOM 314 O LEU A 40 -8.219 -8.470 5.945 1.00 0.00 O ATOM 315 CB LEU A 40 -9.666 -5.848 4.534 1.00 0.00 C ATOM 316 CG LEU A 40 -10.663 -4.694 4.701 1.00 0.00 C ATOM 317 CD1 LEU A 40 -11.207 -4.298 3.328 1.00 0.00 C ATOM 318 CD2 LEU A 40 -11.823 -5.129 5.615 1.00 0.00 C ATOM 0 H LEU A 40 -8.498 -4.230 5.990 1.00 0.00 H new ATOM 0 HA LEU A 40 -9.904 -6.687 6.503 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -8.853 -5.549 3.872 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -10.157 -6.703 4.069 1.00 0.00 H new ATOM 0 HG LEU A 40 -10.158 -3.841 5.155 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -11.916 -3.478 3.440 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -10.384 -3.980 2.688 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -11.709 -5.153 2.875 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -12.526 -4.304 5.728 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -12.335 -5.983 5.172 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -11.431 -5.408 6.593 1.00 0.00 H new ATOM 330 N TRP A 41 -6.810 -6.816 5.351 1.00 0.00 N ATOM 331 CA TRP A 41 -5.673 -7.716 5.144 1.00 0.00 C ATOM 332 C TRP A 41 -5.177 -8.323 6.459 1.00 0.00 C ATOM 333 O TRP A 41 -4.890 -9.518 6.525 1.00 0.00 O ATOM 334 CB TRP A 41 -4.536 -6.959 4.451 1.00 0.00 C ATOM 335 CG TRP A 41 -3.303 -7.810 4.395 1.00 0.00 C ATOM 336 CD1 TRP A 41 -3.037 -8.740 3.448 1.00 0.00 C ATOM 337 CD2 TRP A 41 -2.151 -7.791 5.284 1.00 0.00 C ATOM 338 NE1 TRP A 41 -1.808 -9.314 3.723 1.00 0.00 N ATOM 339 CE2 TRP A 41 -1.221 -8.755 4.838 1.00 0.00 C ATOM 340 CE3 TRP A 41 -1.829 -7.039 6.428 1.00 0.00 C ATOM 341 CZ2 TRP A 41 -0.017 -8.965 5.502 1.00 0.00 C ATOM 342 CZ3 TRP A 41 -0.611 -7.245 7.091 1.00 0.00 C ATOM 343 CH2 TRP A 41 0.290 -8.206 6.629 1.00 0.00 C ATOM 0 H TRP A 41 -6.608 -5.832 5.175 1.00 0.00 H new ATOM 0 HA TRP A 41 -6.008 -8.538 4.512 1.00 0.00 H new ATOM 0 HB2 TRP A 41 -4.839 -6.678 3.442 1.00 0.00 H new ATOM 0 HB3 TRP A 41 -4.324 -6.035 4.989 1.00 0.00 H new ATOM 0 HD1 TRP A 41 -3.678 -8.992 2.616 1.00 0.00 H new ATOM 0 HE1 TRP A 41 -1.388 -10.060 3.168 1.00 0.00 H new ATOM 0 HE3 TRP A 41 -2.524 -6.299 6.798 1.00 0.00 H new ATOM 0 HZ2 TRP A 41 0.676 -9.713 5.146 1.00 0.00 H new ATOM 0 HZ3 TRP A 41 -0.368 -6.657 7.964 1.00 0.00 H new ATOM 0 HH2 TRP A 41 1.226 -8.361 7.146 1.00 0.00 H new ATOM 354 N ILE A 42 -5.065 -7.499 7.496 1.00 0.00 N ATOM 355 CA ILE A 42 -4.587 -7.983 8.789 1.00 0.00 C ATOM 356 C ILE A 42 -5.563 -9.002 9.369 1.00 0.00 C ATOM 357 O ILE A 42 -5.152 -10.014 9.942 1.00 0.00 O ATOM 358 CB ILE A 42 -4.414 -6.803 9.761 1.00 0.00 C ATOM 359 CG1 ILE A 42 -3.602 -7.249 10.989 1.00 0.00 C ATOM 360 CG2 ILE A 42 -5.788 -6.294 10.228 1.00 0.00 C ATOM 361 CD1 ILE A 42 -2.154 -7.588 10.595 1.00 0.00 C ATOM 0 H ILE A 42 -5.295 -6.506 7.470 1.00 0.00 H new ATOM 0 HA ILE A 42 -3.622 -8.469 8.646 1.00 0.00 H new ATOM 0 HB ILE A 42 -3.887 -6.002 9.242 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -3.604 -6.457 11.738 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -4.073 -8.120 11.445 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -5.652 -5.459 10.915 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -6.366 -5.963 9.365 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -6.321 -7.098 10.735 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -1.600 -7.901 11.480 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -2.156 -8.396 9.864 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -1.679 -6.708 10.162 1.00 0.00 H new ATOM 373 N LEU A 43 -6.855 -8.732 9.215 1.00 0.00 N ATOM 374 CA LEU A 43 -7.877 -9.637 9.729 1.00 0.00 C ATOM 375 C LEU A 43 -7.774 -10.998 9.044 1.00 0.00 C ATOM 376 O LEU A 43 -7.891 -12.035 9.692 1.00 0.00 O ATOM 377 CB LEU A 43 -9.271 -9.037 9.493 1.00 0.00 C ATOM 378 CG LEU A 43 -9.560 -7.946 10.541 1.00 0.00 C ATOM 379 CD1 LEU A 43 -10.809 -7.156 10.123 1.00 0.00 C ATOM 380 CD2 LEU A 43 -9.794 -8.580 11.934 1.00 0.00 C ATOM 0 H LEU A 43 -7.217 -7.903 8.744 1.00 0.00 H new ATOM 0 HA LEU A 43 -7.721 -9.771 10.799 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -9.329 -8.614 8.490 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -10.027 -9.819 9.553 1.00 0.00 H new ATOM 0 HG LEU A 43 -8.701 -7.278 10.600 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -11.015 -6.383 10.863 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -10.638 -6.692 9.152 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -11.662 -7.832 10.057 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -9.997 -7.794 12.662 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -10.645 -9.259 11.886 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -8.905 -9.134 12.236 1.00 0.00 H new ATOM 392 N ASP A 44 -7.551 -10.989 7.736 1.00 0.00 N ATOM 393 CA ASP A 44 -7.431 -12.236 6.990 1.00 0.00 C ATOM 394 C ASP A 44 -6.223 -13.036 7.471 1.00 0.00 C ATOM 395 O ASP A 44 -6.296 -14.257 7.622 1.00 0.00 O ATOM 396 CB ASP A 44 -7.285 -11.943 5.497 1.00 0.00 C ATOM 397 CG ASP A 44 -7.178 -13.249 4.714 1.00 0.00 C ATOM 398 OD1 ASP A 44 -7.112 -14.291 5.344 1.00 0.00 O ATOM 399 OD2 ASP A 44 -7.159 -13.187 3.496 1.00 0.00 O ATOM 0 H ASP A 44 -7.450 -10.143 7.175 1.00 0.00 H new ATOM 0 HA ASP A 44 -8.334 -12.823 7.158 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -8.142 -11.369 5.146 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -6.399 -11.332 5.323 1.00 0.00 H new ATOM 404 N ARG A 45 -5.113 -12.342 7.704 1.00 0.00 N ATOM 405 CA ARG A 45 -3.895 -13.002 8.164 1.00 0.00 C ATOM 406 C ARG A 45 -3.995 -13.355 9.647 1.00 0.00 C ATOM 407 O ARG A 45 -3.277 -14.225 10.138 1.00 0.00 O ATOM 408 CB ARG A 45 -2.690 -12.085 7.930 1.00 0.00 C ATOM 409 CG ARG A 45 -1.401 -12.821 8.309 1.00 0.00 C ATOM 410 CD ARG A 45 -0.195 -11.937 7.990 1.00 0.00 C ATOM 411 NE ARG A 45 1.041 -12.689 8.179 1.00 0.00 N ATOM 412 CZ ARG A 45 1.649 -12.748 9.360 1.00 0.00 C ATOM 413 NH1 ARG A 45 1.147 -12.123 10.387 1.00 0.00 N ATOM 414 NH2 ARG A 45 2.752 -13.433 9.489 1.00 0.00 N ATOM 0 H ARG A 45 -5.031 -11.332 7.583 1.00 0.00 H new ATOM 0 HA ARG A 45 -3.767 -13.925 7.598 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -2.651 -11.778 6.885 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -2.790 -11.177 8.525 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -1.411 -13.071 9.370 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -1.332 -13.760 7.761 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -0.258 -11.579 6.963 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -0.198 -11.058 8.635 1.00 0.00 H new ATOM 0 HE ARG A 45 1.449 -13.182 7.385 1.00 0.00 H new ATOM 0 HH11 ARG A 45 0.285 -11.587 10.286 1.00 0.00 H new ATOM 0 HH12 ARG A 45 1.616 -12.170 11.292 1.00 0.00 H new ATOM 0 HH21 ARG A 45 3.146 -13.922 8.685 1.00 0.00 H new ATOM 0 HH22 ARG A 45 3.220 -13.480 10.394 1.00 0.00 H new ATOM 428 N LEU A 46 -4.888 -12.677 10.359 1.00 0.00 N ATOM 429 CA LEU A 46 -5.059 -12.936 11.786 1.00 0.00 C ATOM 430 C LEU A 46 -5.529 -14.368 12.024 1.00 0.00 C ATOM 431 O LEU A 46 -5.012 -15.061 12.900 1.00 0.00 O ATOM 432 CB LEU A 46 -6.074 -11.945 12.377 1.00 0.00 C ATOM 433 CG LEU A 46 -6.291 -12.218 13.894 1.00 0.00 C ATOM 434 CD1 LEU A 46 -6.409 -10.891 14.655 1.00 0.00 C ATOM 435 CD2 LEU A 46 -7.586 -13.025 14.109 1.00 0.00 C ATOM 0 H LEU A 46 -5.498 -11.953 9.979 1.00 0.00 H new ATOM 0 HA LEU A 46 -4.096 -12.805 12.280 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -5.719 -10.924 12.233 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -7.023 -12.030 11.848 1.00 0.00 H new ATOM 0 HG LEU A 46 -5.438 -12.785 14.266 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -6.561 -11.092 15.716 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -5.494 -10.313 14.522 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -7.256 -10.324 14.268 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -7.727 -13.210 15.174 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -8.435 -12.460 13.723 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -7.513 -13.976 13.582 1.00 0.00 H new ATOM 447 N PHE A 47 -6.506 -14.806 11.237 1.00 0.00 N ATOM 448 CA PHE A 47 -7.032 -16.160 11.376 1.00 0.00 C ATOM 449 C PHE A 47 -5.964 -17.192 11.031 1.00 0.00 C ATOM 450 O PHE A 47 -5.804 -18.188 11.735 1.00 0.00 O ATOM 451 CB PHE A 47 -8.243 -16.350 10.463 1.00 0.00 C ATOM 452 CG PHE A 47 -9.370 -15.466 10.942 1.00 0.00 C ATOM 453 CD1 PHE A 47 -10.105 -15.825 12.079 1.00 0.00 C ATOM 454 CD2 PHE A 47 -9.678 -14.286 10.255 1.00 0.00 C ATOM 455 CE1 PHE A 47 -11.148 -15.002 12.528 1.00 0.00 C ATOM 456 CE2 PHE A 47 -10.718 -13.465 10.702 1.00 0.00 C ATOM 457 CZ PHE A 47 -11.453 -13.822 11.839 1.00 0.00 C ATOM 0 H PHE A 47 -6.946 -14.250 10.504 1.00 0.00 H new ATOM 0 HA PHE A 47 -7.335 -16.303 12.413 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -7.981 -16.100 9.435 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -8.557 -17.394 10.468 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -9.869 -16.735 12.610 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -9.111 -14.009 9.378 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -11.715 -15.278 13.404 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -10.954 -12.555 10.170 1.00 0.00 H new ATOM 0 HZ PHE A 47 -12.255 -13.187 12.185 1.00 0.00 H new ATOM 467 N PHE A 48 -5.237 -16.946 9.939 1.00 0.00 N ATOM 468 CA PHE A 48 -4.184 -17.865 9.496 1.00 0.00 C ATOM 469 C PHE A 48 -2.829 -17.165 9.506 1.00 0.00 C ATOM 470 O PHE A 48 -2.658 -16.118 8.884 1.00 0.00 O ATOM 471 CB PHE A 48 -4.499 -18.352 8.079 1.00 0.00 C ATOM 472 CG PHE A 48 -5.982 -18.641 7.959 1.00 0.00 C ATOM 473 CD1 PHE A 48 -6.621 -19.470 8.895 1.00 0.00 C ATOM 474 CD2 PHE A 48 -6.721 -18.075 6.912 1.00 0.00 C ATOM 475 CE1 PHE A 48 -7.992 -19.729 8.779 1.00 0.00 C ATOM 476 CE2 PHE A 48 -8.093 -18.334 6.800 1.00 0.00 C ATOM 477 CZ PHE A 48 -8.727 -19.162 7.733 1.00 0.00 C ATOM 0 H PHE A 48 -5.356 -16.124 9.348 1.00 0.00 H new ATOM 0 HA PHE A 48 -4.145 -18.714 10.178 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -4.205 -17.597 7.350 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -3.924 -19.251 7.856 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -6.055 -19.908 9.704 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -6.232 -17.438 6.190 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -8.483 -20.368 9.498 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -8.661 -17.895 5.994 1.00 0.00 H new ATOM 0 HZ PHE A 48 -9.784 -19.363 7.645 1.00 0.00 H new ATOM 487 N LYS A 49 -1.867 -17.752 10.211 1.00 0.00 N ATOM 488 CA LYS A 49 -0.526 -17.176 10.292 1.00 0.00 C ATOM 489 C LYS A 49 0.336 -17.657 9.129 1.00 0.00 C ATOM 490 O LYS A 49 0.576 -16.867 8.230 1.00 0.00 O ATOM 491 CB LYS A 49 0.130 -17.574 11.614 1.00 0.00 C ATOM 492 CG LYS A 49 -0.625 -16.923 12.774 1.00 0.00 C ATOM 493 CD LYS A 49 0.036 -17.312 14.097 1.00 0.00 C ATOM 494 CE LYS A 49 -0.722 -16.665 15.259 1.00 0.00 C ATOM 495 NZ LYS A 49 -0.066 -17.034 16.545 1.00 0.00 N ATOM 496 OXT LYS A 49 0.740 -18.807 9.153 1.00 0.00 O ATOM 0 H LYS A 49 -1.988 -18.621 10.732 1.00 0.00 H new ATOM 0 HA LYS A 49 -0.612 -16.091 10.239 1.00 0.00 H new ATOM 0 HB2 LYS A 49 0.122 -18.658 11.724 1.00 0.00 H new ATOM 0 HB3 LYS A 49 1.174 -17.260 11.623 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -0.624 -15.839 12.660 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -1.667 -17.243 12.768 1.00 0.00 H new ATOM 0 HD2 LYS A 49 0.038 -18.396 14.209 1.00 0.00 H new ATOM 0 HD3 LYS A 49 1.077 -16.989 14.104 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -0.733 -15.581 15.142 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -1.760 -16.996 15.260 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -0.580 -16.595 17.335 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -0.077 -18.068 16.656 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 0.918 -16.697 16.542 1.00 0.00 H new TER 510 LYS A 49 ATOM 511 N SER B 19 -0.055 23.952 -3.177 1.00 0.00 N ATOM 512 CA SER B 19 -0.157 22.892 -4.220 1.00 0.00 C ATOM 513 C SER B 19 -0.359 23.543 -5.585 1.00 0.00 C ATOM 514 O SER B 19 -1.264 24.359 -5.767 1.00 0.00 O ATOM 515 CB SER B 19 -1.339 21.977 -3.898 1.00 0.00 C ATOM 516 OG SER B 19 -1.712 21.263 -5.070 1.00 0.00 O ATOM 0 HA SER B 19 0.759 22.302 -4.237 1.00 0.00 H new ATOM 0 HB2 SER B 19 -1.069 21.281 -3.104 1.00 0.00 H new ATOM 0 HB3 SER B 19 -2.181 22.566 -3.533 1.00 0.00 H new ATOM 0 HG SER B 19 -2.469 20.674 -4.867 1.00 0.00 H new ATOM 524 N ASN B 20 0.488 23.175 -6.541 1.00 0.00 N ATOM 525 CA ASN B 20 0.394 23.726 -7.889 1.00 0.00 C ATOM 526 C ASN B 20 -0.720 23.040 -8.672 1.00 0.00 C ATOM 527 O ASN B 20 -1.208 21.981 -8.279 1.00 0.00 O ATOM 528 CB ASN B 20 1.724 23.547 -8.623 1.00 0.00 C ATOM 529 CG ASN B 20 2.765 24.508 -8.058 1.00 0.00 C ATOM 530 OD1 ASN B 20 2.415 25.476 -7.383 1.00 0.00 O ATOM 531 ND2 ASN B 20 4.031 24.299 -8.299 1.00 0.00 N ATOM 0 H ASN B 20 1.243 22.502 -6.409 1.00 0.00 H new ATOM 0 HA ASN B 20 0.165 24.789 -7.811 1.00 0.00 H new ATOM 0 HB2 ASN B 20 2.071 22.519 -8.518 1.00 0.00 H new ATOM 0 HB3 ASN B 20 1.588 23.730 -9.689 1.00 0.00 H new ATOM 0 HD21 ASN B 20 4.733 24.939 -7.928 1.00 0.00 H new ATOM 0 HD22 ASN B 20 4.318 23.496 -8.859 1.00 0.00 H new ATOM 538 N ASP B 21 -1.119 23.653 -9.782 1.00 0.00 N ATOM 539 CA ASP B 21 -2.179 23.094 -10.614 1.00 0.00 C ATOM 540 C ASP B 21 -1.768 21.728 -11.154 1.00 0.00 C ATOM 541 O ASP B 21 -2.576 20.799 -11.199 1.00 0.00 O ATOM 542 CB ASP B 21 -2.477 24.036 -11.782 1.00 0.00 C ATOM 543 CG ASP B 21 -3.597 23.463 -12.642 1.00 0.00 C ATOM 544 OD1 ASP B 21 -4.012 22.347 -12.374 1.00 0.00 O ATOM 545 OD2 ASP B 21 -4.025 24.149 -13.555 1.00 0.00 O ATOM 0 H ASP B 21 -0.728 24.531 -10.124 1.00 0.00 H new ATOM 0 HA ASP B 21 -3.074 22.979 -10.003 1.00 0.00 H new ATOM 0 HB2 ASP B 21 -2.763 25.017 -11.404 1.00 0.00 H new ATOM 0 HB3 ASP B 21 -1.580 24.176 -12.385 1.00 0.00 H new ATOM 550 N SER B 22 -0.509 21.613 -11.558 1.00 0.00 N ATOM 551 CA SER B 22 -0.002 20.354 -12.090 1.00 0.00 C ATOM 552 C SER B 22 -0.080 19.260 -11.030 1.00 0.00 C ATOM 553 O SER B 22 -0.449 18.123 -11.325 1.00 0.00 O ATOM 554 CB SER B 22 1.450 20.525 -12.544 1.00 0.00 C ATOM 555 OG SER B 22 1.916 19.301 -13.097 1.00 0.00 O ATOM 0 H SER B 22 0.175 22.369 -11.528 1.00 0.00 H new ATOM 0 HA SER B 22 -0.616 20.066 -12.943 1.00 0.00 H new ATOM 0 HB2 SER B 22 1.520 21.322 -13.284 1.00 0.00 H new ATOM 0 HB3 SER B 22 2.075 20.818 -11.700 1.00 0.00 H new ATOM 0 HG SER B 22 2.845 19.407 -13.390 1.00 0.00 H new ATOM 561 N SER B 23 0.273 19.611 -9.797 1.00 0.00 N ATOM 562 CA SER B 23 0.247 18.650 -8.701 1.00 0.00 C ATOM 563 C SER B 23 1.259 17.541 -8.957 1.00 0.00 C ATOM 564 O SER B 23 1.288 16.957 -10.039 1.00 0.00 O ATOM 565 CB SER B 23 -1.158 18.049 -8.566 1.00 0.00 C ATOM 566 OG SER B 23 -1.245 16.873 -9.362 1.00 0.00 O ATOM 0 H SER B 23 0.578 20.548 -9.533 1.00 0.00 H new ATOM 0 HA SER B 23 0.507 19.163 -7.775 1.00 0.00 H new ATOM 0 HB2 SER B 23 -1.366 17.812 -7.523 1.00 0.00 H new ATOM 0 HB3 SER B 23 -1.908 18.773 -8.884 1.00 0.00 H new ATOM 0 HG SER B 23 -0.614 16.936 -10.109 1.00 0.00 H new ATOM 572 N ASP B 24 2.091 17.257 -7.959 1.00 0.00 N ATOM 573 CA ASP B 24 3.111 16.220 -8.088 1.00 0.00 C ATOM 574 C ASP B 24 2.518 14.965 -8.754 1.00 0.00 C ATOM 575 O ASP B 24 1.760 14.235 -8.119 1.00 0.00 O ATOM 576 CB ASP B 24 3.648 15.858 -6.699 1.00 0.00 C ATOM 577 CG ASP B 24 4.497 17.004 -6.157 1.00 0.00 C ATOM 578 OD1 ASP B 24 5.579 17.212 -6.682 1.00 0.00 O ATOM 579 OD2 ASP B 24 4.052 17.658 -5.228 1.00 0.00 O ATOM 0 H ASP B 24 2.080 17.729 -7.055 1.00 0.00 H new ATOM 0 HA ASP B 24 3.923 16.598 -8.710 1.00 0.00 H new ATOM 0 HB2 ASP B 24 2.819 15.655 -6.021 1.00 0.00 H new ATOM 0 HB3 ASP B 24 4.244 14.947 -6.756 1.00 0.00 H new ATOM 584 N PRO B 25 2.830 14.693 -10.011 1.00 0.00 N ATOM 585 CA PRO B 25 2.285 13.492 -10.724 1.00 0.00 C ATOM 586 C PRO B 25 2.478 12.200 -9.926 1.00 0.00 C ATOM 587 O PRO B 25 1.645 11.295 -9.979 1.00 0.00 O ATOM 588 CB PRO B 25 3.087 13.444 -12.036 1.00 0.00 C ATOM 589 CG PRO B 25 3.521 14.852 -12.280 1.00 0.00 C ATOM 590 CD PRO B 25 3.715 15.484 -10.896 1.00 0.00 C ATOM 0 HA PRO B 25 1.209 13.571 -10.877 1.00 0.00 H new ATOM 0 HB2 PRO B 25 3.945 12.777 -11.949 1.00 0.00 H new ATOM 0 HB3 PRO B 25 2.476 13.072 -12.858 1.00 0.00 H new ATOM 0 HG2 PRO B 25 4.447 14.880 -12.854 1.00 0.00 H new ATOM 0 HG3 PRO B 25 2.772 15.396 -12.855 1.00 0.00 H new ATOM 0 HD2 PRO B 25 4.755 15.427 -10.574 1.00 0.00 H new ATOM 0 HD3 PRO B 25 3.439 16.538 -10.897 1.00 0.00 H new ATOM 598 N LEU B 26 3.587 12.117 -9.204 1.00 0.00 N ATOM 599 CA LEU B 26 3.887 10.929 -8.415 1.00 0.00 C ATOM 600 C LEU B 26 2.818 10.708 -7.350 1.00 0.00 C ATOM 601 O LEU B 26 2.390 9.577 -7.114 1.00 0.00 O ATOM 602 CB LEU B 26 5.255 11.085 -7.746 1.00 0.00 C ATOM 603 CG LEU B 26 6.364 11.079 -8.808 1.00 0.00 C ATOM 604 CD1 LEU B 26 7.680 11.513 -8.153 1.00 0.00 C ATOM 605 CD2 LEU B 26 6.531 9.671 -9.417 1.00 0.00 C ATOM 0 H LEU B 26 4.291 12.853 -9.148 1.00 0.00 H new ATOM 0 HA LEU B 26 3.902 10.065 -9.080 1.00 0.00 H new ATOM 0 HB2 LEU B 26 5.288 12.016 -7.180 1.00 0.00 H new ATOM 0 HB3 LEU B 26 5.416 10.274 -7.036 1.00 0.00 H new ATOM 0 HG LEU B 26 6.094 11.769 -9.607 1.00 0.00 H new ATOM 0 HD11 LEU B 26 8.475 11.512 -8.899 1.00 0.00 H new ATOM 0 HD12 LEU B 26 7.568 12.517 -7.742 1.00 0.00 H new ATOM 0 HD13 LEU B 26 7.934 10.819 -7.352 1.00 0.00 H new ATOM 0 HD21 LEU B 26 7.322 9.690 -10.167 1.00 0.00 H new ATOM 0 HD22 LEU B 26 6.794 8.963 -8.631 1.00 0.00 H new ATOM 0 HD23 LEU B 26 5.596 9.363 -9.884 1.00 0.00 H new ATOM 617 N VAL B 27 2.387 11.790 -6.709 1.00 0.00 N ATOM 618 CA VAL B 27 1.366 11.694 -5.673 1.00 0.00 C ATOM 619 C VAL B 27 0.061 11.162 -6.260 1.00 0.00 C ATOM 620 O VAL B 27 -0.579 10.282 -5.685 1.00 0.00 O ATOM 621 CB VAL B 27 1.129 13.072 -5.044 1.00 0.00 C ATOM 622 CG1 VAL B 27 -0.043 12.996 -4.060 1.00 0.00 C ATOM 623 CG2 VAL B 27 2.392 13.512 -4.301 1.00 0.00 C ATOM 0 H VAL B 27 2.726 12.736 -6.887 1.00 0.00 H new ATOM 0 HA VAL B 27 1.713 11.003 -4.905 1.00 0.00 H new ATOM 0 HB VAL B 27 0.894 13.793 -5.827 1.00 0.00 H new ATOM 0 HG11 VAL B 27 -0.209 13.977 -3.615 1.00 0.00 H new ATOM 0 HG12 VAL B 27 -0.942 12.681 -4.589 1.00 0.00 H new ATOM 0 HG13 VAL B 27 0.187 12.276 -3.275 1.00 0.00 H new ATOM 0 HG21 VAL B 27 2.227 14.492 -3.852 1.00 0.00 H new ATOM 0 HG22 VAL B 27 2.625 12.789 -3.519 1.00 0.00 H new ATOM 0 HG23 VAL B 27 3.225 13.569 -5.002 1.00 0.00 H new ATOM 633 N VAL B 28 -0.325 11.702 -7.413 1.00 0.00 N ATOM 634 CA VAL B 28 -1.554 11.273 -8.072 1.00 0.00 C ATOM 635 C VAL B 28 -1.459 9.801 -8.469 1.00 0.00 C ATOM 636 O VAL B 28 -2.395 9.031 -8.253 1.00 0.00 O ATOM 637 CB VAL B 28 -1.804 12.129 -9.316 1.00 0.00 C ATOM 638 CG1 VAL B 28 -3.011 11.584 -10.085 1.00 0.00 C ATOM 639 CG2 VAL B 28 -2.081 13.574 -8.893 1.00 0.00 C ATOM 0 H VAL B 28 0.191 12.431 -7.906 1.00 0.00 H new ATOM 0 HA VAL B 28 -2.384 11.397 -7.377 1.00 0.00 H new ATOM 0 HB VAL B 28 -0.923 12.098 -9.957 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -3.185 12.196 -10.970 1.00 0.00 H new ATOM 0 HG12 VAL B 28 -2.815 10.556 -10.388 1.00 0.00 H new ATOM 0 HG13 VAL B 28 -3.893 11.612 -9.445 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -2.259 14.184 -9.778 1.00 0.00 H new ATOM 0 HG22 VAL B 28 -2.960 13.603 -8.250 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -1.221 13.965 -8.350 1.00 0.00 H new ATOM 649 N ALA B 29 -0.327 9.418 -9.049 1.00 0.00 N ATOM 650 CA ALA B 29 -0.126 8.037 -9.473 1.00 0.00 C ATOM 651 C ALA B 29 -0.135 7.100 -8.272 1.00 0.00 C ATOM 652 O ALA B 29 -0.658 5.990 -8.343 1.00 0.00 O ATOM 653 CB ALA B 29 1.208 7.898 -10.212 1.00 0.00 C ATOM 0 H ALA B 29 0.460 10.039 -9.235 1.00 0.00 H new ATOM 0 HA ALA B 29 -0.942 7.767 -10.143 1.00 0.00 H new ATOM 0 HB1 ALA B 29 1.346 6.862 -10.523 1.00 0.00 H new ATOM 0 HB2 ALA B 29 1.206 8.543 -11.090 1.00 0.00 H new ATOM 0 HB3 ALA B 29 2.023 8.189 -9.549 1.00 0.00 H new ATOM 659 N ALA B 30 0.450 7.550 -7.170 1.00 0.00 N ATOM 660 CA ALA B 30 0.508 6.733 -5.965 1.00 0.00 C ATOM 661 C ALA B 30 -0.892 6.325 -5.520 1.00 0.00 C ATOM 662 O ALA B 30 -1.133 5.165 -5.190 1.00 0.00 O ATOM 663 CB ALA B 30 1.194 7.510 -4.843 1.00 0.00 C ATOM 0 H ALA B 30 0.887 8.468 -7.085 1.00 0.00 H new ATOM 0 HA ALA B 30 1.080 5.832 -6.189 1.00 0.00 H new ATOM 0 HB1 ALA B 30 1.234 6.893 -3.945 1.00 0.00 H new ATOM 0 HB2 ALA B 30 2.207 7.772 -5.149 1.00 0.00 H new ATOM 0 HB3 ALA B 30 0.631 8.420 -4.634 1.00 0.00 H new ATOM 669 N ASN B 31 -1.814 7.283 -5.516 1.00 0.00 N ATOM 670 CA ASN B 31 -3.185 7.000 -5.109 1.00 0.00 C ATOM 671 C ASN B 31 -3.831 6.004 -6.068 1.00 0.00 C ATOM 672 O ASN B 31 -4.519 5.075 -5.642 1.00 0.00 O ATOM 673 CB ASN B 31 -4.000 8.295 -5.092 1.00 0.00 C ATOM 674 CG ASN B 31 -5.449 7.994 -4.723 1.00 0.00 C ATOM 675 OD1 ASN B 31 -6.335 8.065 -5.574 1.00 0.00 O ATOM 676 ND2 ASN B 31 -5.742 7.657 -3.496 1.00 0.00 N ATOM 0 H ASN B 31 -1.640 8.251 -5.787 1.00 0.00 H new ATOM 0 HA ASN B 31 -3.168 6.567 -4.109 1.00 0.00 H new ATOM 0 HB2 ASN B 31 -3.571 8.995 -4.375 1.00 0.00 H new ATOM 0 HB3 ASN B 31 -3.957 8.774 -6.070 1.00 0.00 H new ATOM 0 HD21 ASN B 31 -6.708 7.452 -3.240 1.00 0.00 H new ATOM 0 HD22 ASN B 31 -5.005 7.599 -2.793 1.00 0.00 H new ATOM 683 N ILE B 32 -3.600 6.200 -7.361 1.00 0.00 N ATOM 684 CA ILE B 32 -4.160 5.312 -8.375 1.00 0.00 C ATOM 685 C ILE B 32 -3.572 3.909 -8.244 1.00 0.00 C ATOM 686 O ILE B 32 -4.286 2.913 -8.346 1.00 0.00 O ATOM 687 CB ILE B 32 -3.871 5.867 -9.777 1.00 0.00 C ATOM 688 CG1 ILE B 32 -4.652 7.169 -9.975 1.00 0.00 C ATOM 689 CG2 ILE B 32 -4.308 4.848 -10.833 1.00 0.00 C ATOM 690 CD1 ILE B 32 -4.166 7.867 -11.245 1.00 0.00 C ATOM 0 H ILE B 32 -3.032 6.962 -7.732 1.00 0.00 H new ATOM 0 HA ILE B 32 -5.238 5.255 -8.226 1.00 0.00 H new ATOM 0 HB ILE B 32 -2.803 6.059 -9.879 1.00 0.00 H new ATOM 0 HG12 ILE B 32 -5.719 6.958 -10.049 1.00 0.00 H new ATOM 0 HG13 ILE B 32 -4.515 7.822 -9.113 1.00 0.00 H new ATOM 0 HG21 ILE B 32 -4.102 5.244 -11.828 1.00 0.00 H new ATOM 0 HG22 ILE B 32 -3.757 3.918 -10.691 1.00 0.00 H new ATOM 0 HG23 ILE B 32 -5.376 4.656 -10.733 1.00 0.00 H new ATOM 0 HD11 ILE B 32 -4.722 8.794 -11.386 1.00 0.00 H new ATOM 0 HD12 ILE B 32 -3.103 8.092 -11.153 1.00 0.00 H new ATOM 0 HD13 ILE B 32 -4.326 7.214 -12.103 1.00 0.00 H new ATOM 702 N ILE B 33 -2.262 3.843 -8.029 1.00 0.00 N ATOM 703 CA ILE B 33 -1.580 2.561 -7.900 1.00 0.00 C ATOM 704 C ILE B 33 -2.111 1.793 -6.688 1.00 0.00 C ATOM 705 O ILE B 33 -2.361 0.590 -6.766 1.00 0.00 O ATOM 706 CB ILE B 33 -0.068 2.795 -7.747 1.00 0.00 C ATOM 707 CG1 ILE B 33 0.521 3.374 -9.058 1.00 0.00 C ATOM 708 CG2 ILE B 33 0.626 1.473 -7.396 1.00 0.00 C ATOM 709 CD1 ILE B 33 0.879 2.260 -10.055 1.00 0.00 C ATOM 0 H ILE B 33 -1.655 4.658 -7.941 1.00 0.00 H new ATOM 0 HA ILE B 33 -1.768 1.970 -8.796 1.00 0.00 H new ATOM 0 HB ILE B 33 0.101 3.512 -6.944 1.00 0.00 H new ATOM 0 HG12 ILE B 33 -0.200 4.053 -9.513 1.00 0.00 H new ATOM 0 HG13 ILE B 33 1.411 3.960 -8.830 1.00 0.00 H new ATOM 0 HG21 ILE B 33 1.697 1.642 -7.288 1.00 0.00 H new ATOM 0 HG22 ILE B 33 0.223 1.088 -6.459 1.00 0.00 H new ATOM 0 HG23 ILE B 33 0.451 0.748 -8.191 1.00 0.00 H new ATOM 0 HD11 ILE B 33 1.289 2.702 -10.963 1.00 0.00 H new ATOM 0 HD12 ILE B 33 1.619 1.596 -9.608 1.00 0.00 H new ATOM 0 HD13 ILE B 33 -0.017 1.691 -10.302 1.00 0.00 H new ATOM 721 N GLY B 34 -2.281 2.492 -5.567 1.00 0.00 N ATOM 722 CA GLY B 34 -2.783 1.854 -4.352 1.00 0.00 C ATOM 723 C GLY B 34 -4.199 1.326 -4.558 1.00 0.00 C ATOM 724 O GLY B 34 -4.513 0.197 -4.180 1.00 0.00 O ATOM 0 H GLY B 34 -2.081 3.488 -5.475 1.00 0.00 H new ATOM 0 HA2 GLY B 34 -2.123 1.034 -4.068 1.00 0.00 H new ATOM 0 HA3 GLY B 34 -2.774 2.570 -3.530 1.00 0.00 H new ATOM 728 N ILE B 35 -5.051 2.148 -5.165 1.00 0.00 N ATOM 729 CA ILE B 35 -6.430 1.754 -5.421 1.00 0.00 C ATOM 730 C ILE B 35 -6.478 0.577 -6.395 1.00 0.00 C ATOM 731 O ILE B 35 -7.248 -0.367 -6.209 1.00 0.00 O ATOM 732 CB ILE B 35 -7.217 2.938 -5.996 1.00 0.00 C ATOM 733 CG1 ILE B 35 -7.353 4.024 -4.925 1.00 0.00 C ATOM 734 CG2 ILE B 35 -8.612 2.471 -6.418 1.00 0.00 C ATOM 735 CD1 ILE B 35 -7.881 5.310 -5.563 1.00 0.00 C ATOM 0 H ILE B 35 -4.811 3.086 -5.487 1.00 0.00 H new ATOM 0 HA ILE B 35 -6.883 1.447 -4.478 1.00 0.00 H new ATOM 0 HB ILE B 35 -6.689 3.337 -6.862 1.00 0.00 H new ATOM 0 HG12 ILE B 35 -8.031 3.691 -4.139 1.00 0.00 H new ATOM 0 HG13 ILE B 35 -6.387 4.209 -4.455 1.00 0.00 H new ATOM 0 HG21 ILE B 35 -9.170 3.314 -6.826 1.00 0.00 H new ATOM 0 HG22 ILE B 35 -8.521 1.694 -7.177 1.00 0.00 H new ATOM 0 HG23 ILE B 35 -9.140 2.072 -5.552 1.00 0.00 H new ATOM 0 HD11 ILE B 35 -7.977 6.082 -4.800 1.00 0.00 H new ATOM 0 HD12 ILE B 35 -7.187 5.646 -6.333 1.00 0.00 H new ATOM 0 HD13 ILE B 35 -8.856 5.120 -6.012 1.00 0.00 H new ATOM 747 N LEU B 36 -5.651 0.642 -7.436 1.00 0.00 N ATOM 748 CA LEU B 36 -5.611 -0.419 -8.436 1.00 0.00 C ATOM 749 C LEU B 36 -5.213 -1.740 -7.791 1.00 0.00 C ATOM 750 O LEU B 36 -5.778 -2.789 -8.099 1.00 0.00 O ATOM 751 CB LEU B 36 -4.609 -0.064 -9.543 1.00 0.00 C ATOM 752 CG LEU B 36 -4.552 -1.180 -10.600 1.00 0.00 C ATOM 753 CD1 LEU B 36 -5.941 -1.393 -11.229 1.00 0.00 C ATOM 754 CD2 LEU B 36 -3.549 -0.782 -11.687 1.00 0.00 C ATOM 0 H LEU B 36 -5.005 1.412 -7.607 1.00 0.00 H new ATOM 0 HA LEU B 36 -6.605 -0.521 -8.871 1.00 0.00 H new ATOM 0 HB2 LEU B 36 -4.897 0.876 -10.014 1.00 0.00 H new ATOM 0 HB3 LEU B 36 -3.620 0.086 -9.111 1.00 0.00 H new ATOM 0 HG LEU B 36 -4.240 -2.111 -10.126 1.00 0.00 H new ATOM 0 HD11 LEU B 36 -5.885 -2.186 -11.975 1.00 0.00 H new ATOM 0 HD12 LEU B 36 -6.653 -1.675 -10.453 1.00 0.00 H new ATOM 0 HD13 LEU B 36 -6.270 -0.469 -11.705 1.00 0.00 H new ATOM 0 HD21 LEU B 36 -3.500 -1.567 -12.442 1.00 0.00 H new ATOM 0 HD22 LEU B 36 -3.868 0.151 -12.153 1.00 0.00 H new ATOM 0 HD23 LEU B 36 -2.564 -0.646 -11.241 1.00 0.00 H new ATOM 766 N HIS B 37 -4.238 -1.681 -6.892 1.00 0.00 N ATOM 767 CA HIS B 37 -3.777 -2.882 -6.211 1.00 0.00 C ATOM 768 C HIS B 37 -4.930 -3.533 -5.463 1.00 0.00 C ATOM 769 O HIS B 37 -5.068 -4.757 -5.459 1.00 0.00 O ATOM 770 CB HIS B 37 -2.666 -2.533 -5.223 1.00 0.00 C ATOM 771 CG HIS B 37 -2.181 -3.794 -4.568 1.00 0.00 C ATOM 772 ND1 HIS B 37 -0.885 -4.255 -4.715 1.00 0.00 N ATOM 773 CD2 HIS B 37 -2.813 -4.712 -3.769 1.00 0.00 C ATOM 774 CE1 HIS B 37 -0.782 -5.400 -4.017 1.00 0.00 C ATOM 775 NE2 HIS B 37 -1.930 -5.722 -3.421 1.00 0.00 N ATOM 0 H HIS B 37 -3.756 -0.824 -6.620 1.00 0.00 H new ATOM 0 HA HIS B 37 -3.391 -3.577 -6.957 1.00 0.00 H new ATOM 0 HB2 HIS B 37 -1.844 -2.037 -5.740 1.00 0.00 H new ATOM 0 HB3 HIS B 37 -3.036 -1.836 -4.471 1.00 0.00 H new ATOM 0 HD2 HIS B 37 -3.846 -4.656 -3.457 1.00 0.00 H new ATOM 0 HE1 HIS B 37 0.122 -5.988 -3.948 1.00 0.00 H new ATOM 0 HE2 HIS B 37 -2.118 -6.536 -2.835 1.00 0.00 H new ATOM 783 N LEU B 38 -5.756 -2.711 -4.828 1.00 0.00 N ATOM 784 CA LEU B 38 -6.894 -3.219 -4.070 1.00 0.00 C ATOM 785 C LEU B 38 -7.853 -3.983 -4.975 1.00 0.00 C ATOM 786 O LEU B 38 -8.401 -5.003 -4.568 1.00 0.00 O ATOM 787 CB LEU B 38 -7.629 -2.051 -3.380 1.00 0.00 C ATOM 788 CG LEU B 38 -7.018 -1.783 -1.986 1.00 0.00 C ATOM 789 CD1 LEU B 38 -7.295 -0.343 -1.558 1.00 0.00 C ATOM 790 CD2 LEU B 38 -7.631 -2.741 -0.951 1.00 0.00 C ATOM 0 H LEU B 38 -5.661 -1.695 -4.822 1.00 0.00 H new ATOM 0 HA LEU B 38 -6.523 -3.907 -3.311 1.00 0.00 H new ATOM 0 HB2 LEU B 38 -7.558 -1.154 -3.995 1.00 0.00 H new ATOM 0 HB3 LEU B 38 -8.689 -2.287 -3.281 1.00 0.00 H new ATOM 0 HG LEU B 38 -5.942 -1.944 -2.043 1.00 0.00 H new ATOM 0 HD11 LEU B 38 -6.860 -0.166 -0.574 1.00 0.00 H new ATOM 0 HD12 LEU B 38 -6.852 0.343 -2.280 1.00 0.00 H new ATOM 0 HD13 LEU B 38 -8.371 -0.177 -1.514 1.00 0.00 H new ATOM 0 HD21 LEU B 38 -7.195 -2.546 0.029 1.00 0.00 H new ATOM 0 HD22 LEU B 38 -8.709 -2.586 -0.906 1.00 0.00 H new ATOM 0 HD23 LEU B 38 -7.424 -3.771 -1.241 1.00 0.00 H new ATOM 802 N ILE B 39 -8.062 -3.492 -6.183 1.00 0.00 N ATOM 803 CA ILE B 39 -8.974 -4.160 -7.104 1.00 0.00 C ATOM 804 C ILE B 39 -8.470 -5.570 -7.419 1.00 0.00 C ATOM 805 O ILE B 39 -9.242 -6.525 -7.440 1.00 0.00 O ATOM 806 CB ILE B 39 -9.085 -3.349 -8.397 1.00 0.00 C ATOM 807 CG1 ILE B 39 -9.786 -2.021 -8.094 1.00 0.00 C ATOM 808 CG2 ILE B 39 -9.903 -4.133 -9.430 1.00 0.00 C ATOM 809 CD1 ILE B 39 -9.701 -1.094 -9.308 1.00 0.00 C ATOM 0 H ILE B 39 -7.623 -2.647 -6.549 1.00 0.00 H new ATOM 0 HA ILE B 39 -9.956 -4.234 -6.637 1.00 0.00 H new ATOM 0 HB ILE B 39 -8.089 -3.160 -8.797 1.00 0.00 H new ATOM 0 HG12 ILE B 39 -10.830 -2.202 -7.837 1.00 0.00 H new ATOM 0 HG13 ILE B 39 -9.323 -1.545 -7.230 1.00 0.00 H new ATOM 0 HG21 ILE B 39 -9.980 -3.553 -10.349 1.00 0.00 H new ATOM 0 HG22 ILE B 39 -9.410 -5.082 -9.640 1.00 0.00 H new ATOM 0 HG23 ILE B 39 -10.901 -4.322 -9.036 1.00 0.00 H new ATOM 0 HD11 ILE B 39 -10.202 -0.153 -9.083 1.00 0.00 H new ATOM 0 HD12 ILE B 39 -8.655 -0.900 -9.545 1.00 0.00 H new ATOM 0 HD13 ILE B 39 -10.185 -1.568 -10.162 1.00 0.00 H new ATOM 821 N LEU B 40 -7.178 -5.694 -7.672 1.00 0.00 N ATOM 822 CA LEU B 40 -6.603 -7.000 -7.979 1.00 0.00 C ATOM 823 C LEU B 40 -6.506 -7.872 -6.723 1.00 0.00 C ATOM 824 O LEU B 40 -6.815 -9.063 -6.761 1.00 0.00 O ATOM 825 CB LEU B 40 -5.219 -6.814 -8.594 1.00 0.00 C ATOM 826 CG LEU B 40 -5.309 -5.809 -9.748 1.00 0.00 C ATOM 827 CD1 LEU B 40 -3.919 -5.617 -10.357 1.00 0.00 C ATOM 828 CD2 LEU B 40 -6.280 -6.328 -10.825 1.00 0.00 C ATOM 0 H LEU B 40 -6.513 -4.921 -7.672 1.00 0.00 H new ATOM 0 HA LEU B 40 -7.256 -7.507 -8.689 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -4.518 -6.457 -7.839 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -4.838 -7.769 -8.957 1.00 0.00 H new ATOM 0 HG LEU B 40 -5.679 -4.856 -9.369 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -3.977 -4.903 -11.179 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -3.237 -5.239 -9.595 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -3.551 -6.572 -10.732 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -6.337 -5.607 -11.641 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -5.921 -7.283 -11.209 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -7.270 -6.462 -10.389 1.00 0.00 H new ATOM 840 N TRP B 41 -6.060 -7.276 -5.620 1.00 0.00 N ATOM 841 CA TRP B 41 -5.906 -8.011 -4.362 1.00 0.00 C ATOM 842 C TRP B 41 -7.257 -8.422 -3.773 1.00 0.00 C ATOM 843 O TRP B 41 -7.414 -9.552 -3.310 1.00 0.00 O ATOM 844 CB TRP B 41 -5.128 -7.155 -3.354 1.00 0.00 C ATOM 845 CG TRP B 41 -5.119 -7.815 -2.009 1.00 0.00 C ATOM 846 CD1 TRP B 41 -4.249 -8.772 -1.612 1.00 0.00 C ATOM 847 CD2 TRP B 41 -5.981 -7.551 -0.866 1.00 0.00 C ATOM 848 NE1 TRP B 41 -4.542 -9.131 -0.308 1.00 0.00 N ATOM 849 CE2 TRP B 41 -5.597 -8.399 0.196 1.00 0.00 C ATOM 850 CE3 TRP B 41 -7.054 -6.667 -0.653 1.00 0.00 C ATOM 851 CZ2 TRP B 41 -6.252 -8.372 1.422 1.00 0.00 C ATOM 852 CZ3 TRP B 41 -7.708 -6.633 0.587 1.00 0.00 C ATOM 853 CH2 TRP B 41 -7.307 -7.485 1.618 1.00 0.00 C ATOM 0 H TRP B 41 -5.799 -6.291 -5.569 1.00 0.00 H new ATOM 0 HA TRP B 41 -5.350 -8.925 -4.574 1.00 0.00 H new ATOM 0 HB2 TRP B 41 -4.105 -7.010 -3.702 1.00 0.00 H new ATOM 0 HB3 TRP B 41 -5.582 -6.167 -3.279 1.00 0.00 H new ATOM 0 HD1 TRP B 41 -3.455 -9.188 -2.215 1.00 0.00 H new ATOM 0 HE1 TRP B 41 -4.040 -9.848 0.216 1.00 0.00 H new ATOM 0 HE3 TRP B 41 -7.376 -6.011 -1.448 1.00 0.00 H new ATOM 0 HZ2 TRP B 41 -5.944 -9.035 2.217 1.00 0.00 H new ATOM 0 HZ3 TRP B 41 -8.525 -5.945 0.745 1.00 0.00 H new ATOM 0 HH2 TRP B 41 -7.817 -7.456 2.570 1.00 0.00 H new ATOM 864 N ILE B 42 -8.218 -7.508 -3.778 1.00 0.00 N ATOM 865 CA ILE B 42 -9.537 -7.802 -3.224 1.00 0.00 C ATOM 866 C ILE B 42 -10.218 -8.902 -4.033 1.00 0.00 C ATOM 867 O ILE B 42 -10.866 -9.788 -3.472 1.00 0.00 O ATOM 868 CB ILE B 42 -10.404 -6.530 -3.222 1.00 0.00 C ATOM 869 CG1 ILE B 42 -11.648 -6.746 -2.344 1.00 0.00 C ATOM 870 CG2 ILE B 42 -10.853 -6.195 -4.653 1.00 0.00 C ATOM 871 CD1 ILE B 42 -11.256 -6.899 -0.866 1.00 0.00 C ATOM 0 H ILE B 42 -8.113 -6.566 -4.155 1.00 0.00 H new ATOM 0 HA ILE B 42 -9.417 -8.149 -2.198 1.00 0.00 H new ATOM 0 HB ILE B 42 -9.812 -5.706 -2.824 1.00 0.00 H new ATOM 0 HG12 ILE B 42 -12.330 -5.903 -2.458 1.00 0.00 H new ATOM 0 HG13 ILE B 42 -12.183 -7.636 -2.677 1.00 0.00 H new ATOM 0 HG21 ILE B 42 -11.466 -5.294 -4.640 1.00 0.00 H new ATOM 0 HG22 ILE B 42 -9.977 -6.030 -5.280 1.00 0.00 H new ATOM 0 HG23 ILE B 42 -11.435 -7.024 -5.055 1.00 0.00 H new ATOM 0 HD11 ILE B 42 -12.153 -7.051 -0.266 1.00 0.00 H new ATOM 0 HD12 ILE B 42 -10.594 -7.757 -0.752 1.00 0.00 H new ATOM 0 HD13 ILE B 42 -10.743 -5.998 -0.531 1.00 0.00 H new ATOM 883 N LEU B 43 -10.068 -8.840 -5.353 1.00 0.00 N ATOM 884 CA LEU B 43 -10.676 -9.837 -6.225 1.00 0.00 C ATOM 885 C LEU B 43 -10.106 -11.220 -5.926 1.00 0.00 C ATOM 886 O LEU B 43 -10.841 -12.205 -5.885 1.00 0.00 O ATOM 887 CB LEU B 43 -10.417 -9.471 -7.695 1.00 0.00 C ATOM 888 CG LEU B 43 -11.377 -8.349 -8.136 1.00 0.00 C ATOM 889 CD1 LEU B 43 -10.919 -7.790 -9.491 1.00 0.00 C ATOM 890 CD2 LEU B 43 -12.823 -8.889 -8.262 1.00 0.00 C ATOM 0 H LEU B 43 -9.536 -8.117 -5.838 1.00 0.00 H new ATOM 0 HA LEU B 43 -11.751 -9.854 -6.043 1.00 0.00 H new ATOM 0 HB2 LEU B 43 -9.384 -9.147 -7.821 1.00 0.00 H new ATOM 0 HB3 LEU B 43 -10.555 -10.348 -8.327 1.00 0.00 H new ATOM 0 HG LEU B 43 -11.363 -7.559 -7.385 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -11.597 -6.996 -9.805 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -9.910 -7.389 -9.397 1.00 0.00 H new ATOM 0 HD13 LEU B 43 -10.925 -8.587 -10.234 1.00 0.00 H new ATOM 0 HD21 LEU B 43 -13.487 -8.083 -8.574 1.00 0.00 H new ATOM 0 HD22 LEU B 43 -12.850 -9.688 -9.003 1.00 0.00 H new ATOM 0 HD23 LEU B 43 -13.152 -9.277 -7.298 1.00 0.00 H new ATOM 902 N ASP B 44 -8.799 -11.292 -5.715 1.00 0.00 N ATOM 903 CA ASP B 44 -8.157 -12.567 -5.416 1.00 0.00 C ATOM 904 C ASP B 44 -8.679 -13.136 -4.101 1.00 0.00 C ATOM 905 O ASP B 44 -8.933 -14.336 -3.990 1.00 0.00 O ATOM 906 CB ASP B 44 -6.642 -12.380 -5.326 1.00 0.00 C ATOM 907 CG ASP B 44 -5.967 -13.718 -5.038 1.00 0.00 C ATOM 908 OD1 ASP B 44 -6.679 -14.683 -4.812 1.00 0.00 O ATOM 909 OD2 ASP B 44 -4.747 -13.758 -5.044 1.00 0.00 O ATOM 0 H ASP B 44 -8.167 -10.492 -5.744 1.00 0.00 H new ATOM 0 HA ASP B 44 -8.391 -13.266 -6.219 1.00 0.00 H new ATOM 0 HB2 ASP B 44 -6.262 -11.965 -6.260 1.00 0.00 H new ATOM 0 HB3 ASP B 44 -6.402 -11.665 -4.539 1.00 0.00 H new ATOM 914 N ARG B 45 -8.831 -12.270 -3.105 1.00 0.00 N ATOM 915 CA ARG B 45 -9.318 -12.700 -1.800 1.00 0.00 C ATOM 916 C ARG B 45 -10.828 -12.937 -1.835 1.00 0.00 C ATOM 917 O ARG B 45 -11.375 -13.646 -0.993 1.00 0.00 O ATOM 918 CB ARG B 45 -8.985 -11.641 -0.745 1.00 0.00 C ATOM 919 CG ARG B 45 -9.399 -12.143 0.640 1.00 0.00 C ATOM 920 CD ARG B 45 -8.982 -11.122 1.699 1.00 0.00 C ATOM 921 NE ARG B 45 -9.208 -11.666 3.036 1.00 0.00 N ATOM 922 CZ ARG B 45 -10.380 -11.534 3.653 1.00 0.00 C ATOM 923 NH1 ARG B 45 -11.360 -10.903 3.069 1.00 0.00 N ATOM 924 NH2 ARG B 45 -10.544 -12.036 4.847 1.00 0.00 N ATOM 0 H ARG B 45 -8.626 -11.273 -3.175 1.00 0.00 H new ATOM 0 HA ARG B 45 -8.826 -13.638 -1.541 1.00 0.00 H new ATOM 0 HB2 ARG B 45 -7.917 -11.423 -0.759 1.00 0.00 H new ATOM 0 HB3 ARG B 45 -9.503 -10.710 -0.975 1.00 0.00 H new ATOM 0 HG2 ARG B 45 -10.477 -12.299 0.675 1.00 0.00 H new ATOM 0 HG3 ARG B 45 -8.931 -13.106 0.844 1.00 0.00 H new ATOM 0 HD2 ARG B 45 -7.930 -10.867 1.575 1.00 0.00 H new ATOM 0 HD3 ARG B 45 -9.551 -10.201 1.572 1.00 0.00 H new ATOM 0 HE ARG B 45 -8.450 -12.159 3.508 1.00 0.00 H new ATOM 0 HH11 ARG B 45 -11.230 -10.509 2.137 1.00 0.00 H new ATOM 0 HH12 ARG B 45 -12.257 -10.803 3.544 1.00 0.00 H new ATOM 0 HH21 ARG B 45 -9.776 -12.527 5.304 1.00 0.00 H new ATOM 0 HH22 ARG B 45 -11.441 -11.937 5.323 1.00 0.00 H new ATOM 938 N LEU B 46 -11.498 -12.338 -2.814 1.00 0.00 N ATOM 939 CA LEU B 46 -12.945 -12.497 -2.934 1.00 0.00 C ATOM 940 C LEU B 46 -13.309 -13.957 -3.184 1.00 0.00 C ATOM 941 O LEU B 46 -14.232 -14.487 -2.565 1.00 0.00 O ATOM 942 CB LEU B 46 -13.470 -11.619 -4.080 1.00 0.00 C ATOM 943 CG LEU B 46 -15.007 -11.790 -4.245 1.00 0.00 C ATOM 944 CD1 LEU B 46 -15.658 -10.436 -4.553 1.00 0.00 C ATOM 945 CD2 LEU B 46 -15.316 -12.759 -5.404 1.00 0.00 C ATOM 0 H LEU B 46 -11.071 -11.746 -3.527 1.00 0.00 H new ATOM 0 HA LEU B 46 -13.409 -12.184 -1.998 1.00 0.00 H new ATOM 0 HB2 LEU B 46 -13.235 -10.574 -3.881 1.00 0.00 H new ATOM 0 HB3 LEU B 46 -12.968 -11.887 -5.009 1.00 0.00 H new ATOM 0 HG LEU B 46 -15.407 -12.191 -3.314 1.00 0.00 H new ATOM 0 HD11 LEU B 46 -16.734 -10.567 -4.667 1.00 0.00 H new ATOM 0 HD12 LEU B 46 -15.461 -9.743 -3.735 1.00 0.00 H new ATOM 0 HD13 LEU B 46 -15.242 -10.034 -5.477 1.00 0.00 H new ATOM 0 HD21 LEU B 46 -16.395 -12.869 -5.508 1.00 0.00 H new ATOM 0 HD22 LEU B 46 -14.901 -12.362 -6.330 1.00 0.00 H new ATOM 0 HD23 LEU B 46 -14.871 -13.731 -5.194 1.00 0.00 H new ATOM 957 N PHE B 47 -12.583 -14.599 -4.091 1.00 0.00 N ATOM 958 CA PHE B 47 -12.845 -15.999 -4.408 1.00 0.00 C ATOM 959 C PHE B 47 -12.568 -16.888 -3.202 1.00 0.00 C ATOM 960 O PHE B 47 -13.349 -17.787 -2.889 1.00 0.00 O ATOM 961 CB PHE B 47 -11.975 -16.443 -5.584 1.00 0.00 C ATOM 962 CG PHE B 47 -12.402 -15.698 -6.827 1.00 0.00 C ATOM 963 CD1 PHE B 47 -13.578 -16.062 -7.494 1.00 0.00 C ATOM 964 CD2 PHE B 47 -11.623 -14.640 -7.311 1.00 0.00 C ATOM 965 CE1 PHE B 47 -13.976 -15.368 -8.643 1.00 0.00 C ATOM 966 CE2 PHE B 47 -12.022 -13.944 -8.460 1.00 0.00 C ATOM 967 CZ PHE B 47 -13.198 -14.308 -9.125 1.00 0.00 C ATOM 0 H PHE B 47 -11.816 -14.179 -4.616 1.00 0.00 H new ATOM 0 HA PHE B 47 -13.896 -16.096 -4.679 1.00 0.00 H new ATOM 0 HB2 PHE B 47 -10.925 -16.245 -5.370 1.00 0.00 H new ATOM 0 HB3 PHE B 47 -12.072 -17.518 -5.738 1.00 0.00 H new ATOM 0 HD1 PHE B 47 -14.179 -16.879 -7.122 1.00 0.00 H new ATOM 0 HD2 PHE B 47 -10.714 -14.360 -6.799 1.00 0.00 H new ATOM 0 HE1 PHE B 47 -14.883 -15.650 -9.157 1.00 0.00 H new ATOM 0 HE2 PHE B 47 -11.422 -13.127 -8.832 1.00 0.00 H new ATOM 0 HZ PHE B 47 -13.506 -13.771 -10.010 1.00 0.00 H new ATOM 977 N PHE B 48 -11.444 -16.635 -2.528 1.00 0.00 N ATOM 978 CA PHE B 48 -11.061 -17.422 -1.352 1.00 0.00 C ATOM 979 C PHE B 48 -10.985 -16.530 -0.116 1.00 0.00 C ATOM 980 O PHE B 48 -10.274 -15.527 -0.107 1.00 0.00 O ATOM 981 CB PHE B 48 -9.695 -18.071 -1.600 1.00 0.00 C ATOM 982 CG PHE B 48 -9.628 -18.582 -3.025 1.00 0.00 C ATOM 983 CD1 PHE B 48 -10.641 -19.413 -3.528 1.00 0.00 C ATOM 984 CD2 PHE B 48 -8.552 -18.221 -3.850 1.00 0.00 C ATOM 985 CE1 PHE B 48 -10.574 -19.879 -4.848 1.00 0.00 C ATOM 986 CE2 PHE B 48 -8.488 -18.688 -5.167 1.00 0.00 C ATOM 987 CZ PHE B 48 -9.498 -19.518 -5.666 1.00 0.00 C ATOM 0 H PHE B 48 -10.786 -15.896 -2.774 1.00 0.00 H new ATOM 0 HA PHE B 48 -11.812 -18.193 -1.182 1.00 0.00 H new ATOM 0 HB2 PHE B 48 -8.899 -17.347 -1.425 1.00 0.00 H new ATOM 0 HB3 PHE B 48 -9.538 -18.892 -0.900 1.00 0.00 H new ATOM 0 HD1 PHE B 48 -11.472 -19.693 -2.898 1.00 0.00 H new ATOM 0 HD2 PHE B 48 -7.771 -17.581 -3.467 1.00 0.00 H new ATOM 0 HE1 PHE B 48 -11.354 -20.518 -5.234 1.00 0.00 H new ATOM 0 HE2 PHE B 48 -7.658 -18.408 -5.799 1.00 0.00 H new ATOM 0 HZ PHE B 48 -9.447 -19.880 -6.682 1.00 0.00 H new ATOM 997 N LYS B 49 -11.715 -16.909 0.928 1.00 0.00 N ATOM 998 CA LYS B 49 -11.722 -16.137 2.167 1.00 0.00 C ATOM 999 C LYS B 49 -10.587 -16.581 3.083 1.00 0.00 C ATOM 1000 O LYS B 49 -9.622 -15.845 3.199 1.00 0.00 O ATOM 1001 CB LYS B 49 -13.059 -16.318 2.885 1.00 0.00 C ATOM 1002 CG LYS B 49 -14.176 -15.689 2.050 1.00 0.00 C ATOM 1003 CD LYS B 49 -15.514 -15.862 2.771 1.00 0.00 C ATOM 1004 CE LYS B 49 -16.631 -15.237 1.933 1.00 0.00 C ATOM 1005 NZ LYS B 49 -17.931 -15.394 2.643 1.00 0.00 N ATOM 1006 OXT LYS B 49 -10.698 -17.654 3.653 1.00 0.00 O ATOM 0 H LYS B 49 -12.306 -17.740 0.942 1.00 0.00 H new ATOM 0 HA LYS B 49 -11.581 -15.085 1.918 1.00 0.00 H new ATOM 0 HB2 LYS B 49 -13.260 -17.378 3.041 1.00 0.00 H new ATOM 0 HB3 LYS B 49 -13.021 -15.853 3.870 1.00 0.00 H new ATOM 0 HG2 LYS B 49 -13.972 -14.630 1.889 1.00 0.00 H new ATOM 0 HG3 LYS B 49 -14.218 -16.158 1.067 1.00 0.00 H new ATOM 0 HD2 LYS B 49 -15.717 -16.920 2.935 1.00 0.00 H new ATOM 0 HD3 LYS B 49 -15.474 -15.390 3.753 1.00 0.00 H new ATOM 0 HE2 LYS B 49 -16.424 -14.181 1.761 1.00 0.00 H new ATOM 0 HE3 LYS B 49 -16.678 -15.716 0.955 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 -18.691 -14.969 2.074 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 -18.129 -16.405 2.785 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 -17.882 -14.917 3.566 1.00 0.00 H new TER 1020 LYS B 49 ATOM 1021 N SER C 19 5.508 23.266 -3.751 1.00 0.00 N ATOM 1022 CA SER C 19 6.444 22.107 -3.681 1.00 0.00 C ATOM 1023 C SER C 19 7.863 22.581 -3.975 1.00 0.00 C ATOM 1024 O SER C 19 8.115 23.225 -4.995 1.00 0.00 O ATOM 1025 CB SER C 19 6.022 21.053 -4.707 1.00 0.00 C ATOM 1026 OG SER C 19 7.114 20.178 -4.956 1.00 0.00 O ATOM 0 HA SER C 19 6.414 21.669 -2.683 1.00 0.00 H new ATOM 0 HB2 SER C 19 5.166 20.489 -4.336 1.00 0.00 H new ATOM 0 HB3 SER C 19 5.708 21.535 -5.633 1.00 0.00 H new ATOM 0 HG SER C 19 6.847 19.500 -5.612 1.00 0.00 H new ATOM 1034 N ASN C 20 8.787 22.259 -3.076 1.00 0.00 N ATOM 1035 CA ASN C 20 10.180 22.654 -3.248 1.00 0.00 C ATOM 1036 C ASN C 20 10.882 21.731 -4.240 1.00 0.00 C ATOM 1037 O ASN C 20 10.383 20.652 -4.557 1.00 0.00 O ATOM 1038 CB ASN C 20 10.909 22.615 -1.904 1.00 0.00 C ATOM 1039 CG ASN C 20 10.450 23.773 -1.026 1.00 0.00 C ATOM 1040 OD1 ASN C 20 9.865 24.736 -1.523 1.00 0.00 O ATOM 1041 ND2 ASN C 20 10.683 23.741 0.257 1.00 0.00 N ATOM 0 H ASN C 20 8.598 21.729 -2.225 1.00 0.00 H new ATOM 0 HA ASN C 20 10.201 23.671 -3.639 1.00 0.00 H new ATOM 0 HB2 ASN C 20 10.712 21.668 -1.402 1.00 0.00 H new ATOM 0 HB3 ASN C 20 11.986 22.674 -2.064 1.00 0.00 H new ATOM 0 HD21 ASN C 20 10.381 24.514 0.850 1.00 0.00 H new ATOM 0 HD22 ASN C 20 11.168 22.943 0.668 1.00 0.00 H new ATOM 1048 N ASP C 21 12.042 22.163 -4.722 1.00 0.00 N ATOM 1049 CA ASP C 21 12.806 21.367 -5.680 1.00 0.00 C ATOM 1050 C ASP C 21 13.216 20.036 -5.059 1.00 0.00 C ATOM 1051 O ASP C 21 13.162 18.994 -5.714 1.00 0.00 O ATOM 1052 CB ASP C 21 14.056 22.134 -6.113 1.00 0.00 C ATOM 1053 CG ASP C 21 14.842 21.313 -7.131 1.00 0.00 C ATOM 1054 OD1 ASP C 21 14.459 20.181 -7.371 1.00 0.00 O ATOM 1055 OD2 ASP C 21 15.815 21.832 -7.655 1.00 0.00 O ATOM 0 H ASP C 21 12.473 23.052 -4.469 1.00 0.00 H new ATOM 0 HA ASP C 21 12.178 21.174 -6.549 1.00 0.00 H new ATOM 0 HB2 ASP C 21 13.773 23.093 -6.547 1.00 0.00 H new ATOM 0 HB3 ASP C 21 14.680 22.348 -5.246 1.00 0.00 H new ATOM 1060 N SER C 22 13.619 20.077 -3.795 1.00 0.00 N ATOM 1061 CA SER C 22 14.033 18.868 -3.098 1.00 0.00 C ATOM 1062 C SER C 22 12.871 17.883 -3.010 1.00 0.00 C ATOM 1063 O SER C 22 13.049 16.679 -3.196 1.00 0.00 O ATOM 1064 CB SER C 22 14.518 19.214 -1.689 1.00 0.00 C ATOM 1065 OG SER C 22 14.956 18.029 -1.038 1.00 0.00 O ATOM 0 H SER C 22 13.668 20.929 -3.236 1.00 0.00 H new ATOM 0 HA SER C 22 14.848 18.408 -3.657 1.00 0.00 H new ATOM 0 HB2 SER C 22 15.332 19.937 -1.740 1.00 0.00 H new ATOM 0 HB3 SER C 22 13.714 19.679 -1.119 1.00 0.00 H new ATOM 0 HG SER C 22 15.269 18.248 -0.135 1.00 0.00 H new ATOM 1071 N SER C 23 11.683 18.404 -2.720 1.00 0.00 N ATOM 1072 CA SER C 23 10.498 17.561 -2.602 1.00 0.00 C ATOM 1073 C SER C 23 10.656 16.603 -1.428 1.00 0.00 C ATOM 1074 O SER C 23 11.677 15.928 -1.304 1.00 0.00 O ATOM 1075 CB SER C 23 10.291 16.765 -3.896 1.00 0.00 C ATOM 1076 OG SER C 23 10.965 15.518 -3.795 1.00 0.00 O ATOM 0 H SER C 23 11.515 19.398 -2.563 1.00 0.00 H new ATOM 0 HA SER C 23 9.629 18.196 -2.430 1.00 0.00 H new ATOM 0 HB2 SER C 23 9.227 16.603 -4.070 1.00 0.00 H new ATOM 0 HB3 SER C 23 10.671 17.329 -4.748 1.00 0.00 H new ATOM 0 HG SER C 23 11.741 15.612 -3.204 1.00 0.00 H new ATOM 1082 N ASP C 24 9.642 16.551 -0.568 1.00 0.00 N ATOM 1083 CA ASP C 24 9.683 15.677 0.602 1.00 0.00 C ATOM 1084 C ASP C 24 10.220 14.287 0.214 1.00 0.00 C ATOM 1085 O ASP C 24 9.509 13.511 -0.424 1.00 0.00 O ATOM 1086 CB ASP C 24 8.273 15.537 1.182 1.00 0.00 C ATOM 1087 CG ASP C 24 7.852 16.849 1.841 1.00 0.00 C ATOM 1088 OD1 ASP C 24 8.406 17.168 2.881 1.00 0.00 O ATOM 1089 OD2 ASP C 24 6.988 17.514 1.295 1.00 0.00 O ATOM 0 H ASP C 24 8.787 17.100 -0.658 1.00 0.00 H new ATOM 0 HA ASP C 24 10.347 16.115 1.347 1.00 0.00 H new ATOM 0 HB2 ASP C 24 7.569 15.274 0.392 1.00 0.00 H new ATOM 0 HB3 ASP C 24 8.249 14.728 1.913 1.00 0.00 H new ATOM 1094 N PRO C 25 11.447 13.945 0.571 1.00 0.00 N ATOM 1095 CA PRO C 25 12.035 12.609 0.221 1.00 0.00 C ATOM 1096 C PRO C 25 11.119 11.449 0.609 1.00 0.00 C ATOM 1097 O PRO C 25 11.073 10.424 -0.074 1.00 0.00 O ATOM 1098 CB PRO C 25 13.345 12.559 1.026 1.00 0.00 C ATOM 1099 CG PRO C 25 13.727 13.988 1.238 1.00 0.00 C ATOM 1100 CD PRO C 25 12.415 14.774 1.325 1.00 0.00 C ATOM 0 HA PRO C 25 12.184 12.504 -0.854 1.00 0.00 H new ATOM 0 HB2 PRO C 25 13.204 12.044 1.976 1.00 0.00 H new ATOM 0 HB3 PRO C 25 14.121 12.020 0.483 1.00 0.00 H new ATOM 0 HG2 PRO C 25 14.311 14.103 2.151 1.00 0.00 H new ATOM 0 HG3 PRO C 25 14.345 14.352 0.417 1.00 0.00 H new ATOM 0 HD2 PRO C 25 12.101 14.912 2.360 1.00 0.00 H new ATOM 0 HD3 PRO C 25 12.515 15.767 0.887 1.00 0.00 H new ATOM 1108 N LEU C 26 10.403 11.610 1.715 1.00 0.00 N ATOM 1109 CA LEU C 26 9.507 10.565 2.191 1.00 0.00 C ATOM 1110 C LEU C 26 8.413 10.285 1.166 1.00 0.00 C ATOM 1111 O LEU C 26 8.062 9.131 0.918 1.00 0.00 O ATOM 1112 CB LEU C 26 8.870 10.995 3.515 1.00 0.00 C ATOM 1113 CG LEU C 26 9.938 11.059 4.618 1.00 0.00 C ATOM 1114 CD1 LEU C 26 9.343 11.752 5.848 1.00 0.00 C ATOM 1115 CD2 LEU C 26 10.413 9.641 5.003 1.00 0.00 C ATOM 0 H LEU C 26 10.425 12.448 2.295 1.00 0.00 H new ATOM 0 HA LEU C 26 10.086 9.654 2.341 1.00 0.00 H new ATOM 0 HB2 LEU C 26 8.396 11.970 3.400 1.00 0.00 H new ATOM 0 HB3 LEU C 26 8.087 10.291 3.796 1.00 0.00 H new ATOM 0 HG LEU C 26 10.796 11.620 4.248 1.00 0.00 H new ATOM 0 HD11 LEU C 26 10.094 11.802 6.636 1.00 0.00 H new ATOM 0 HD12 LEU C 26 9.030 12.761 5.581 1.00 0.00 H new ATOM 0 HD13 LEU C 26 8.481 11.186 6.203 1.00 0.00 H new ATOM 0 HD21 LEU C 26 11.169 9.710 5.785 1.00 0.00 H new ATOM 0 HD22 LEU C 26 9.566 9.060 5.367 1.00 0.00 H new ATOM 0 HD23 LEU C 26 10.840 9.150 4.128 1.00 0.00 H new ATOM 1127 N VAL C 27 7.876 11.345 0.570 1.00 0.00 N ATOM 1128 CA VAL C 27 6.824 11.193 -0.430 1.00 0.00 C ATOM 1129 C VAL C 27 7.342 10.412 -1.633 1.00 0.00 C ATOM 1130 O VAL C 27 6.676 9.503 -2.131 1.00 0.00 O ATOM 1131 CB VAL C 27 6.329 12.572 -0.879 1.00 0.00 C ATOM 1132 CG1 VAL C 27 5.330 12.413 -2.029 1.00 0.00 C ATOM 1133 CG2 VAL C 27 5.643 13.271 0.298 1.00 0.00 C ATOM 0 H VAL C 27 8.148 12.310 0.759 1.00 0.00 H new ATOM 0 HA VAL C 27 5.996 10.641 0.015 1.00 0.00 H new ATOM 0 HB VAL C 27 7.176 13.168 -1.218 1.00 0.00 H new ATOM 0 HG11 VAL C 27 4.980 13.396 -2.346 1.00 0.00 H new ATOM 0 HG12 VAL C 27 5.816 11.914 -2.867 1.00 0.00 H new ATOM 0 HG13 VAL C 27 4.481 11.816 -1.694 1.00 0.00 H new ATOM 0 HG21 VAL C 27 5.289 14.253 -0.018 1.00 0.00 H new ATOM 0 HG22 VAL C 27 4.797 12.672 0.634 1.00 0.00 H new ATOM 0 HG23 VAL C 27 6.353 13.387 1.116 1.00 0.00 H new ATOM 1143 N VAL C 28 8.535 10.770 -2.095 1.00 0.00 N ATOM 1144 CA VAL C 28 9.135 10.096 -3.241 1.00 0.00 C ATOM 1145 C VAL C 28 9.389 8.624 -2.920 1.00 0.00 C ATOM 1146 O VAL C 28 9.089 7.743 -3.725 1.00 0.00 O ATOM 1147 CB VAL C 28 10.455 10.776 -3.615 1.00 0.00 C ATOM 1148 CG1 VAL C 28 11.153 9.980 -4.720 1.00 0.00 C ATOM 1149 CG2 VAL C 28 10.169 12.195 -4.113 1.00 0.00 C ATOM 0 H VAL C 28 9.103 11.518 -1.697 1.00 0.00 H new ATOM 0 HA VAL C 28 8.445 10.160 -4.082 1.00 0.00 H new ATOM 0 HB VAL C 28 11.102 10.817 -2.739 1.00 0.00 H new ATOM 0 HG11 VAL C 28 12.092 10.468 -4.982 1.00 0.00 H new ATOM 0 HG12 VAL C 28 11.356 8.969 -4.367 1.00 0.00 H new ATOM 0 HG13 VAL C 28 10.509 9.935 -5.598 1.00 0.00 H new ATOM 0 HG21 VAL C 28 11.106 12.683 -4.380 1.00 0.00 H new ATOM 0 HG22 VAL C 28 9.521 12.150 -4.988 1.00 0.00 H new ATOM 0 HG23 VAL C 28 9.676 12.764 -3.325 1.00 0.00 H new ATOM 1159 N ALA C 29 9.945 8.368 -1.739 1.00 0.00 N ATOM 1160 CA ALA C 29 10.237 7.000 -1.327 1.00 0.00 C ATOM 1161 C ALA C 29 8.951 6.193 -1.189 1.00 0.00 C ATOM 1162 O ALA C 29 8.911 5.013 -1.531 1.00 0.00 O ATOM 1163 CB ALA C 29 10.979 7.005 0.011 1.00 0.00 C ATOM 0 H ALA C 29 10.200 9.082 -1.057 1.00 0.00 H new ATOM 0 HA ALA C 29 10.863 6.539 -2.091 1.00 0.00 H new ATOM 0 HB1 ALA C 29 11.193 5.980 0.312 1.00 0.00 H new ATOM 0 HB2 ALA C 29 11.914 7.556 -0.093 1.00 0.00 H new ATOM 0 HB3 ALA C 29 10.359 7.483 0.769 1.00 0.00 H new ATOM 1169 N ALA C 30 7.904 6.834 -0.685 1.00 0.00 N ATOM 1170 CA ALA C 30 6.628 6.155 -0.504 1.00 0.00 C ATOM 1171 C ALA C 30 6.129 5.581 -1.824 1.00 0.00 C ATOM 1172 O ALA C 30 5.685 4.433 -1.883 1.00 0.00 O ATOM 1173 CB ALA C 30 5.593 7.133 0.052 1.00 0.00 C ATOM 0 H ALA C 30 7.912 7.813 -0.397 1.00 0.00 H new ATOM 0 HA ALA C 30 6.773 5.336 0.200 1.00 0.00 H new ATOM 0 HB1 ALA C 30 4.641 6.619 0.185 1.00 0.00 H new ATOM 0 HB2 ALA C 30 5.935 7.517 1.013 1.00 0.00 H new ATOM 0 HB3 ALA C 30 5.464 7.961 -0.645 1.00 0.00 H new ATOM 1179 N ASN C 31 6.206 6.379 -2.884 1.00 0.00 N ATOM 1180 CA ASN C 31 5.759 5.927 -4.196 1.00 0.00 C ATOM 1181 C ASN C 31 6.609 4.753 -4.675 1.00 0.00 C ATOM 1182 O ASN C 31 6.088 3.776 -5.212 1.00 0.00 O ATOM 1183 CB ASN C 31 5.858 7.075 -5.202 1.00 0.00 C ATOM 1184 CG ASN C 31 5.446 6.590 -6.587 1.00 0.00 C ATOM 1185 OD1 ASN C 31 6.290 6.443 -7.472 1.00 0.00 O ATOM 1186 ND2 ASN C 31 4.191 6.329 -6.830 1.00 0.00 N ATOM 0 H ASN C 31 6.570 7.332 -2.861 1.00 0.00 H new ATOM 0 HA ASN C 31 4.722 5.601 -4.116 1.00 0.00 H new ATOM 0 HB2 ASN C 31 5.216 7.899 -4.890 1.00 0.00 H new ATOM 0 HB3 ASN C 31 6.878 7.458 -5.230 1.00 0.00 H new ATOM 0 HD21 ASN C 31 3.908 6.003 -7.754 1.00 0.00 H new ATOM 0 HD22 ASN C 31 3.493 6.451 -6.096 1.00 0.00 H new ATOM 1193 N ILE C 32 7.917 4.856 -4.473 1.00 0.00 N ATOM 1194 CA ILE C 32 8.835 3.798 -4.883 1.00 0.00 C ATOM 1195 C ILE C 32 8.573 2.523 -4.085 1.00 0.00 C ATOM 1196 O ILE C 32 8.571 1.422 -4.635 1.00 0.00 O ATOM 1197 CB ILE C 32 10.285 4.251 -4.679 1.00 0.00 C ATOM 1198 CG1 ILE C 32 10.601 5.390 -5.652 1.00 0.00 C ATOM 1199 CG2 ILE C 32 11.234 3.080 -4.948 1.00 0.00 C ATOM 1200 CD1 ILE C 32 11.939 6.028 -5.272 1.00 0.00 C ATOM 0 H ILE C 32 8.366 5.658 -4.030 1.00 0.00 H new ATOM 0 HA ILE C 32 8.671 3.589 -5.940 1.00 0.00 H new ATOM 0 HB ILE C 32 10.415 4.595 -3.653 1.00 0.00 H new ATOM 0 HG12 ILE C 32 10.644 5.010 -6.673 1.00 0.00 H new ATOM 0 HG13 ILE C 32 9.808 6.138 -5.624 1.00 0.00 H new ATOM 0 HG21 ILE C 32 12.264 3.405 -4.802 1.00 0.00 H new ATOM 0 HG22 ILE C 32 11.010 2.265 -4.260 1.00 0.00 H new ATOM 0 HG23 ILE C 32 11.104 2.735 -5.974 1.00 0.00 H new ATOM 0 HD11 ILE C 32 12.165 6.839 -5.964 1.00 0.00 H new ATOM 0 HD12 ILE C 32 11.879 6.423 -4.258 1.00 0.00 H new ATOM 0 HD13 ILE C 32 12.728 5.277 -5.323 1.00 0.00 H new ATOM 1212 N ILE C 33 8.368 2.681 -2.782 1.00 0.00 N ATOM 1213 CA ILE C 33 8.123 1.539 -1.908 1.00 0.00 C ATOM 1214 C ILE C 33 6.836 0.820 -2.321 1.00 0.00 C ATOM 1215 O ILE C 33 6.794 -0.409 -2.378 1.00 0.00 O ATOM 1216 CB ILE C 33 8.009 2.017 -0.452 1.00 0.00 C ATOM 1217 CG1 ILE C 33 9.377 2.551 0.048 1.00 0.00 C ATOM 1218 CG2 ILE C 33 7.539 0.858 0.439 1.00 0.00 C ATOM 1219 CD1 ILE C 33 10.264 1.415 0.576 1.00 0.00 C ATOM 0 H ILE C 33 8.366 3.585 -2.309 1.00 0.00 H new ATOM 0 HA ILE C 33 8.957 0.842 -1.996 1.00 0.00 H new ATOM 0 HB ILE C 33 7.280 2.826 -0.402 1.00 0.00 H new ATOM 0 HG12 ILE C 33 9.888 3.065 -0.766 1.00 0.00 H new ATOM 0 HG13 ILE C 33 9.216 3.285 0.837 1.00 0.00 H new ATOM 0 HG21 ILE C 33 7.460 1.201 1.471 1.00 0.00 H new ATOM 0 HG22 ILE C 33 6.565 0.508 0.097 1.00 0.00 H new ATOM 0 HG23 ILE C 33 8.258 0.041 0.383 1.00 0.00 H new ATOM 0 HD11 ILE C 33 11.214 1.825 0.918 1.00 0.00 H new ATOM 0 HD12 ILE C 33 9.763 0.918 1.407 1.00 0.00 H new ATOM 0 HD13 ILE C 33 10.445 0.694 -0.221 1.00 0.00 H new ATOM 1231 N GLY C 34 5.787 1.589 -2.601 1.00 0.00 N ATOM 1232 CA GLY C 34 4.511 1.005 -3.003 1.00 0.00 C ATOM 1233 C GLY C 34 4.649 0.245 -4.319 1.00 0.00 C ATOM 1234 O GLY C 34 4.161 -0.877 -4.454 1.00 0.00 O ATOM 0 H GLY C 34 5.794 2.608 -2.558 1.00 0.00 H new ATOM 0 HA2 GLY C 34 4.154 0.330 -2.225 1.00 0.00 H new ATOM 0 HA3 GLY C 34 3.764 1.792 -3.110 1.00 0.00 H new ATOM 1238 N ILE C 35 5.322 0.863 -5.284 1.00 0.00 N ATOM 1239 CA ILE C 35 5.524 0.240 -6.587 1.00 0.00 C ATOM 1240 C ILE C 35 6.378 -1.020 -6.446 1.00 0.00 C ATOM 1241 O ILE C 35 6.096 -2.049 -7.063 1.00 0.00 O ATOM 1242 CB ILE C 35 6.200 1.228 -7.545 1.00 0.00 C ATOM 1243 CG1 ILE C 35 5.234 2.376 -7.851 1.00 0.00 C ATOM 1244 CG2 ILE C 35 6.561 0.512 -8.850 1.00 0.00 C ATOM 1245 CD1 ILE C 35 5.979 3.500 -8.575 1.00 0.00 C ATOM 0 H ILE C 35 5.735 1.791 -5.189 1.00 0.00 H new ATOM 0 HA ILE C 35 4.552 -0.039 -6.994 1.00 0.00 H new ATOM 0 HB ILE C 35 7.106 1.620 -7.082 1.00 0.00 H new ATOM 0 HG12 ILE C 35 4.411 2.016 -8.468 1.00 0.00 H new ATOM 0 HG13 ILE C 35 4.798 2.753 -6.926 1.00 0.00 H new ATOM 0 HG21 ILE C 35 7.041 1.215 -9.530 1.00 0.00 H new ATOM 0 HG22 ILE C 35 7.244 -0.311 -8.637 1.00 0.00 H new ATOM 0 HG23 ILE C 35 5.655 0.121 -9.313 1.00 0.00 H new ATOM 0 HD11 ILE C 35 5.288 4.315 -8.791 1.00 0.00 H new ATOM 0 HD12 ILE C 35 6.787 3.868 -7.942 1.00 0.00 H new ATOM 0 HD13 ILE C 35 6.394 3.119 -9.508 1.00 0.00 H new ATOM 1257 N LEU C 36 7.431 -0.930 -5.636 1.00 0.00 N ATOM 1258 CA LEU C 36 8.323 -2.065 -5.427 1.00 0.00 C ATOM 1259 C LEU C 36 7.555 -3.240 -4.833 1.00 0.00 C ATOM 1260 O LEU C 36 7.754 -4.388 -5.227 1.00 0.00 O ATOM 1261 CB LEU C 36 9.468 -1.668 -4.486 1.00 0.00 C ATOM 1262 CG LEU C 36 10.414 -2.861 -4.254 1.00 0.00 C ATOM 1263 CD1 LEU C 36 11.004 -3.344 -5.591 1.00 0.00 C ATOM 1264 CD2 LEU C 36 11.546 -2.420 -3.320 1.00 0.00 C ATOM 0 H LEU C 36 7.685 -0.089 -5.118 1.00 0.00 H new ATOM 0 HA LEU C 36 8.737 -2.363 -6.390 1.00 0.00 H new ATOM 0 HB2 LEU C 36 10.024 -0.833 -4.912 1.00 0.00 H new ATOM 0 HB3 LEU C 36 9.062 -1.327 -3.533 1.00 0.00 H new ATOM 0 HG LEU C 36 9.857 -3.683 -3.804 1.00 0.00 H new ATOM 0 HD11 LEU C 36 11.671 -4.187 -5.411 1.00 0.00 H new ATOM 0 HD12 LEU C 36 10.196 -3.655 -6.254 1.00 0.00 H new ATOM 0 HD13 LEU C 36 11.563 -2.532 -6.056 1.00 0.00 H new ATOM 0 HD21 LEU C 36 12.223 -3.257 -3.148 1.00 0.00 H new ATOM 0 HD22 LEU C 36 12.095 -1.597 -3.777 1.00 0.00 H new ATOM 0 HD23 LEU C 36 11.126 -2.092 -2.369 1.00 0.00 H new ATOM 1276 N HIS C 37 6.674 -2.943 -3.886 1.00 0.00 N ATOM 1277 CA HIS C 37 5.881 -3.983 -3.248 1.00 0.00 C ATOM 1278 C HIS C 37 5.063 -4.732 -4.291 1.00 0.00 C ATOM 1279 O HIS C 37 4.941 -5.955 -4.236 1.00 0.00 O ATOM 1280 CB HIS C 37 4.936 -3.370 -2.217 1.00 0.00 C ATOM 1281 CG HIS C 37 4.167 -4.471 -1.541 1.00 0.00 C ATOM 1282 ND1 HIS C 37 4.280 -4.738 -0.188 1.00 0.00 N ATOM 1283 CD2 HIS C 37 3.282 -5.397 -2.028 1.00 0.00 C ATOM 1284 CE1 HIS C 37 3.484 -5.787 0.086 1.00 0.00 C ATOM 1285 NE2 HIS C 37 2.852 -6.226 -1.001 1.00 0.00 N ATOM 0 H HIS C 37 6.492 -1.999 -3.546 1.00 0.00 H new ATOM 0 HA HIS C 37 6.559 -4.676 -2.750 1.00 0.00 H new ATOM 0 HB2 HIS C 37 5.502 -2.799 -1.481 1.00 0.00 H new ATOM 0 HB3 HIS C 37 4.250 -2.675 -2.701 1.00 0.00 H new ATOM 0 HD2 HIS C 37 2.966 -5.471 -3.058 1.00 0.00 H new ATOM 0 HE1 HIS C 37 3.371 -6.221 1.069 1.00 0.00 H new ATOM 0 HE2 HIS C 37 2.194 -7.003 -1.065 1.00 0.00 H new ATOM 1293 N LEU C 38 4.502 -3.990 -5.236 1.00 0.00 N ATOM 1294 CA LEU C 38 3.687 -4.594 -6.283 1.00 0.00 C ATOM 1295 C LEU C 38 4.506 -5.581 -7.105 1.00 0.00 C ATOM 1296 O LEU C 38 3.999 -6.629 -7.490 1.00 0.00 O ATOM 1297 CB LEU C 38 3.102 -3.494 -7.193 1.00 0.00 C ATOM 1298 CG LEU C 38 1.752 -2.998 -6.629 1.00 0.00 C ATOM 1299 CD1 LEU C 38 1.457 -1.586 -7.136 1.00 0.00 C ATOM 1300 CD2 LEU C 38 0.615 -3.936 -7.077 1.00 0.00 C ATOM 0 H LEU C 38 4.595 -2.976 -5.300 1.00 0.00 H new ATOM 0 HA LEU C 38 2.869 -5.141 -5.814 1.00 0.00 H new ATOM 0 HB2 LEU C 38 3.802 -2.662 -7.266 1.00 0.00 H new ATOM 0 HB3 LEU C 38 2.962 -3.882 -8.202 1.00 0.00 H new ATOM 0 HG LEU C 38 1.815 -2.991 -5.541 1.00 0.00 H new ATOM 0 HD11 LEU C 38 0.503 -1.246 -6.732 1.00 0.00 H new ATOM 0 HD12 LEU C 38 2.249 -0.910 -6.813 1.00 0.00 H new ATOM 0 HD13 LEU C 38 1.408 -1.593 -8.225 1.00 0.00 H new ATOM 0 HD21 LEU C 38 -0.332 -3.578 -6.674 1.00 0.00 H new ATOM 0 HD22 LEU C 38 0.564 -3.951 -8.166 1.00 0.00 H new ATOM 0 HD23 LEU C 38 0.808 -4.944 -6.709 1.00 0.00 H new ATOM 1312 N ILE C 39 5.756 -5.247 -7.380 1.00 0.00 N ATOM 1313 CA ILE C 39 6.598 -6.134 -8.171 1.00 0.00 C ATOM 1314 C ILE C 39 6.783 -7.473 -7.454 1.00 0.00 C ATOM 1315 O ILE C 39 6.703 -8.534 -8.066 1.00 0.00 O ATOM 1316 CB ILE C 39 7.964 -5.480 -8.401 1.00 0.00 C ATOM 1317 CG1 ILE C 39 7.783 -4.254 -9.304 1.00 0.00 C ATOM 1318 CG2 ILE C 39 8.908 -6.478 -9.082 1.00 0.00 C ATOM 1319 CD1 ILE C 39 9.084 -3.448 -9.355 1.00 0.00 C ATOM 0 H ILE C 39 6.206 -4.384 -7.074 1.00 0.00 H new ATOM 0 HA ILE C 39 6.114 -6.313 -9.131 1.00 0.00 H new ATOM 0 HB ILE C 39 8.391 -5.179 -7.444 1.00 0.00 H new ATOM 0 HG12 ILE C 39 7.501 -4.570 -10.308 1.00 0.00 H new ATOM 0 HG13 ILE C 39 6.973 -3.630 -8.927 1.00 0.00 H new ATOM 0 HG21 ILE C 39 9.878 -6.009 -9.244 1.00 0.00 H new ATOM 0 HG22 ILE C 39 9.030 -7.355 -8.446 1.00 0.00 H new ATOM 0 HG23 ILE C 39 8.487 -6.781 -10.041 1.00 0.00 H new ATOM 0 HD11 ILE C 39 8.948 -2.579 -9.998 1.00 0.00 H new ATOM 0 HD12 ILE C 39 9.347 -3.118 -8.350 1.00 0.00 H new ATOM 0 HD13 ILE C 39 9.884 -4.073 -9.753 1.00 0.00 H new ATOM 1331 N LEU C 40 7.036 -7.420 -6.155 1.00 0.00 N ATOM 1332 CA LEU C 40 7.223 -8.643 -5.383 1.00 0.00 C ATOM 1333 C LEU C 40 5.892 -9.365 -5.158 1.00 0.00 C ATOM 1334 O LEU C 40 5.810 -10.588 -5.278 1.00 0.00 O ATOM 1335 CB LEU C 40 7.868 -8.305 -4.045 1.00 0.00 C ATOM 1336 CG LEU C 40 9.115 -7.445 -4.283 1.00 0.00 C ATOM 1337 CD1 LEU C 40 9.752 -7.096 -2.938 1.00 0.00 C ATOM 1338 CD2 LEU C 40 10.125 -8.211 -5.155 1.00 0.00 C ATOM 0 H LEU C 40 7.116 -6.557 -5.617 1.00 0.00 H new ATOM 0 HA LEU C 40 7.875 -9.311 -5.946 1.00 0.00 H new ATOM 0 HB2 LEU C 40 7.160 -7.770 -3.412 1.00 0.00 H new ATOM 0 HB3 LEU C 40 8.139 -9.220 -3.518 1.00 0.00 H new ATOM 0 HG LEU C 40 8.828 -6.529 -4.800 1.00 0.00 H new ATOM 0 HD11 LEU C 40 10.639 -6.485 -3.103 1.00 0.00 H new ATOM 0 HD12 LEU C 40 9.037 -6.542 -2.330 1.00 0.00 H new ATOM 0 HD13 LEU C 40 10.035 -8.013 -2.420 1.00 0.00 H new ATOM 0 HD21 LEU C 40 11.007 -7.592 -5.319 1.00 0.00 H new ATOM 0 HD22 LEU C 40 10.416 -9.132 -4.650 1.00 0.00 H new ATOM 0 HD23 LEU C 40 9.668 -8.452 -6.115 1.00 0.00 H new ATOM 1350 N TRP C 41 4.854 -8.603 -4.810 1.00 0.00 N ATOM 1351 CA TRP C 41 3.535 -9.180 -4.550 1.00 0.00 C ATOM 1352 C TRP C 41 2.892 -9.737 -5.824 1.00 0.00 C ATOM 1353 O TRP C 41 2.321 -10.827 -5.808 1.00 0.00 O ATOM 1354 CB TRP C 41 2.623 -8.120 -3.922 1.00 0.00 C ATOM 1355 CG TRP C 41 1.221 -8.640 -3.814 1.00 0.00 C ATOM 1356 CD1 TRP C 41 0.745 -9.407 -2.805 1.00 0.00 C ATOM 1357 CD2 TRP C 41 0.100 -8.405 -4.710 1.00 0.00 C ATOM 1358 NE1 TRP C 41 -0.589 -9.684 -3.047 1.00 0.00 N ATOM 1359 CE2 TRP C 41 -1.032 -9.078 -4.205 1.00 0.00 C ATOM 1360 CE3 TRP C 41 -0.042 -7.679 -5.907 1.00 0.00 C ATOM 1361 CZ2 TRP C 41 -2.258 -9.035 -4.860 1.00 0.00 C ATOM 1362 CZ3 TRP C 41 -1.280 -7.628 -6.564 1.00 0.00 C ATOM 1363 CH2 TRP C 41 -2.382 -8.306 -6.040 1.00 0.00 C ATOM 0 H TRP C 41 4.901 -7.590 -4.702 1.00 0.00 H new ATOM 0 HA TRP C 41 3.665 -10.013 -3.859 1.00 0.00 H new ATOM 0 HB2 TRP C 41 2.995 -7.849 -2.934 1.00 0.00 H new ATOM 0 HB3 TRP C 41 2.637 -7.214 -4.527 1.00 0.00 H new ATOM 0 HD1 TRP C 41 1.313 -9.747 -1.952 1.00 0.00 H new ATOM 0 HE1 TRP C 41 -1.173 -10.264 -2.444 1.00 0.00 H new ATOM 0 HE3 TRP C 41 0.808 -7.158 -6.322 1.00 0.00 H new ATOM 0 HZ2 TRP C 41 -3.109 -9.564 -4.456 1.00 0.00 H new ATOM 0 HZ3 TRP C 41 -1.381 -7.062 -7.478 1.00 0.00 H new ATOM 0 HH2 TRP C 41 -3.333 -8.265 -6.551 1.00 0.00 H new ATOM 1374 N ILE C 42 2.974 -8.985 -6.915 1.00 0.00 N ATOM 1375 CA ILE C 42 2.380 -9.425 -8.176 1.00 0.00 C ATOM 1376 C ILE C 42 3.071 -10.692 -8.676 1.00 0.00 C ATOM 1377 O ILE C 42 2.420 -11.608 -9.179 1.00 0.00 O ATOM 1378 CB ILE C 42 2.491 -8.311 -9.232 1.00 0.00 C ATOM 1379 CG1 ILE C 42 1.581 -8.631 -10.430 1.00 0.00 C ATOM 1380 CG2 ILE C 42 3.941 -8.189 -9.722 1.00 0.00 C ATOM 1381 CD1 ILE C 42 0.099 -8.575 -10.025 1.00 0.00 C ATOM 0 H ILE C 42 3.439 -8.078 -6.955 1.00 0.00 H new ATOM 0 HA ILE C 42 1.326 -9.646 -8.005 1.00 0.00 H new ATOM 0 HB ILE C 42 2.181 -7.370 -8.777 1.00 0.00 H new ATOM 0 HG12 ILE C 42 1.769 -7.920 -11.235 1.00 0.00 H new ATOM 0 HG13 ILE C 42 1.819 -9.622 -10.818 1.00 0.00 H new ATOM 0 HG21 ILE C 42 4.007 -7.398 -10.469 1.00 0.00 H new ATOM 0 HG22 ILE C 42 4.591 -7.949 -8.880 1.00 0.00 H new ATOM 0 HG23 ILE C 42 4.256 -9.134 -10.165 1.00 0.00 H new ATOM 0 HD11 ILE C 42 -0.523 -8.805 -10.890 1.00 0.00 H new ATOM 0 HD12 ILE C 42 -0.091 -9.304 -9.237 1.00 0.00 H new ATOM 0 HD13 ILE C 42 -0.141 -7.576 -9.660 1.00 0.00 H new ATOM 1393 N LEU C 43 4.393 -10.735 -8.532 1.00 0.00 N ATOM 1394 CA LEU C 43 5.157 -11.895 -8.972 1.00 0.00 C ATOM 1395 C LEU C 43 4.732 -13.137 -8.194 1.00 0.00 C ATOM 1396 O LEU C 43 4.585 -14.216 -8.766 1.00 0.00 O ATOM 1397 CB LEU C 43 6.658 -11.638 -8.768 1.00 0.00 C ATOM 1398 CG LEU C 43 7.195 -10.728 -9.891 1.00 0.00 C ATOM 1399 CD1 LEU C 43 8.602 -10.239 -9.519 1.00 0.00 C ATOM 1400 CD2 LEU C 43 7.253 -11.495 -11.235 1.00 0.00 C ATOM 0 H LEU C 43 4.951 -9.988 -8.119 1.00 0.00 H new ATOM 0 HA LEU C 43 4.962 -12.063 -10.031 1.00 0.00 H new ATOM 0 HB2 LEU C 43 6.827 -11.170 -7.798 1.00 0.00 H new ATOM 0 HB3 LEU C 43 7.200 -12.584 -8.765 1.00 0.00 H new ATOM 0 HG LEU C 43 6.523 -9.877 -10.005 1.00 0.00 H new ATOM 0 HD11 LEU C 43 8.985 -9.595 -10.311 1.00 0.00 H new ATOM 0 HD12 LEU C 43 8.557 -9.678 -8.585 1.00 0.00 H new ATOM 0 HD13 LEU C 43 9.264 -11.096 -9.396 1.00 0.00 H new ATOM 0 HD21 LEU C 43 7.635 -10.835 -12.014 1.00 0.00 H new ATOM 0 HD22 LEU C 43 7.913 -12.357 -11.134 1.00 0.00 H new ATOM 0 HD23 LEU C 43 6.253 -11.834 -11.504 1.00 0.00 H new ATOM 1412 N ASP C 44 4.534 -12.983 -6.891 1.00 0.00 N ATOM 1413 CA ASP C 44 4.122 -14.109 -6.060 1.00 0.00 C ATOM 1414 C ASP C 44 2.751 -14.622 -6.493 1.00 0.00 C ATOM 1415 O ASP C 44 2.521 -15.830 -6.556 1.00 0.00 O ATOM 1416 CB ASP C 44 4.066 -13.686 -4.589 1.00 0.00 C ATOM 1417 CG ASP C 44 3.649 -14.869 -3.720 1.00 0.00 C ATOM 1418 OD1 ASP C 44 3.320 -15.902 -4.279 1.00 0.00 O ATOM 1419 OD2 ASP C 44 3.659 -14.722 -2.508 1.00 0.00 O ATOM 0 H ASP C 44 4.650 -12.102 -6.391 1.00 0.00 H new ATOM 0 HA ASP C 44 4.854 -14.908 -6.180 1.00 0.00 H new ATOM 0 HB2 ASP C 44 5.041 -13.317 -4.271 1.00 0.00 H new ATOM 0 HB3 ASP C 44 3.359 -12.866 -4.465 1.00 0.00 H new ATOM 1424 N ARG C 45 1.841 -13.696 -6.785 1.00 0.00 N ATOM 1425 CA ARG C 45 0.495 -14.069 -7.205 1.00 0.00 C ATOM 1426 C ARG C 45 0.491 -14.539 -8.660 1.00 0.00 C ATOM 1427 O ARG C 45 -0.423 -15.240 -9.093 1.00 0.00 O ATOM 1428 CB ARG C 45 -0.449 -12.874 -7.044 1.00 0.00 C ATOM 1429 CG ARG C 45 -1.880 -13.297 -7.381 1.00 0.00 C ATOM 1430 CD ARG C 45 -2.832 -12.129 -7.135 1.00 0.00 C ATOM 1431 NE ARG C 45 -4.215 -12.569 -7.280 1.00 0.00 N ATOM 1432 CZ ARG C 45 -4.831 -12.558 -8.458 1.00 0.00 C ATOM 1433 NH1 ARG C 45 -4.202 -12.147 -9.523 1.00 0.00 N ATOM 1434 NH2 ARG C 45 -6.070 -12.961 -8.548 1.00 0.00 N ATOM 0 H ARG C 45 2.010 -12.691 -6.739 1.00 0.00 H new ATOM 0 HA ARG C 45 0.153 -14.890 -6.576 1.00 0.00 H new ATOM 0 HB2 ARG C 45 -0.402 -12.497 -6.022 1.00 0.00 H new ATOM 0 HB3 ARG C 45 -0.136 -12.061 -7.699 1.00 0.00 H new ATOM 0 HG2 ARG C 45 -1.940 -13.615 -8.422 1.00 0.00 H new ATOM 0 HG3 ARG C 45 -2.171 -14.151 -6.769 1.00 0.00 H new ATOM 0 HD2 ARG C 45 -2.674 -11.726 -6.135 1.00 0.00 H new ATOM 0 HD3 ARG C 45 -2.623 -11.325 -7.840 1.00 0.00 H new ATOM 0 HE ARG C 45 -4.722 -12.893 -6.457 1.00 0.00 H new ATOM 0 HH11 ARG C 45 -3.234 -11.833 -9.454 1.00 0.00 H new ATOM 0 HH12 ARG C 45 -4.678 -12.140 -10.425 1.00 0.00 H new ATOM 0 HH21 ARG C 45 -6.563 -13.283 -7.715 1.00 0.00 H new ATOM 0 HH22 ARG C 45 -6.544 -12.953 -9.451 1.00 0.00 H new ATOM 1448 N LEU C 46 1.513 -14.150 -9.411 1.00 0.00 N ATOM 1449 CA LEU C 46 1.600 -14.543 -10.814 1.00 0.00 C ATOM 1450 C LEU C 46 1.705 -16.058 -10.948 1.00 0.00 C ATOM 1451 O LEU C 46 1.026 -16.663 -11.779 1.00 0.00 O ATOM 1452 CB LEU C 46 2.820 -13.873 -11.467 1.00 0.00 C ATOM 1453 CG LEU C 46 2.949 -14.295 -12.958 1.00 0.00 C ATOM 1454 CD1 LEU C 46 3.379 -13.094 -13.811 1.00 0.00 C ATOM 1455 CD2 LEU C 46 4.004 -15.407 -13.109 1.00 0.00 C ATOM 0 H LEU C 46 2.284 -13.571 -9.080 1.00 0.00 H new ATOM 0 HA LEU C 46 0.692 -14.217 -11.321 1.00 0.00 H new ATOM 0 HB2 LEU C 46 2.726 -12.789 -11.398 1.00 0.00 H new ATOM 0 HB3 LEU C 46 3.725 -14.149 -10.926 1.00 0.00 H new ATOM 0 HG LEU C 46 1.978 -14.660 -13.294 1.00 0.00 H new ATOM 0 HD11 LEU C 46 3.466 -13.401 -14.853 1.00 0.00 H new ATOM 0 HD12 LEU C 46 2.634 -12.303 -13.727 1.00 0.00 H new ATOM 0 HD13 LEU C 46 4.342 -12.724 -13.460 1.00 0.00 H new ATOM 0 HD21 LEU C 46 4.084 -15.693 -14.158 1.00 0.00 H new ATOM 0 HD22 LEU C 46 4.969 -15.043 -12.758 1.00 0.00 H new ATOM 0 HD23 LEU C 46 3.706 -16.274 -12.519 1.00 0.00 H new ATOM 1467 N PHE C 47 2.553 -16.667 -10.127 1.00 0.00 N ATOM 1468 CA PHE C 47 2.730 -18.113 -10.167 1.00 0.00 C ATOM 1469 C PHE C 47 1.445 -18.826 -9.758 1.00 0.00 C ATOM 1470 O PHE C 47 1.039 -19.801 -10.391 1.00 0.00 O ATOM 1471 CB PHE C 47 3.867 -18.530 -9.234 1.00 0.00 C ATOM 1472 CG PHE C 47 5.171 -17.984 -9.766 1.00 0.00 C ATOM 1473 CD1 PHE C 47 5.786 -18.590 -10.868 1.00 0.00 C ATOM 1474 CD2 PHE C 47 5.763 -16.868 -9.161 1.00 0.00 C ATOM 1475 CE1 PHE C 47 6.992 -18.081 -11.365 1.00 0.00 C ATOM 1476 CE2 PHE C 47 6.969 -16.360 -9.657 1.00 0.00 C ATOM 1477 CZ PHE C 47 7.584 -16.965 -10.759 1.00 0.00 C ATOM 0 H PHE C 47 3.124 -16.187 -9.432 1.00 0.00 H new ATOM 0 HA PHE C 47 2.978 -18.397 -11.189 1.00 0.00 H new ATOM 0 HB2 PHE C 47 3.685 -18.153 -8.228 1.00 0.00 H new ATOM 0 HB3 PHE C 47 3.916 -19.617 -9.163 1.00 0.00 H new ATOM 0 HD1 PHE C 47 5.330 -19.450 -11.335 1.00 0.00 H new ATOM 0 HD2 PHE C 47 5.289 -16.399 -8.311 1.00 0.00 H new ATOM 0 HE1 PHE C 47 7.466 -18.549 -12.215 1.00 0.00 H new ATOM 0 HE2 PHE C 47 7.425 -15.500 -9.189 1.00 0.00 H new ATOM 0 HZ PHE C 47 8.514 -16.572 -11.142 1.00 0.00 H new ATOM 1487 N PHE C 48 0.811 -18.337 -8.691 1.00 0.00 N ATOM 1488 CA PHE C 48 -0.431 -18.937 -8.194 1.00 0.00 C ATOM 1489 C PHE C 48 -1.574 -17.929 -8.262 1.00 0.00 C ATOM 1490 O PHE C 48 -1.477 -16.830 -7.717 1.00 0.00 O ATOM 1491 CB PHE C 48 -0.230 -19.386 -6.743 1.00 0.00 C ATOM 1492 CG PHE C 48 1.139 -20.019 -6.593 1.00 0.00 C ATOM 1493 CD1 PHE C 48 1.547 -21.041 -7.462 1.00 0.00 C ATOM 1494 CD2 PHE C 48 2.005 -19.577 -5.582 1.00 0.00 C ATOM 1495 CE1 PHE C 48 2.816 -21.618 -7.320 1.00 0.00 C ATOM 1496 CE2 PHE C 48 3.273 -20.156 -5.441 1.00 0.00 C ATOM 1497 CZ PHE C 48 3.677 -21.176 -6.308 1.00 0.00 C ATOM 0 H PHE C 48 1.134 -17.531 -8.156 1.00 0.00 H new ATOM 0 HA PHE C 48 -0.684 -19.795 -8.816 1.00 0.00 H new ATOM 0 HB2 PHE C 48 -0.323 -18.533 -6.071 1.00 0.00 H new ATOM 0 HB3 PHE C 48 -1.005 -20.099 -6.462 1.00 0.00 H new ATOM 0 HD1 PHE C 48 0.883 -21.384 -8.241 1.00 0.00 H new ATOM 0 HD2 PHE C 48 1.694 -18.790 -4.912 1.00 0.00 H new ATOM 0 HE1 PHE C 48 3.130 -22.404 -7.991 1.00 0.00 H new ATOM 0 HE2 PHE C 48 3.939 -19.814 -4.662 1.00 0.00 H new ATOM 0 HZ PHE C 48 4.654 -21.623 -6.197 1.00 0.00 H new ATOM 1507 N LYS C 49 -2.656 -18.312 -8.933 1.00 0.00 N ATOM 1508 CA LYS C 49 -3.817 -17.433 -9.064 1.00 0.00 C ATOM 1509 C LYS C 49 -4.758 -17.605 -7.876 1.00 0.00 C ATOM 1510 O LYS C 49 -4.793 -16.720 -7.039 1.00 0.00 O ATOM 1511 CB LYS C 49 -4.564 -17.750 -10.359 1.00 0.00 C ATOM 1512 CG LYS C 49 -3.684 -17.387 -11.556 1.00 0.00 C ATOM 1513 CD LYS C 49 -4.434 -17.692 -12.853 1.00 0.00 C ATOM 1514 CE LYS C 49 -3.553 -17.331 -14.051 1.00 0.00 C ATOM 1515 NZ LYS C 49 -4.289 -17.619 -15.313 1.00 0.00 N ATOM 1516 OXT LYS C 49 -5.429 -18.624 -7.819 1.00 0.00 O ATOM 0 H LYS C 49 -2.755 -19.218 -9.392 1.00 0.00 H new ATOM 0 HA LYS C 49 -3.468 -16.401 -9.088 1.00 0.00 H new ATOM 0 HB2 LYS C 49 -4.823 -18.808 -10.392 1.00 0.00 H new ATOM 0 HB3 LYS C 49 -5.499 -17.191 -10.398 1.00 0.00 H new ATOM 0 HG2 LYS C 49 -3.417 -16.331 -11.518 1.00 0.00 H new ATOM 0 HG3 LYS C 49 -2.753 -17.952 -11.521 1.00 0.00 H new ATOM 0 HD2 LYS C 49 -4.702 -18.748 -12.891 1.00 0.00 H new ATOM 0 HD3 LYS C 49 -5.365 -17.126 -12.889 1.00 0.00 H new ATOM 0 HE2 LYS C 49 -3.279 -16.277 -14.010 1.00 0.00 H new ATOM 0 HE3 LYS C 49 -2.626 -17.903 -14.020 1.00 0.00 H new ATOM 0 HZ1 LYS C 49 -3.691 -17.374 -16.128 1.00 0.00 H new ATOM 0 HZ2 LYS C 49 -4.529 -18.630 -15.352 1.00 0.00 H new ATOM 0 HZ3 LYS C 49 -5.162 -17.054 -15.342 1.00 0.00 H new TER 1530 LYS C 49 ATOM 1531 N SER D 19 5.553 23.411 1.239 1.00 0.00 N ATOM 1532 CA SER D 19 5.418 22.444 2.363 1.00 0.00 C ATOM 1533 C SER D 19 5.787 23.132 3.675 1.00 0.00 C ATOM 1534 O SER D 19 6.860 23.723 3.796 1.00 0.00 O ATOM 1535 CB SER D 19 6.348 21.253 2.122 1.00 0.00 C ATOM 1536 OG SER D 19 6.557 20.563 3.348 1.00 0.00 O ATOM 0 HA SER D 19 4.388 22.092 2.421 1.00 0.00 H new ATOM 0 HB2 SER D 19 5.912 20.581 1.383 1.00 0.00 H new ATOM 0 HB3 SER D 19 7.300 21.597 1.718 1.00 0.00 H new ATOM 0 HG SER D 19 7.151 19.799 3.196 1.00 0.00 H new ATOM 1544 N ASN D 20 4.889 23.051 4.652 1.00 0.00 N ATOM 1545 CA ASN D 20 5.128 23.668 5.952 1.00 0.00 C ATOM 1546 C ASN D 20 6.058 22.802 6.795 1.00 0.00 C ATOM 1547 O ASN D 20 6.279 21.630 6.490 1.00 0.00 O ATOM 1548 CB ASN D 20 3.803 23.867 6.690 1.00 0.00 C ATOM 1549 CG ASN D 20 3.010 24.998 6.045 1.00 0.00 C ATOM 1550 OD1 ASN D 20 3.569 25.799 5.294 1.00 0.00 O ATOM 1551 ND2 ASN D 20 1.734 25.115 6.293 1.00 0.00 N ATOM 0 H ASN D 20 3.995 22.567 4.569 1.00 0.00 H new ATOM 0 HA ASN D 20 5.601 24.637 5.790 1.00 0.00 H new ATOM 0 HB2 ASN D 20 3.222 22.945 6.666 1.00 0.00 H new ATOM 0 HB3 ASN D 20 3.993 24.097 7.738 1.00 0.00 H new ATOM 0 HD21 ASN D 20 1.198 25.870 5.865 1.00 0.00 H new ATOM 0 HD22 ASN D 20 1.272 24.451 6.915 1.00 0.00 H new ATOM 1558 N ASP D 21 6.604 23.388 7.857 1.00 0.00 N ATOM 1559 CA ASP D 21 7.512 22.661 8.737 1.00 0.00 C ATOM 1560 C ASP D 21 6.798 21.477 9.380 1.00 0.00 C ATOM 1561 O ASP D 21 7.365 20.391 9.506 1.00 0.00 O ATOM 1562 CB ASP D 21 8.036 23.596 9.829 1.00 0.00 C ATOM 1563 CG ASP D 21 9.002 22.844 10.738 1.00 0.00 C ATOM 1564 OD1 ASP D 21 9.140 21.644 10.560 1.00 0.00 O ATOM 1565 OD2 ASP D 21 9.591 23.478 11.598 1.00 0.00 O ATOM 0 H ASP D 21 6.435 24.357 8.127 1.00 0.00 H new ATOM 0 HA ASP D 21 8.347 22.289 8.143 1.00 0.00 H new ATOM 0 HB2 ASP D 21 8.539 24.451 9.377 1.00 0.00 H new ATOM 0 HB3 ASP D 21 7.204 23.988 10.414 1.00 0.00 H new ATOM 1570 N SER D 22 5.552 21.694 9.785 1.00 0.00 N ATOM 1571 CA SER D 22 4.768 20.634 10.408 1.00 0.00 C ATOM 1572 C SER D 22 4.576 19.474 9.439 1.00 0.00 C ATOM 1573 O SER D 22 4.670 18.308 9.825 1.00 0.00 O ATOM 1574 CB SER D 22 3.403 21.177 10.838 1.00 0.00 C ATOM 1575 OG SER D 22 2.670 20.144 11.482 1.00 0.00 O ATOM 0 H SER D 22 5.066 22.586 9.694 1.00 0.00 H new ATOM 0 HA SER D 22 5.306 20.275 11.285 1.00 0.00 H new ATOM 0 HB2 SER D 22 3.531 22.023 11.513 1.00 0.00 H new ATOM 0 HB3 SER D 22 2.854 21.542 9.970 1.00 0.00 H new ATOM 0 HG SER D 22 1.796 20.488 11.760 1.00 0.00 H new ATOM 1581 N SER D 23 4.302 19.799 8.181 1.00 0.00 N ATOM 1582 CA SER D 23 4.090 18.778 7.164 1.00 0.00 C ATOM 1583 C SER D 23 2.849 17.960 7.499 1.00 0.00 C ATOM 1584 O SER D 23 2.695 17.488 8.624 1.00 0.00 O ATOM 1585 CB SER D 23 5.313 17.854 7.087 1.00 0.00 C ATOM 1586 OG SER D 23 5.130 16.757 7.971 1.00 0.00 O ATOM 0 H SER D 23 4.222 20.758 7.842 1.00 0.00 H new ATOM 0 HA SER D 23 3.948 19.265 6.199 1.00 0.00 H new ATOM 0 HB2 SER D 23 5.448 17.495 6.067 1.00 0.00 H new ATOM 0 HB3 SER D 23 6.216 18.404 7.353 1.00 0.00 H new ATOM 0 HG SER D 23 4.539 17.024 8.706 1.00 0.00 H new ATOM 1592 N ASP D 24 1.963 17.803 6.518 1.00 0.00 N ATOM 1593 CA ASP D 24 0.729 17.048 6.724 1.00 0.00 C ATOM 1594 C ASP D 24 1.020 15.745 7.491 1.00 0.00 C ATOM 1595 O ASP D 24 1.577 14.809 6.919 1.00 0.00 O ATOM 1596 CB ASP D 24 0.107 16.713 5.365 1.00 0.00 C ATOM 1597 CG ASP D 24 -0.455 17.982 4.728 1.00 0.00 C ATOM 1598 OD1 ASP D 24 -1.455 18.476 5.223 1.00 0.00 O ATOM 1599 OD2 ASP D 24 0.122 18.440 3.755 1.00 0.00 O ATOM 0 H ASP D 24 2.075 18.185 5.579 1.00 0.00 H new ATOM 0 HA ASP D 24 0.037 17.653 7.309 1.00 0.00 H new ATOM 0 HB2 ASP D 24 0.857 16.268 4.711 1.00 0.00 H new ATOM 0 HB3 ASP D 24 -0.686 15.975 5.489 1.00 0.00 H new ATOM 1604 N PRO D 25 0.667 15.651 8.763 1.00 0.00 N ATOM 1605 CA PRO D 25 0.925 14.414 9.570 1.00 0.00 C ATOM 1606 C PRO D 25 0.424 13.146 8.875 1.00 0.00 C ATOM 1607 O PRO D 25 1.024 12.080 9.002 1.00 0.00 O ATOM 1608 CB PRO D 25 0.148 14.659 10.877 1.00 0.00 C ATOM 1609 CG PRO D 25 0.059 16.144 11.006 1.00 0.00 C ATOM 1610 CD PRO D 25 0.002 16.694 9.578 1.00 0.00 C ATOM 0 HA PRO D 25 1.992 14.249 9.723 1.00 0.00 H new ATOM 0 HB2 PRO D 25 -0.843 14.207 10.837 1.00 0.00 H new ATOM 0 HB3 PRO D 25 0.664 14.220 11.731 1.00 0.00 H new ATOM 0 HG2 PRO D 25 -0.828 16.433 11.570 1.00 0.00 H new ATOM 0 HG3 PRO D 25 0.921 16.541 11.542 1.00 0.00 H new ATOM 0 HD2 PRO D 25 -1.026 16.858 9.254 1.00 0.00 H new ATOM 0 HD3 PRO D 25 0.517 17.651 9.498 1.00 0.00 H new ATOM 1618 N LEU D 26 -0.681 13.271 8.154 1.00 0.00 N ATOM 1619 CA LEU D 26 -1.260 12.127 7.459 1.00 0.00 C ATOM 1620 C LEU D 26 -0.285 11.581 6.419 1.00 0.00 C ATOM 1621 O LEU D 26 -0.137 10.367 6.275 1.00 0.00 O ATOM 1622 CB LEU D 26 -2.560 12.548 6.769 1.00 0.00 C ATOM 1623 CG LEU D 26 -3.628 12.886 7.822 1.00 0.00 C ATOM 1624 CD1 LEU D 26 -4.814 13.564 7.127 1.00 0.00 C ATOM 1625 CD2 LEU D 26 -4.113 11.608 8.538 1.00 0.00 C ATOM 0 H LEU D 26 -1.192 14.145 8.034 1.00 0.00 H new ATOM 0 HA LEU D 26 -1.468 11.345 8.189 1.00 0.00 H new ATOM 0 HB2 LEU D 26 -2.379 13.413 6.131 1.00 0.00 H new ATOM 0 HB3 LEU D 26 -2.915 11.745 6.123 1.00 0.00 H new ATOM 0 HG LEU D 26 -3.194 13.554 8.566 1.00 0.00 H new ATOM 0 HD11 LEU D 26 -5.578 13.808 7.866 1.00 0.00 H new ATOM 0 HD12 LEU D 26 -4.476 14.478 6.639 1.00 0.00 H new ATOM 0 HD13 LEU D 26 -5.233 12.889 6.381 1.00 0.00 H new ATOM 0 HD21 LEU D 26 -4.868 11.870 9.279 1.00 0.00 H new ATOM 0 HD22 LEU D 26 -4.544 10.923 7.808 1.00 0.00 H new ATOM 0 HD23 LEU D 26 -3.270 11.127 9.034 1.00 0.00 H new ATOM 1637 N VAL D 27 0.377 12.481 5.701 1.00 0.00 N ATOM 1638 CA VAL D 27 1.336 12.069 4.682 1.00 0.00 C ATOM 1639 C VAL D 27 2.488 11.292 5.316 1.00 0.00 C ATOM 1640 O VAL D 27 2.895 10.244 4.814 1.00 0.00 O ATOM 1641 CB VAL D 27 1.882 13.301 3.951 1.00 0.00 C ATOM 1642 CG1 VAL D 27 2.993 12.879 2.987 1.00 0.00 C ATOM 1643 CG2 VAL D 27 0.749 13.964 3.166 1.00 0.00 C ATOM 0 H VAL D 27 0.270 13.490 5.803 1.00 0.00 H new ATOM 0 HA VAL D 27 0.828 11.421 3.968 1.00 0.00 H new ATOM 0 HB VAL D 27 2.286 14.005 4.678 1.00 0.00 H new ATOM 0 HG11 VAL D 27 3.379 13.757 2.469 1.00 0.00 H new ATOM 0 HG12 VAL D 27 3.799 12.404 3.546 1.00 0.00 H new ATOM 0 HG13 VAL D 27 2.594 12.174 2.258 1.00 0.00 H new ATOM 0 HG21 VAL D 27 1.132 14.841 2.644 1.00 0.00 H new ATOM 0 HG22 VAL D 27 0.347 13.257 2.440 1.00 0.00 H new ATOM 0 HG23 VAL D 27 -0.041 14.267 3.853 1.00 0.00 H new ATOM 1653 N VAL D 28 3.005 11.812 6.425 1.00 0.00 N ATOM 1654 CA VAL D 28 4.106 11.159 7.123 1.00 0.00 C ATOM 1655 C VAL D 28 3.676 9.786 7.633 1.00 0.00 C ATOM 1656 O VAL D 28 4.403 8.804 7.484 1.00 0.00 O ATOM 1657 CB VAL D 28 4.565 12.027 8.298 1.00 0.00 C ATOM 1658 CG1 VAL D 28 5.620 11.276 9.115 1.00 0.00 C ATOM 1659 CG2 VAL D 28 5.167 13.329 7.765 1.00 0.00 C ATOM 0 H VAL D 28 2.682 12.678 6.857 1.00 0.00 H new ATOM 0 HA VAL D 28 4.933 11.030 6.425 1.00 0.00 H new ATOM 0 HB VAL D 28 3.709 12.253 8.934 1.00 0.00 H new ATOM 0 HG11 VAL D 28 5.944 11.897 9.950 1.00 0.00 H new ATOM 0 HG12 VAL D 28 5.192 10.349 9.497 1.00 0.00 H new ATOM 0 HG13 VAL D 28 6.476 11.046 8.480 1.00 0.00 H new ATOM 0 HG21 VAL D 28 5.494 13.948 8.601 1.00 0.00 H new ATOM 0 HG22 VAL D 28 6.021 13.101 7.127 1.00 0.00 H new ATOM 0 HG23 VAL D 28 4.416 13.867 7.187 1.00 0.00 H new ATOM 1669 N ALA D 29 2.493 9.725 8.237 1.00 0.00 N ATOM 1670 CA ALA D 29 1.979 8.468 8.767 1.00 0.00 C ATOM 1671 C ALA D 29 1.751 7.464 7.643 1.00 0.00 C ATOM 1672 O ALA D 29 1.998 6.271 7.804 1.00 0.00 O ATOM 1673 CB ALA D 29 0.662 8.705 9.507 1.00 0.00 C ATOM 0 H ALA D 29 1.876 10.526 8.371 1.00 0.00 H new ATOM 0 HA ALA D 29 2.718 8.065 9.460 1.00 0.00 H new ATOM 0 HB1 ALA D 29 0.289 7.758 9.898 1.00 0.00 H new ATOM 0 HB2 ALA D 29 0.828 9.398 10.332 1.00 0.00 H new ATOM 0 HB3 ALA D 29 -0.071 9.128 8.820 1.00 0.00 H new ATOM 1679 N ALA D 30 1.275 7.952 6.504 1.00 0.00 N ATOM 1680 CA ALA D 30 1.012 7.081 5.367 1.00 0.00 C ATOM 1681 C ALA D 30 2.272 6.323 4.964 1.00 0.00 C ATOM 1682 O ALA D 30 2.230 5.116 4.729 1.00 0.00 O ATOM 1683 CB ALA D 30 0.511 7.906 4.183 1.00 0.00 C ATOM 0 H ALA D 30 1.065 8.937 6.344 1.00 0.00 H new ATOM 0 HA ALA D 30 0.248 6.360 5.658 1.00 0.00 H new ATOM 0 HB1 ALA D 30 0.317 7.247 3.337 1.00 0.00 H new ATOM 0 HB2 ALA D 30 -0.409 8.420 4.461 1.00 0.00 H new ATOM 0 HB3 ALA D 30 1.267 8.640 3.905 1.00 0.00 H new ATOM 1689 N ASN D 31 3.391 7.034 4.891 1.00 0.00 N ATOM 1690 CA ASN D 31 4.654 6.406 4.517 1.00 0.00 C ATOM 1691 C ASN D 31 5.059 5.363 5.555 1.00 0.00 C ATOM 1692 O ASN D 31 5.507 4.269 5.206 1.00 0.00 O ATOM 1693 CB ASN D 31 5.749 7.468 4.403 1.00 0.00 C ATOM 1694 CG ASN D 31 7.080 6.808 4.068 1.00 0.00 C ATOM 1695 OD1 ASN D 31 7.273 6.317 2.876 1.00 0.00 O flip ATOM 1696 ND2 ASN D 31 7.971 6.737 4.917 1.00 0.00 N flip ATOM 0 H ASN D 31 3.451 8.034 5.083 1.00 0.00 H new ATOM 0 HA ASN D 31 4.525 5.913 3.554 1.00 0.00 H new ATOM 0 HB2 ASN D 31 5.487 8.191 3.630 1.00 0.00 H new ATOM 0 HB3 ASN D 31 5.832 8.019 5.340 1.00 0.00 H new ATOM 0 HD21 ASN D 31 7.819 7.122 5.849 1.00 0.00 H new ATOM 0 HD22 ASN D 31 8.860 6.294 4.687 1.00 0.00 H new ATOM 1703 N ILE D 32 4.897 5.708 6.828 1.00 0.00 N ATOM 1704 CA ILE D 32 5.246 4.795 7.912 1.00 0.00 C ATOM 1705 C ILE D 32 4.344 3.563 7.885 1.00 0.00 C ATOM 1706 O ILE D 32 4.806 2.437 8.069 1.00 0.00 O ATOM 1707 CB ILE D 32 5.111 5.508 9.262 1.00 0.00 C ATOM 1708 CG1 ILE D 32 6.177 6.602 9.363 1.00 0.00 C ATOM 1709 CG2 ILE D 32 5.312 4.501 10.397 1.00 0.00 C ATOM 1710 CD1 ILE D 32 5.883 7.490 10.573 1.00 0.00 C ATOM 0 H ILE D 32 4.528 6.608 7.134 1.00 0.00 H new ATOM 0 HA ILE D 32 6.279 4.475 7.776 1.00 0.00 H new ATOM 0 HB ILE D 32 4.118 5.951 9.341 1.00 0.00 H new ATOM 0 HG12 ILE D 32 7.166 6.153 9.459 1.00 0.00 H new ATOM 0 HG13 ILE D 32 6.186 7.201 8.452 1.00 0.00 H new ATOM 0 HG21 ILE D 32 5.216 5.010 11.356 1.00 0.00 H new ATOM 0 HG22 ILE D 32 4.559 3.717 10.325 1.00 0.00 H new ATOM 0 HG23 ILE D 32 6.305 4.058 10.319 1.00 0.00 H new ATOM 0 HD11 ILE D 32 6.642 8.269 10.645 1.00 0.00 H new ATOM 0 HD12 ILE D 32 4.901 7.949 10.457 1.00 0.00 H new ATOM 0 HD13 ILE D 32 5.896 6.885 11.480 1.00 0.00 H new ATOM 1722 N ILE D 33 3.054 3.789 7.667 1.00 0.00 N ATOM 1723 CA ILE D 33 2.088 2.696 7.634 1.00 0.00 C ATOM 1724 C ILE D 33 2.410 1.733 6.489 1.00 0.00 C ATOM 1725 O ILE D 33 2.371 0.516 6.664 1.00 0.00 O ATOM 1726 CB ILE D 33 0.672 3.266 7.452 1.00 0.00 C ATOM 1727 CG1 ILE D 33 0.249 4.067 8.710 1.00 0.00 C ATOM 1728 CG2 ILE D 33 -0.319 2.120 7.202 1.00 0.00 C ATOM 1729 CD1 ILE D 33 -0.349 3.146 9.785 1.00 0.00 C ATOM 0 H ILE D 33 2.653 4.714 7.511 1.00 0.00 H new ATOM 0 HA ILE D 33 2.142 2.149 8.575 1.00 0.00 H new ATOM 0 HB ILE D 33 0.669 3.938 6.594 1.00 0.00 H new ATOM 0 HG12 ILE D 33 1.114 4.591 9.117 1.00 0.00 H new ATOM 0 HG13 ILE D 33 -0.482 4.826 8.431 1.00 0.00 H new ATOM 0 HG21 ILE D 33 -1.322 2.528 7.073 1.00 0.00 H new ATOM 0 HG22 ILE D 33 -0.029 1.578 6.302 1.00 0.00 H new ATOM 0 HG23 ILE D 33 -0.310 1.439 8.053 1.00 0.00 H new ATOM 0 HD11 ILE D 33 -0.635 3.739 10.654 1.00 0.00 H new ATOM 0 HD12 ILE D 33 -1.228 2.642 9.384 1.00 0.00 H new ATOM 0 HD13 ILE D 33 0.392 2.403 10.081 1.00 0.00 H new ATOM 1741 N GLY D 34 2.724 2.283 5.320 1.00 0.00 N ATOM 1742 CA GLY D 34 3.048 1.454 4.162 1.00 0.00 C ATOM 1743 C GLY D 34 4.303 0.625 4.418 1.00 0.00 C ATOM 1744 O GLY D 34 4.338 -0.574 4.133 1.00 0.00 O ATOM 0 H GLY D 34 2.761 3.288 5.149 1.00 0.00 H new ATOM 0 HA2 GLY D 34 2.211 0.793 3.937 1.00 0.00 H new ATOM 0 HA3 GLY D 34 3.198 2.087 3.287 1.00 0.00 H new ATOM 1748 N ILE D 35 5.330 1.268 4.963 1.00 0.00 N ATOM 1749 CA ILE D 35 6.583 0.583 5.260 1.00 0.00 C ATOM 1750 C ILE D 35 6.363 -0.493 6.322 1.00 0.00 C ATOM 1751 O ILE D 35 6.888 -1.602 6.218 1.00 0.00 O ATOM 1752 CB ILE D 35 7.631 1.590 5.745 1.00 0.00 C ATOM 1753 CG1 ILE D 35 8.004 2.528 4.595 1.00 0.00 C ATOM 1754 CG2 ILE D 35 8.884 0.844 6.213 1.00 0.00 C ATOM 1755 CD1 ILE D 35 8.827 3.698 5.137 1.00 0.00 C ATOM 0 H ILE D 35 5.320 2.258 5.207 1.00 0.00 H new ATOM 0 HA ILE D 35 6.943 0.106 4.348 1.00 0.00 H new ATOM 0 HB ILE D 35 7.220 2.167 6.573 1.00 0.00 H new ATOM 0 HG12 ILE D 35 8.575 1.987 3.841 1.00 0.00 H new ATOM 0 HG13 ILE D 35 7.103 2.899 4.107 1.00 0.00 H new ATOM 0 HG21 ILE D 35 9.628 1.562 6.557 1.00 0.00 H new ATOM 0 HG22 ILE D 35 8.623 0.172 7.030 1.00 0.00 H new ATOM 0 HG23 ILE D 35 9.294 0.266 5.385 1.00 0.00 H new ATOM 0 HD11 ILE D 35 9.093 4.366 4.318 1.00 0.00 H new ATOM 0 HD12 ILE D 35 8.240 4.244 5.875 1.00 0.00 H new ATOM 0 HD13 ILE D 35 9.735 3.318 5.605 1.00 0.00 H new ATOM 1767 N LEU D 36 5.589 -0.153 7.350 1.00 0.00 N ATOM 1768 CA LEU D 36 5.312 -1.094 8.432 1.00 0.00 C ATOM 1769 C LEU D 36 4.609 -2.332 7.888 1.00 0.00 C ATOM 1770 O LEU D 36 4.917 -3.456 8.281 1.00 0.00 O ATOM 1771 CB LEU D 36 4.434 -0.430 9.497 1.00 0.00 C ATOM 1772 CG LEU D 36 4.130 -1.415 10.640 1.00 0.00 C ATOM 1773 CD1 LEU D 36 5.437 -1.897 11.291 1.00 0.00 C ATOM 1774 CD2 LEU D 36 3.263 -0.708 11.686 1.00 0.00 C ATOM 0 H LEU D 36 5.146 0.759 7.456 1.00 0.00 H new ATOM 0 HA LEU D 36 6.259 -1.392 8.883 1.00 0.00 H new ATOM 0 HB2 LEU D 36 4.938 0.451 9.894 1.00 0.00 H new ATOM 0 HB3 LEU D 36 3.502 -0.089 9.046 1.00 0.00 H new ATOM 0 HG LEU D 36 3.601 -2.280 10.241 1.00 0.00 H new ATOM 0 HD11 LEU D 36 5.207 -2.593 12.098 1.00 0.00 H new ATOM 0 HD12 LEU D 36 6.052 -2.398 10.544 1.00 0.00 H new ATOM 0 HD13 LEU D 36 5.980 -1.042 11.694 1.00 0.00 H new ATOM 0 HD21 LEU D 36 3.041 -1.397 12.501 1.00 0.00 H new ATOM 0 HD22 LEU D 36 3.798 0.157 12.078 1.00 0.00 H new ATOM 0 HD23 LEU D 36 2.331 -0.380 11.225 1.00 0.00 H new ATOM 1786 N HIS D 37 3.664 -2.117 6.981 1.00 0.00 N ATOM 1787 CA HIS D 37 2.929 -3.225 6.393 1.00 0.00 C ATOM 1788 C HIS D 37 3.889 -4.185 5.705 1.00 0.00 C ATOM 1789 O HIS D 37 3.736 -5.402 5.797 1.00 0.00 O ATOM 1790 CB HIS D 37 1.916 -2.703 5.373 1.00 0.00 C ATOM 1791 CG HIS D 37 1.143 -3.862 4.815 1.00 0.00 C ATOM 1792 ND1 HIS D 37 -0.223 -3.995 4.987 1.00 0.00 N ATOM 1793 CD2 HIS D 37 1.534 -4.961 4.095 1.00 0.00 C ATOM 1794 CE1 HIS D 37 -0.597 -5.135 4.382 1.00 0.00 C ATOM 1795 NE2 HIS D 37 0.435 -5.762 3.822 1.00 0.00 N ATOM 0 H HIS D 37 3.392 -1.195 6.641 1.00 0.00 H new ATOM 0 HA HIS D 37 2.401 -3.751 7.188 1.00 0.00 H new ATOM 0 HB2 HIS D 37 1.239 -1.991 5.845 1.00 0.00 H new ATOM 0 HB3 HIS D 37 2.429 -2.171 4.571 1.00 0.00 H new ATOM 0 HD2 HIS D 37 2.547 -5.172 3.786 1.00 0.00 H new ATOM 0 HE1 HIS D 37 -1.613 -5.499 4.354 1.00 0.00 H new ATOM 0 HE2 HIS D 37 0.421 -6.641 3.304 1.00 0.00 H new ATOM 1803 N LEU D 38 4.876 -3.629 5.015 1.00 0.00 N ATOM 1804 CA LEU D 38 5.857 -4.446 4.308 1.00 0.00 C ATOM 1805 C LEU D 38 6.619 -5.343 5.275 1.00 0.00 C ATOM 1806 O LEU D 38 6.908 -6.490 4.953 1.00 0.00 O ATOM 1807 CB LEU D 38 6.840 -3.539 3.538 1.00 0.00 C ATOM 1808 CG LEU D 38 6.297 -3.249 2.120 1.00 0.00 C ATOM 1809 CD1 LEU D 38 6.898 -1.950 1.583 1.00 0.00 C ATOM 1810 CD2 LEU D 38 6.669 -4.403 1.174 1.00 0.00 C ATOM 0 H LEU D 38 5.019 -2.623 4.929 1.00 0.00 H new ATOM 0 HA LEU D 38 5.327 -5.083 3.600 1.00 0.00 H new ATOM 0 HB2 LEU D 38 6.984 -2.604 4.079 1.00 0.00 H new ATOM 0 HB3 LEU D 38 7.815 -4.021 3.471 1.00 0.00 H new ATOM 0 HG LEU D 38 5.213 -3.152 2.174 1.00 0.00 H new ATOM 0 HD11 LEU D 38 6.509 -1.755 0.584 1.00 0.00 H new ATOM 0 HD12 LEU D 38 6.631 -1.125 2.244 1.00 0.00 H new ATOM 0 HD13 LEU D 38 7.983 -2.042 1.538 1.00 0.00 H new ATOM 0 HD21 LEU D 38 6.284 -4.194 0.176 1.00 0.00 H new ATOM 0 HD22 LEU D 38 7.754 -4.503 1.131 1.00 0.00 H new ATOM 0 HD23 LEU D 38 6.233 -5.331 1.544 1.00 0.00 H new ATOM 1822 N ILE D 39 6.950 -4.823 6.443 1.00 0.00 N ATOM 1823 CA ILE D 39 7.689 -5.612 7.420 1.00 0.00 C ATOM 1824 C ILE D 39 6.873 -6.835 7.841 1.00 0.00 C ATOM 1825 O ILE D 39 7.399 -7.940 7.941 1.00 0.00 O ATOM 1826 CB ILE D 39 8.002 -4.752 8.646 1.00 0.00 C ATOM 1827 CG1 ILE D 39 8.994 -3.653 8.245 1.00 0.00 C ATOM 1828 CG2 ILE D 39 8.626 -5.623 9.743 1.00 0.00 C ATOM 1829 CD1 ILE D 39 9.140 -2.641 9.384 1.00 0.00 C ATOM 0 H ILE D 39 6.725 -3.873 6.738 1.00 0.00 H new ATOM 0 HA ILE D 39 8.621 -5.951 6.967 1.00 0.00 H new ATOM 0 HB ILE D 39 7.082 -4.304 9.022 1.00 0.00 H new ATOM 0 HG12 ILE D 39 9.963 -4.094 8.012 1.00 0.00 H new ATOM 0 HG13 ILE D 39 8.647 -3.150 7.342 1.00 0.00 H new ATOM 0 HG21 ILE D 39 8.848 -5.007 10.615 1.00 0.00 H new ATOM 0 HG22 ILE D 39 7.927 -6.411 10.024 1.00 0.00 H new ATOM 0 HG23 ILE D 39 9.548 -6.071 9.372 1.00 0.00 H new ATOM 0 HD11 ILE D 39 9.846 -1.864 9.092 1.00 0.00 H new ATOM 0 HD12 ILE D 39 8.171 -2.190 9.596 1.00 0.00 H new ATOM 0 HD13 ILE D 39 9.507 -3.148 10.276 1.00 0.00 H new ATOM 1841 N LEU D 40 5.590 -6.633 8.091 1.00 0.00 N ATOM 1842 CA LEU D 40 4.728 -7.737 8.496 1.00 0.00 C ATOM 1843 C LEU D 40 4.414 -8.660 7.314 1.00 0.00 C ATOM 1844 O LEU D 40 4.437 -9.882 7.446 1.00 0.00 O ATOM 1845 CB LEU D 40 3.434 -7.185 9.086 1.00 0.00 C ATOM 1846 CG LEU D 40 3.770 -6.141 10.158 1.00 0.00 C ATOM 1847 CD1 LEU D 40 2.472 -5.580 10.739 1.00 0.00 C ATOM 1848 CD2 LEU D 40 4.605 -6.788 11.278 1.00 0.00 C ATOM 0 H LEU D 40 5.124 -5.728 8.023 1.00 0.00 H new ATOM 0 HA LEU D 40 5.253 -8.324 9.249 1.00 0.00 H new ATOM 0 HB2 LEU D 40 2.826 -6.734 8.301 1.00 0.00 H new ATOM 0 HB3 LEU D 40 2.845 -7.993 9.521 1.00 0.00 H new ATOM 0 HG LEU D 40 4.348 -5.334 9.709 1.00 0.00 H new ATOM 0 HD11 LEU D 40 2.706 -4.837 11.502 1.00 0.00 H new ATOM 0 HD12 LEU D 40 1.890 -5.113 9.945 1.00 0.00 H new ATOM 0 HD13 LEU D 40 1.894 -6.389 11.186 1.00 0.00 H new ATOM 0 HD21 LEU D 40 4.840 -6.040 12.035 1.00 0.00 H new ATOM 0 HD22 LEU D 40 4.037 -7.599 11.733 1.00 0.00 H new ATOM 0 HD23 LEU D 40 5.531 -7.183 10.860 1.00 0.00 H new ATOM 1860 N TRP D 41 4.106 -8.062 6.163 1.00 0.00 N ATOM 1861 CA TRP D 41 3.769 -8.836 4.965 1.00 0.00 C ATOM 1862 C TRP D 41 4.979 -9.598 4.419 1.00 0.00 C ATOM 1863 O TRP D 41 4.863 -10.767 4.045 1.00 0.00 O ATOM 1864 CB TRP D 41 3.203 -7.901 3.888 1.00 0.00 C ATOM 1865 CG TRP D 41 3.026 -8.643 2.596 1.00 0.00 C ATOM 1866 CD1 TRP D 41 1.948 -9.395 2.267 1.00 0.00 C ATOM 1867 CD2 TRP D 41 3.911 -8.680 1.443 1.00 0.00 C ATOM 1868 NE1 TRP D 41 2.134 -9.913 0.998 1.00 0.00 N ATOM 1869 CE2 TRP D 41 3.327 -9.492 0.447 1.00 0.00 C ATOM 1870 CE3 TRP D 41 5.160 -8.092 1.169 1.00 0.00 C ATOM 1871 CZ2 TRP D 41 3.956 -9.715 -0.773 1.00 0.00 C ATOM 1872 CZ3 TRP D 41 5.792 -8.312 -0.064 1.00 0.00 C ATOM 1873 CH2 TRP D 41 5.190 -9.119 -1.031 1.00 0.00 C ATOM 0 H TRP D 41 4.082 -7.051 6.033 1.00 0.00 H new ATOM 0 HA TRP D 41 3.017 -9.574 5.243 1.00 0.00 H new ATOM 0 HB2 TRP D 41 2.246 -7.494 4.216 1.00 0.00 H new ATOM 0 HB3 TRP D 41 3.875 -7.056 3.741 1.00 0.00 H new ATOM 0 HD1 TRP D 41 1.084 -9.563 2.893 1.00 0.00 H new ATOM 0 HE1 TRP D 41 1.471 -10.530 0.528 1.00 0.00 H new ATOM 0 HE3 TRP D 41 5.634 -7.468 1.912 1.00 0.00 H new ATOM 0 HZ2 TRP D 41 3.492 -10.346 -1.516 1.00 0.00 H new ATOM 0 HZ3 TRP D 41 6.749 -7.855 -0.266 1.00 0.00 H new ATOM 0 HH2 TRP D 41 5.680 -9.282 -1.979 1.00 0.00 H new ATOM 1884 N ILE D 42 6.129 -8.936 4.358 1.00 0.00 N ATOM 1885 CA ILE D 42 7.335 -9.575 3.840 1.00 0.00 C ATOM 1886 C ILE D 42 7.750 -10.737 4.738 1.00 0.00 C ATOM 1887 O ILE D 42 8.165 -11.790 4.252 1.00 0.00 O ATOM 1888 CB ILE D 42 8.477 -8.546 3.744 1.00 0.00 C ATOM 1889 CG1 ILE D 42 9.626 -9.116 2.893 1.00 0.00 C ATOM 1890 CG2 ILE D 42 9.009 -8.215 5.146 1.00 0.00 C ATOM 1891 CD1 ILE D 42 9.192 -9.287 1.429 1.00 0.00 C ATOM 0 H ILE D 42 6.253 -7.969 4.657 1.00 0.00 H new ATOM 0 HA ILE D 42 7.123 -9.964 2.844 1.00 0.00 H new ATOM 0 HB ILE D 42 8.090 -7.640 3.279 1.00 0.00 H new ATOM 0 HG12 ILE D 42 10.488 -8.450 2.946 1.00 0.00 H new ATOM 0 HG13 ILE D 42 9.941 -10.078 3.298 1.00 0.00 H new ATOM 0 HG21 ILE D 42 9.816 -7.487 5.066 1.00 0.00 H new ATOM 0 HG22 ILE D 42 8.204 -7.800 5.752 1.00 0.00 H new ATOM 0 HG23 ILE D 42 9.385 -9.124 5.616 1.00 0.00 H new ATOM 0 HD11 ILE D 42 10.021 -9.691 0.848 1.00 0.00 H new ATOM 0 HD12 ILE D 42 8.346 -9.972 1.378 1.00 0.00 H new ATOM 0 HD13 ILE D 42 8.901 -8.319 1.020 1.00 0.00 H new ATOM 1903 N LEU D 43 7.634 -10.538 6.046 1.00 0.00 N ATOM 1904 CA LEU D 43 8.001 -11.580 6.998 1.00 0.00 C ATOM 1905 C LEU D 43 7.119 -12.811 6.804 1.00 0.00 C ATOM 1906 O LEU D 43 7.603 -13.940 6.843 1.00 0.00 O ATOM 1907 CB LEU D 43 7.853 -11.051 8.431 1.00 0.00 C ATOM 1908 CG LEU D 43 9.056 -10.155 8.791 1.00 0.00 C ATOM 1909 CD1 LEU D 43 8.759 -9.401 10.094 1.00 0.00 C ATOM 1910 CD2 LEU D 43 10.337 -11.007 8.967 1.00 0.00 C ATOM 0 H LEU D 43 7.293 -9.675 6.468 1.00 0.00 H new ATOM 0 HA LEU D 43 9.039 -11.864 6.825 1.00 0.00 H new ATOM 0 HB2 LEU D 43 6.927 -10.484 8.524 1.00 0.00 H new ATOM 0 HB3 LEU D 43 7.788 -11.885 9.130 1.00 0.00 H new ATOM 0 HG LEU D 43 9.218 -9.444 7.981 1.00 0.00 H new ATOM 0 HD11 LEU D 43 9.608 -8.767 10.349 1.00 0.00 H new ATOM 0 HD12 LEU D 43 7.871 -8.782 9.962 1.00 0.00 H new ATOM 0 HD13 LEU D 43 8.586 -10.117 10.897 1.00 0.00 H new ATOM 0 HD21 LEU D 43 11.174 -10.357 9.221 1.00 0.00 H new ATOM 0 HD22 LEU D 43 10.185 -11.732 9.767 1.00 0.00 H new ATOM 0 HD23 LEU D 43 10.555 -11.533 8.037 1.00 0.00 H new ATOM 1922 N ASP D 44 5.828 -12.589 6.593 1.00 0.00 N ATOM 1923 CA ASP D 44 4.902 -13.697 6.390 1.00 0.00 C ATOM 1924 C ASP D 44 5.262 -14.473 5.126 1.00 0.00 C ATOM 1925 O ASP D 44 5.227 -15.703 5.112 1.00 0.00 O ATOM 1926 CB ASP D 44 3.470 -13.173 6.275 1.00 0.00 C ATOM 1927 CG ASP D 44 2.503 -14.336 6.074 1.00 0.00 C ATOM 1928 OD1 ASP D 44 2.970 -15.455 5.939 1.00 0.00 O ATOM 1929 OD2 ASP D 44 1.306 -14.091 6.053 1.00 0.00 O ATOM 0 H ASP D 44 5.401 -11.663 6.558 1.00 0.00 H new ATOM 0 HA ASP D 44 4.976 -14.364 7.249 1.00 0.00 H new ATOM 0 HB2 ASP D 44 3.203 -12.619 7.175 1.00 0.00 H new ATOM 0 HB3 ASP D 44 3.394 -12.478 5.439 1.00 0.00 H new ATOM 1934 N ARG D 45 5.602 -13.746 4.067 1.00 0.00 N ATOM 1935 CA ARG D 45 5.960 -14.379 2.801 1.00 0.00 C ATOM 1936 C ARG D 45 7.371 -14.959 2.866 1.00 0.00 C ATOM 1937 O ARG D 45 7.727 -15.841 2.085 1.00 0.00 O ATOM 1938 CB ARG D 45 5.870 -13.356 1.664 1.00 0.00 C ATOM 1939 CG ARG D 45 6.136 -14.049 0.325 1.00 0.00 C ATOM 1940 CD ARG D 45 5.957 -13.045 -0.815 1.00 0.00 C ATOM 1941 NE ARG D 45 6.032 -13.726 -2.105 1.00 0.00 N ATOM 1942 CZ ARG D 45 7.193 -13.921 -2.723 1.00 0.00 C ATOM 1943 NH1 ARG D 45 8.302 -13.494 -2.186 1.00 0.00 N ATOM 1944 NH2 ARG D 45 7.223 -14.541 -3.871 1.00 0.00 N ATOM 0 H ARG D 45 5.637 -12.727 4.058 1.00 0.00 H new ATOM 0 HA ARG D 45 5.260 -15.193 2.612 1.00 0.00 H new ATOM 0 HB2 ARG D 45 4.883 -12.893 1.655 1.00 0.00 H new ATOM 0 HB3 ARG D 45 6.595 -12.558 1.822 1.00 0.00 H new ATOM 0 HG2 ARG D 45 7.147 -14.457 0.309 1.00 0.00 H new ATOM 0 HG3 ARG D 45 5.452 -14.888 0.196 1.00 0.00 H new ATOM 0 HD2 ARG D 45 4.996 -12.541 -0.717 1.00 0.00 H new ATOM 0 HD3 ARG D 45 6.727 -12.276 -0.756 1.00 0.00 H new ATOM 0 HE ARG D 45 5.173 -14.060 -2.542 1.00 0.00 H new ATOM 0 HH11 ARG D 45 8.281 -13.009 -1.289 1.00 0.00 H new ATOM 0 HH12 ARG D 45 9.191 -13.645 -2.663 1.00 0.00 H new ATOM 0 HH21 ARG D 45 6.357 -14.875 -4.293 1.00 0.00 H new ATOM 0 HH22 ARG D 45 8.113 -14.691 -4.346 1.00 0.00 H new ATOM 1958 N LEU D 46 8.175 -14.460 3.798 1.00 0.00 N ATOM 1959 CA LEU D 46 9.545 -14.945 3.940 1.00 0.00 C ATOM 1960 C LEU D 46 9.563 -16.425 4.306 1.00 0.00 C ATOM 1961 O LEU D 46 10.326 -17.205 3.736 1.00 0.00 O ATOM 1962 CB LEU D 46 10.277 -14.129 5.017 1.00 0.00 C ATOM 1963 CG LEU D 46 11.734 -14.643 5.204 1.00 0.00 C ATOM 1964 CD1 LEU D 46 12.686 -13.458 5.408 1.00 0.00 C ATOM 1965 CD2 LEU D 46 11.821 -15.562 6.438 1.00 0.00 C ATOM 0 H LEU D 46 7.908 -13.730 4.459 1.00 0.00 H new ATOM 0 HA LEU D 46 10.055 -14.823 2.984 1.00 0.00 H new ATOM 0 HB2 LEU D 46 10.291 -13.076 4.735 1.00 0.00 H new ATOM 0 HB3 LEU D 46 9.738 -14.199 5.962 1.00 0.00 H new ATOM 0 HG LEU D 46 12.018 -15.199 4.311 1.00 0.00 H new ATOM 0 HD11 LEU D 46 13.703 -13.827 5.538 1.00 0.00 H new ATOM 0 HD12 LEU D 46 12.646 -12.805 4.537 1.00 0.00 H new ATOM 0 HD13 LEU D 46 12.387 -12.899 6.295 1.00 0.00 H new ATOM 0 HD21 LEU D 46 12.845 -15.915 6.557 1.00 0.00 H new ATOM 0 HD22 LEU D 46 11.522 -15.007 7.327 1.00 0.00 H new ATOM 0 HD23 LEU D 46 11.157 -16.416 6.303 1.00 0.00 H new ATOM 1977 N PHE D 47 8.716 -16.807 5.255 1.00 0.00 N ATOM 1978 CA PHE D 47 8.647 -18.200 5.684 1.00 0.00 C ATOM 1979 C PHE D 47 8.154 -19.090 4.549 1.00 0.00 C ATOM 1980 O PHE D 47 8.699 -20.167 4.312 1.00 0.00 O ATOM 1981 CB PHE D 47 7.710 -18.336 6.886 1.00 0.00 C ATOM 1982 CG PHE D 47 8.316 -17.616 8.069 1.00 0.00 C ATOM 1983 CD1 PHE D 47 9.381 -18.194 8.769 1.00 0.00 C ATOM 1984 CD2 PHE D 47 7.813 -16.370 8.462 1.00 0.00 C ATOM 1985 CE1 PHE D 47 9.945 -17.526 9.862 1.00 0.00 C ATOM 1986 CE2 PHE D 47 8.378 -15.701 9.556 1.00 0.00 C ATOM 1987 CZ PHE D 47 9.443 -16.278 10.256 1.00 0.00 C ATOM 0 H PHE D 47 8.073 -16.179 5.738 1.00 0.00 H new ATOM 0 HA PHE D 47 9.650 -18.518 5.970 1.00 0.00 H new ATOM 0 HB2 PHE D 47 6.732 -17.915 6.650 1.00 0.00 H new ATOM 0 HB3 PHE D 47 7.555 -19.388 7.125 1.00 0.00 H new ATOM 0 HD1 PHE D 47 9.768 -19.156 8.466 1.00 0.00 H new ATOM 0 HD2 PHE D 47 6.990 -15.925 7.922 1.00 0.00 H new ATOM 0 HE1 PHE D 47 10.767 -17.972 10.402 1.00 0.00 H new ATOM 0 HE2 PHE D 47 7.991 -14.739 9.859 1.00 0.00 H new ATOM 0 HZ PHE D 47 9.878 -15.762 11.099 1.00 0.00 H new ATOM 1997 N PHE D 48 7.113 -18.633 3.850 1.00 0.00 N ATOM 1998 CA PHE D 48 6.540 -19.397 2.737 1.00 0.00 C ATOM 1999 C PHE D 48 6.660 -18.612 1.435 1.00 0.00 C ATOM 2000 O PHE D 48 6.204 -17.473 1.344 1.00 0.00 O ATOM 2001 CB PHE D 48 5.064 -19.686 3.028 1.00 0.00 C ATOM 2002 CG PHE D 48 4.897 -20.057 4.489 1.00 0.00 C ATOM 2003 CD1 PHE D 48 5.693 -21.061 5.060 1.00 0.00 C ATOM 2004 CD2 PHE D 48 3.945 -19.391 5.273 1.00 0.00 C ATOM 2005 CE1 PHE D 48 5.536 -21.396 6.411 1.00 0.00 C ATOM 2006 CE2 PHE D 48 3.790 -19.727 6.625 1.00 0.00 C ATOM 2007 CZ PHE D 48 4.584 -20.730 7.190 1.00 0.00 C ATOM 0 H PHE D 48 6.651 -17.742 4.033 1.00 0.00 H new ATOM 0 HA PHE D 48 7.087 -20.334 2.632 1.00 0.00 H new ATOM 0 HB2 PHE D 48 4.458 -18.811 2.793 1.00 0.00 H new ATOM 0 HB3 PHE D 48 4.710 -20.498 2.393 1.00 0.00 H new ATOM 0 HD1 PHE D 48 6.427 -21.576 4.458 1.00 0.00 H new ATOM 0 HD2 PHE D 48 3.330 -18.618 4.835 1.00 0.00 H new ATOM 0 HE1 PHE D 48 6.150 -22.168 6.851 1.00 0.00 H new ATOM 0 HE2 PHE D 48 3.058 -19.212 7.230 1.00 0.00 H new ATOM 0 HZ PHE D 48 4.462 -20.991 8.231 1.00 0.00 H new ATOM 2017 N LYS D 49 7.271 -19.230 0.429 1.00 0.00 N ATOM 2018 CA LYS D 49 7.443 -18.579 -0.867 1.00 0.00 C ATOM 2019 C LYS D 49 6.223 -18.815 -1.752 1.00 0.00 C ATOM 2020 O LYS D 49 5.457 -17.884 -1.932 1.00 0.00 O ATOM 2021 CB LYS D 49 8.693 -19.124 -1.562 1.00 0.00 C ATOM 2022 CG LYS D 49 9.936 -18.712 -0.770 1.00 0.00 C ATOM 2023 CD LYS D 49 11.187 -19.249 -1.468 1.00 0.00 C ATOM 2024 CE LYS D 49 12.428 -18.840 -0.674 1.00 0.00 C ATOM 2025 NZ LYS D 49 13.646 -19.352 -1.363 1.00 0.00 N ATOM 2026 OXT LYS D 49 6.074 -19.925 -2.236 1.00 0.00 O ATOM 0 H LYS D 49 7.653 -20.174 0.484 1.00 0.00 H new ATOM 0 HA LYS D 49 7.556 -17.507 -0.703 1.00 0.00 H new ATOM 0 HB2 LYS D 49 8.638 -20.210 -1.634 1.00 0.00 H new ATOM 0 HB3 LYS D 49 8.753 -18.740 -2.580 1.00 0.00 H new ATOM 0 HG2 LYS D 49 9.988 -17.626 -0.693 1.00 0.00 H new ATOM 0 HG3 LYS D 49 9.878 -19.101 0.246 1.00 0.00 H new ATOM 0 HD2 LYS D 49 11.134 -20.335 -1.548 1.00 0.00 H new ATOM 0 HD3 LYS D 49 11.246 -18.858 -2.484 1.00 0.00 H new ATOM 0 HE2 LYS D 49 12.476 -17.755 -0.586 1.00 0.00 H new ATOM 0 HE3 LYS D 49 12.374 -19.240 0.338 1.00 0.00 H new ATOM 0 HZ1 LYS D 49 14.492 -19.075 -0.825 1.00 0.00 H new ATOM 0 HZ2 LYS D 49 13.600 -20.389 -1.425 1.00 0.00 H new ATOM 0 HZ3 LYS D 49 13.698 -18.950 -2.321 1.00 0.00 H new TER 2040 LYS D 49 HETATM 2041 S 3LW C 100 2.576 8.695 0.562 1.00 0.00 S HETATM 2042 BR 3LW C 100 4.610 10.781 1.125 1.00 0.00 BR HETATM 2043 C1 3LW C 100 3.004 10.085 0.386 1.00 0.00 C HETATM 2044 C2 3LW C 100 2.140 10.796 -0.345 1.00 0.00 C HETATM 2045 N2 3LW C 100 0.688 6.599 0.642 1.00 0.00 N HETATM 2046 C3 3LW C 100 1.128 10.000 -0.699 1.00 0.00 C HETATM 2047 C5 3LW C 100 0.395 7.597 -0.393 1.00 0.00 C HETATM 2048 C10 3LW C 100 0.537 5.159 0.318 1.00 0.00 C HETATM 2049 C12 3LW C 100 1.319 8.763 -0.204 1.00 0.00 C HETATM 2050 C61 3LW C 100 -0.929 4.795 -0.056 1.00 0.00 C HETATM 2051 C62 3LW C 100 0.925 4.278 1.538 1.00 0.00 C HETATM 2052 C63 3LW C 100 1.448 4.714 -0.868 1.00 0.00 C HETATM 2053 C71 3LW C 100 -1.077 3.288 -0.364 1.00 0.00 C HETATM 2054 C72 3LW C 100 0.771 2.772 1.228 1.00 0.00 C HETATM 2055 C73 3LW C 100 1.285 3.210 -1.171 1.00 0.00 C HETATM 2056 C81 3LW C 100 -0.684 2.458 0.864 1.00 0.00 C HETATM 2057 C82 3LW C 100 1.676 2.379 0.057 1.00 0.00 C HETATM 2058 C83 3LW C 100 -0.173 2.907 -1.544 1.00 0.00 C