USER MOD reduce.3.24.130724 H: found=0, std=0, add=1059, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 1067 hydrogens (23 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 -39:sc= 0.0784 USER MOD Single : A 20 ASN :FLIP amide:sc= -0.0167 F(o=-1.2,f=-0.017) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 31 ASN : amide:sc= -1.91 K(o=-1.9,f=-4.2!) USER MOD Single : A 37 HIS : no HD1:sc= -9.52! C(o=-9.5!,f=-11!) USER MOD Single : A 49 LYS NZ :NH3+ -163:sc=-0.00682 (180deg=-0.321) USER MOD Single : B 19 SER OG : rot -35:sc= 0.0771 USER MOD Single : B 20 ASN :FLIP amide:sc= 0 F(o=-1.1,f=0) USER MOD Single : B 22 SER OG : rot 180:sc= 0 USER MOD Single : B 23 SER OG : rot 180:sc= 0 USER MOD Single : B 31 ASN : amide:sc= -1.73 K(o=-1.7,f=-2.9!) USER MOD Single : B 37 HIS : no HD1:sc= -9.71! C(o=-9.7!,f=-12!) USER MOD Single : B 49 LYS NZ :NH3+ -163:sc= -0.0167 (180deg=-0.318) USER MOD Single : C 19 SER OG : rot -36:sc= 0.0893 USER MOD Single : C 20 ASN :FLIP amide:sc=-0.00612 F(o=-1.1,f=-0.0061) USER MOD Single : C 22 SER OG : rot 180:sc= 0 USER MOD Single : C 23 SER OG : rot 180:sc= 0 USER MOD Single : C 31 ASN : amide:sc= -3.55 K(o=-3.6,f=-6.9!) USER MOD Single : C 37 HIS : no HD1:sc= -9.46! C(o=-9.5!,f=-11!) USER MOD Single : C 49 LYS NZ :NH3+ -164:sc= -0.0252 (180deg=-0.327) USER MOD Single : D 19 SER OG : rot -30:sc= 0.0789 USER MOD Single : D 20 ASN :FLIP amide:sc= -0.017 F(o=-1.2,f=-0.017) USER MOD Single : D 22 SER OG : rot 180:sc= 0 USER MOD Single : D 23 SER OG : rot 180:sc= 0 USER MOD Single : D 31 ASN : amide:sc= -1.56 K(o=-1.6,f=-2.5!) USER MOD Single : D 37 HIS : no HD1:sc= -9.84! C(o=-9.8!,f=-12!) USER MOD Single : D 49 LYS NZ :NH3+ -164:sc= -0.0173 (180deg=-0.292) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 19 -1.281 21.751 -15.185 1.00 0.00 N ATOM 2 CA SER A 19 -2.658 21.972 -14.661 1.00 0.00 C ATOM 3 C SER A 19 -2.767 21.380 -13.260 1.00 0.00 C ATOM 4 O SER A 19 -1.982 20.511 -12.883 1.00 0.00 O ATOM 5 CB SER A 19 -3.666 21.297 -15.590 1.00 0.00 C ATOM 6 OG SER A 19 -3.418 19.896 -15.616 1.00 0.00 O ATOM 0 HA SER A 19 -2.869 23.040 -14.616 1.00 0.00 H new ATOM 0 HB2 SER A 19 -4.682 21.492 -15.246 1.00 0.00 H new ATOM 0 HB3 SER A 19 -3.585 21.711 -16.595 1.00 0.00 H new ATOM 0 HG SER A 19 -2.451 19.735 -15.616 1.00 0.00 H new ATOM 14 N ASN A 20 -3.744 21.857 -12.495 1.00 0.00 N ATOM 15 CA ASN A 20 -3.950 21.363 -11.138 1.00 0.00 C ATOM 16 C ASN A 20 -2.674 21.517 -10.314 1.00 0.00 C ATOM 17 O ASN A 20 -2.316 20.634 -9.534 1.00 0.00 O ATOM 18 CB ASN A 20 -4.366 19.892 -11.171 1.00 0.00 C ATOM 19 CG ASN A 20 -5.713 19.745 -11.875 1.00 0.00 C ATOM 20 OD1 ASN A 20 -6.562 20.736 -11.859 1.00 0.00 O flip ATOM 21 ND2 ASN A 20 -5.997 18.699 -12.457 1.00 0.00 N flip ATOM 0 H ASN A 20 -4.401 22.580 -12.789 1.00 0.00 H new ATOM 0 HA ASN A 20 -4.743 21.951 -10.675 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -3.609 19.303 -11.690 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -4.433 19.502 -10.155 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -5.332 17.925 -12.469 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -6.897 18.606 -12.928 1.00 0.00 H new ATOM 28 N ASP A 21 -1.988 22.640 -10.498 1.00 0.00 N ATOM 29 CA ASP A 21 -0.750 22.897 -9.772 1.00 0.00 C ATOM 30 C ASP A 21 -1.000 22.917 -8.266 1.00 0.00 C ATOM 31 O ASP A 21 -0.194 22.407 -7.488 1.00 0.00 O ATOM 32 CB ASP A 21 -0.159 24.240 -10.208 1.00 0.00 C ATOM 33 CG ASP A 21 1.126 24.522 -9.436 1.00 0.00 C ATOM 34 OD1 ASP A 21 2.044 23.727 -9.542 1.00 0.00 O ATOM 35 OD2 ASP A 21 1.170 25.530 -8.750 1.00 0.00 O ATOM 0 H ASP A 21 -2.266 23.383 -11.140 1.00 0.00 H new ATOM 0 HA ASP A 21 -0.047 22.096 -10.000 1.00 0.00 H new ATOM 0 HB2 ASP A 21 0.046 24.226 -11.278 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -0.881 25.038 -10.033 1.00 0.00 H new ATOM 40 N SER A 22 -2.118 23.511 -7.860 1.00 0.00 N ATOM 41 CA SER A 22 -2.459 23.593 -6.444 1.00 0.00 C ATOM 42 C SER A 22 -2.614 22.197 -5.845 1.00 0.00 C ATOM 43 O SER A 22 -2.120 21.920 -4.750 1.00 0.00 O ATOM 44 CB SER A 22 -3.759 24.376 -6.265 1.00 0.00 C ATOM 45 OG SER A 22 -4.060 24.482 -4.881 1.00 0.00 O ATOM 0 H SER A 22 -2.799 23.940 -8.487 1.00 0.00 H new ATOM 0 HA SER A 22 -1.651 24.108 -5.925 1.00 0.00 H new ATOM 0 HB2 SER A 22 -3.662 25.369 -6.704 1.00 0.00 H new ATOM 0 HB3 SER A 22 -4.573 23.875 -6.788 1.00 0.00 H new ATOM 0 HG SER A 22 -4.893 24.985 -4.765 1.00 0.00 H new ATOM 51 N SER A 23 -3.299 21.314 -6.575 1.00 0.00 N ATOM 52 CA SER A 23 -3.517 19.937 -6.124 1.00 0.00 C ATOM 53 C SER A 23 -2.788 18.972 -7.051 1.00 0.00 C ATOM 54 O SER A 23 -3.264 18.671 -8.147 1.00 0.00 O ATOM 55 CB SER A 23 -5.013 19.619 -6.134 1.00 0.00 C ATOM 56 OG SER A 23 -5.211 18.283 -5.690 1.00 0.00 O ATOM 0 H SER A 23 -3.713 21.528 -7.482 1.00 0.00 H new ATOM 0 HA SER A 23 -3.131 19.829 -5.110 1.00 0.00 H new ATOM 0 HB2 SER A 23 -5.549 20.313 -5.486 1.00 0.00 H new ATOM 0 HB3 SER A 23 -5.417 19.744 -7.139 1.00 0.00 H new ATOM 0 HG SER A 23 -6.169 18.076 -5.693 1.00 0.00 H new ATOM 62 N ASP A 24 -1.627 18.497 -6.614 1.00 0.00 N ATOM 63 CA ASP A 24 -0.837 17.576 -7.425 1.00 0.00 C ATOM 64 C ASP A 24 -1.628 16.289 -7.701 1.00 0.00 C ATOM 65 O ASP A 24 -2.215 15.718 -6.782 1.00 0.00 O ATOM 66 CB ASP A 24 0.461 17.225 -6.695 1.00 0.00 C ATOM 67 CG ASP A 24 1.442 16.567 -7.661 1.00 0.00 C ATOM 68 OD1 ASP A 24 1.203 15.431 -8.034 1.00 0.00 O ATOM 69 OD2 ASP A 24 2.418 17.209 -8.011 1.00 0.00 O ATOM 0 H ASP A 24 -1.214 18.731 -5.711 1.00 0.00 H new ATOM 0 HA ASP A 24 -0.606 18.061 -8.373 1.00 0.00 H new ATOM 0 HB2 ASP A 24 0.904 18.126 -6.271 1.00 0.00 H new ATOM 0 HB3 ASP A 24 0.250 16.552 -5.864 1.00 0.00 H new ATOM 74 N PRO A 25 -1.667 15.812 -8.932 1.00 0.00 N ATOM 75 CA PRO A 25 -2.421 14.567 -9.269 1.00 0.00 C ATOM 76 C PRO A 25 -1.748 13.311 -8.713 1.00 0.00 C ATOM 77 O PRO A 25 -2.378 12.260 -8.595 1.00 0.00 O ATOM 78 CB PRO A 25 -2.445 14.560 -10.806 1.00 0.00 C ATOM 79 CG PRO A 25 -1.232 15.334 -11.215 1.00 0.00 C ATOM 80 CD PRO A 25 -1.008 16.386 -10.126 1.00 0.00 C ATOM 0 HA PRO A 25 -3.418 14.559 -8.828 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -2.415 13.543 -11.197 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -3.355 15.021 -11.189 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -0.366 14.679 -11.307 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -1.380 15.805 -12.187 1.00 0.00 H new ATOM 0 HD2 PRO A 25 0.054 16.559 -9.951 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -1.447 17.345 -10.401 1.00 0.00 H new ATOM 88 N LEU A 26 -0.463 13.421 -8.385 1.00 0.00 N ATOM 89 CA LEU A 26 0.275 12.278 -7.857 1.00 0.00 C ATOM 90 C LEU A 26 -0.329 11.812 -6.534 1.00 0.00 C ATOM 91 O LEU A 26 -0.518 10.616 -6.317 1.00 0.00 O ATOM 92 CB LEU A 26 1.746 12.663 -7.650 1.00 0.00 C ATOM 93 CG LEU A 26 2.559 11.453 -7.164 1.00 0.00 C ATOM 94 CD1 LEU A 26 2.549 10.339 -8.226 1.00 0.00 C ATOM 95 CD2 LEU A 26 4.002 11.899 -6.896 1.00 0.00 C ATOM 0 H LEU A 26 0.083 14.278 -8.474 1.00 0.00 H new ATOM 0 HA LEU A 26 0.211 11.460 -8.575 1.00 0.00 H new ATOM 0 HB2 LEU A 26 2.164 13.037 -8.584 1.00 0.00 H new ATOM 0 HB3 LEU A 26 1.817 13.471 -6.922 1.00 0.00 H new ATOM 0 HG LEU A 26 2.113 11.063 -6.249 1.00 0.00 H new ATOM 0 HD11 LEU A 26 3.129 9.489 -7.867 1.00 0.00 H new ATOM 0 HD12 LEU A 26 1.522 10.025 -8.414 1.00 0.00 H new ATOM 0 HD13 LEU A 26 2.988 10.714 -9.150 1.00 0.00 H new ATOM 0 HD21 LEU A 26 4.588 11.047 -6.550 1.00 0.00 H new ATOM 0 HD22 LEU A 26 4.438 12.291 -7.815 1.00 0.00 H new ATOM 0 HD23 LEU A 26 4.007 12.676 -6.132 1.00 0.00 H new ATOM 107 N VAL A 27 -0.627 12.763 -5.656 1.00 0.00 N ATOM 108 CA VAL A 27 -1.209 12.432 -4.359 1.00 0.00 C ATOM 109 C VAL A 27 -2.594 11.814 -4.535 1.00 0.00 C ATOM 110 O VAL A 27 -2.918 10.806 -3.907 1.00 0.00 O ATOM 111 CB VAL A 27 -1.306 13.691 -3.493 1.00 0.00 C ATOM 112 CG1 VAL A 27 -2.056 13.373 -2.196 1.00 0.00 C ATOM 113 CG2 VAL A 27 0.103 14.183 -3.156 1.00 0.00 C ATOM 0 H VAL A 27 -0.478 13.759 -5.815 1.00 0.00 H new ATOM 0 HA VAL A 27 -0.564 11.705 -3.865 1.00 0.00 H new ATOM 0 HB VAL A 27 -1.846 14.464 -4.040 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -2.122 14.272 -1.584 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -3.060 13.021 -2.433 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -1.521 12.599 -1.647 1.00 0.00 H new ATOM 0 HG21 VAL A 27 0.038 15.079 -2.539 1.00 0.00 H new ATOM 0 HG22 VAL A 27 0.639 13.406 -2.611 1.00 0.00 H new ATOM 0 HG23 VAL A 27 0.638 14.415 -4.077 1.00 0.00 H new ATOM 123 N VAL A 28 -3.404 12.426 -5.392 1.00 0.00 N ATOM 124 CA VAL A 28 -4.753 11.929 -5.639 1.00 0.00 C ATOM 125 C VAL A 28 -4.703 10.541 -6.270 1.00 0.00 C ATOM 126 O VAL A 28 -5.434 9.638 -5.868 1.00 0.00 O ATOM 127 CB VAL A 28 -5.501 12.892 -6.565 1.00 0.00 C ATOM 128 CG1 VAL A 28 -6.869 12.303 -6.925 1.00 0.00 C ATOM 129 CG2 VAL A 28 -5.695 14.232 -5.852 1.00 0.00 C ATOM 0 H VAL A 28 -3.153 13.260 -5.923 1.00 0.00 H new ATOM 0 HA VAL A 28 -5.279 11.862 -4.687 1.00 0.00 H new ATOM 0 HB VAL A 28 -4.922 13.042 -7.476 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -7.399 12.991 -7.584 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -6.732 11.348 -7.432 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -7.450 12.151 -6.016 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -6.227 14.920 -6.509 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -6.274 14.079 -4.941 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -4.722 14.653 -5.597 1.00 0.00 H new ATOM 139 N ALA A 29 -3.833 10.379 -7.263 1.00 0.00 N ATOM 140 CA ALA A 29 -3.697 9.097 -7.943 1.00 0.00 C ATOM 141 C ALA A 29 -3.192 8.029 -6.982 1.00 0.00 C ATOM 142 O ALA A 29 -3.631 6.880 -7.028 1.00 0.00 O ATOM 143 CB ALA A 29 -2.725 9.226 -9.116 1.00 0.00 C ATOM 0 H ALA A 29 -3.217 11.113 -7.612 1.00 0.00 H new ATOM 0 HA ALA A 29 -4.679 8.802 -8.314 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -2.630 8.263 -9.618 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -3.102 9.967 -9.821 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -1.749 9.540 -8.747 1.00 0.00 H new ATOM 149 N ALA A 30 -2.265 8.410 -6.110 1.00 0.00 N ATOM 150 CA ALA A 30 -1.707 7.468 -5.147 1.00 0.00 C ATOM 151 C ALA A 30 -2.812 6.847 -4.301 1.00 0.00 C ATOM 152 O ALA A 30 -2.862 5.629 -4.126 1.00 0.00 O ATOM 153 CB ALA A 30 -0.704 8.182 -4.239 1.00 0.00 C ATOM 0 H ALA A 30 -1.887 9.355 -6.050 1.00 0.00 H new ATOM 0 HA ALA A 30 -1.199 6.675 -5.696 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -0.292 7.471 -3.523 1.00 0.00 H new ATOM 0 HB2 ALA A 30 0.103 8.597 -4.843 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -1.207 8.987 -3.703 1.00 0.00 H new ATOM 159 N ASN A 31 -3.696 7.688 -3.777 1.00 0.00 N ATOM 160 CA ASN A 31 -4.796 7.204 -2.951 1.00 0.00 C ATOM 161 C ASN A 31 -5.737 6.321 -3.765 1.00 0.00 C ATOM 162 O ASN A 31 -6.199 5.285 -3.287 1.00 0.00 O ATOM 163 CB ASN A 31 -5.573 8.391 -2.378 1.00 0.00 C ATOM 164 CG ASN A 31 -4.732 9.108 -1.327 1.00 0.00 C ATOM 165 OD1 ASN A 31 -3.798 8.525 -0.778 1.00 0.00 O ATOM 166 ND2 ASN A 31 -5.006 10.344 -1.017 1.00 0.00 N ATOM 0 H ASN A 31 -3.674 8.699 -3.907 1.00 0.00 H new ATOM 0 HA ASN A 31 -4.380 6.610 -2.137 1.00 0.00 H new ATOM 0 HB2 ASN A 31 -5.838 9.083 -3.178 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -6.506 8.045 -1.934 1.00 0.00 H new ATOM 0 HD21 ASN A 31 -4.445 10.831 -0.317 1.00 0.00 H new ATOM 0 HD22 ASN A 31 -5.781 10.825 -1.474 1.00 0.00 H new ATOM 173 N ILE A 32 -6.018 6.736 -4.997 1.00 0.00 N ATOM 174 CA ILE A 32 -6.907 5.973 -5.867 1.00 0.00 C ATOM 175 C ILE A 32 -6.298 4.613 -6.197 1.00 0.00 C ATOM 176 O ILE A 32 -6.981 3.590 -6.168 1.00 0.00 O ATOM 177 CB ILE A 32 -7.167 6.754 -7.160 1.00 0.00 C ATOM 178 CG1 ILE A 32 -7.981 8.011 -6.835 1.00 0.00 C ATOM 179 CG2 ILE A 32 -7.956 5.881 -8.141 1.00 0.00 C ATOM 180 CD1 ILE A 32 -8.009 8.932 -8.056 1.00 0.00 C ATOM 0 H ILE A 32 -5.646 7.590 -5.413 1.00 0.00 H new ATOM 0 HA ILE A 32 -7.851 5.814 -5.345 1.00 0.00 H new ATOM 0 HB ILE A 32 -6.215 7.035 -7.611 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -8.997 7.736 -6.551 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -7.542 8.531 -5.984 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -8.139 6.439 -9.059 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -7.383 4.983 -8.371 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -8.908 5.599 -7.692 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -8.588 9.826 -7.824 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -6.991 9.218 -8.320 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -8.468 8.410 -8.895 1.00 0.00 H new ATOM 192 N ILE A 33 -5.005 4.609 -6.510 1.00 0.00 N ATOM 193 CA ILE A 33 -4.312 3.371 -6.844 1.00 0.00 C ATOM 194 C ILE A 33 -4.295 2.418 -5.647 1.00 0.00 C ATOM 195 O ILE A 33 -4.527 1.218 -5.800 1.00 0.00 O ATOM 196 CB ILE A 33 -2.878 3.684 -7.291 1.00 0.00 C ATOM 197 CG1 ILE A 33 -2.910 4.394 -8.650 1.00 0.00 C ATOM 198 CG2 ILE A 33 -2.071 2.391 -7.411 1.00 0.00 C ATOM 199 CD1 ILE A 33 -1.526 4.970 -8.963 1.00 0.00 C ATOM 0 H ILE A 33 -4.420 5.444 -6.539 1.00 0.00 H new ATOM 0 HA ILE A 33 -4.845 2.883 -7.660 1.00 0.00 H new ATOM 0 HB ILE A 33 -2.407 4.330 -6.550 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -3.208 3.694 -9.430 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -3.652 5.192 -8.637 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -1.055 2.624 -7.729 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -2.042 1.889 -6.444 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -2.540 1.736 -8.146 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -1.552 5.474 -9.929 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -1.245 5.684 -8.189 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -0.794 4.163 -8.994 1.00 0.00 H new ATOM 211 N GLY A 34 -4.018 2.951 -4.462 1.00 0.00 N ATOM 212 CA GLY A 34 -3.973 2.124 -3.261 1.00 0.00 C ATOM 213 C GLY A 34 -5.328 1.474 -2.996 1.00 0.00 C ATOM 214 O GLY A 34 -5.410 0.283 -2.684 1.00 0.00 O ATOM 0 H GLY A 34 -3.823 3.940 -4.307 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -3.211 1.353 -3.374 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -3.684 2.734 -2.405 1.00 0.00 H new ATOM 218 N ILE A 35 -6.389 2.261 -3.128 1.00 0.00 N ATOM 219 CA ILE A 35 -7.739 1.757 -2.906 1.00 0.00 C ATOM 220 C ILE A 35 -8.075 0.683 -3.940 1.00 0.00 C ATOM 221 O ILE A 35 -8.647 -0.360 -3.613 1.00 0.00 O ATOM 222 CB ILE A 35 -8.745 2.908 -2.991 1.00 0.00 C ATOM 223 CG1 ILE A 35 -8.517 3.858 -1.811 1.00 0.00 C ATOM 224 CG2 ILE A 35 -10.169 2.352 -2.927 1.00 0.00 C ATOM 225 CD1 ILE A 35 -9.268 5.169 -2.053 1.00 0.00 C ATOM 0 H ILE A 35 -6.342 3.247 -3.387 1.00 0.00 H new ATOM 0 HA ILE A 35 -7.794 1.313 -1.912 1.00 0.00 H new ATOM 0 HB ILE A 35 -8.610 3.444 -3.930 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -8.862 3.395 -0.887 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -7.452 4.055 -1.690 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -10.883 3.173 -2.988 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -10.330 1.668 -3.760 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -10.309 1.818 -1.987 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -9.104 5.843 -1.212 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -8.902 5.635 -2.968 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -10.334 4.965 -2.152 1.00 0.00 H new ATOM 237 N LEU A 36 -7.705 0.945 -5.190 1.00 0.00 N ATOM 238 CA LEU A 36 -7.966 -0.002 -6.265 1.00 0.00 C ATOM 239 C LEU A 36 -7.256 -1.319 -5.978 1.00 0.00 C ATOM 240 O LEU A 36 -7.793 -2.395 -6.247 1.00 0.00 O ATOM 241 CB LEU A 36 -7.482 0.570 -7.604 1.00 0.00 C ATOM 242 CG LEU A 36 -7.789 -0.407 -8.750 1.00 0.00 C ATOM 243 CD1 LEU A 36 -9.306 -0.651 -8.858 1.00 0.00 C ATOM 244 CD2 LEU A 36 -7.268 0.186 -10.064 1.00 0.00 C ATOM 0 H LEU A 36 -7.228 1.798 -5.480 1.00 0.00 H new ATOM 0 HA LEU A 36 -9.040 -0.179 -6.325 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -7.968 1.527 -7.794 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -6.410 0.761 -7.558 1.00 0.00 H new ATOM 0 HG LEU A 36 -7.298 -1.359 -8.550 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -9.506 -1.345 -9.674 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -9.674 -1.075 -7.923 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -9.814 0.294 -9.053 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -7.482 -0.501 -10.883 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -7.760 1.140 -10.253 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -6.191 0.341 -9.992 1.00 0.00 H new ATOM 256 N HIS A 37 -6.051 -1.227 -5.429 1.00 0.00 N ATOM 257 CA HIS A 37 -5.284 -2.422 -5.110 1.00 0.00 C ATOM 258 C HIS A 37 -6.071 -3.304 -4.151 1.00 0.00 C ATOM 259 O HIS A 37 -6.093 -4.527 -4.297 1.00 0.00 O ATOM 260 CB HIS A 37 -3.954 -2.039 -4.459 1.00 0.00 C ATOM 261 CG HIS A 37 -3.165 -3.291 -4.188 1.00 0.00 C ATOM 262 ND1 HIS A 37 -1.944 -3.546 -4.788 1.00 0.00 N ATOM 263 CD2 HIS A 37 -3.424 -4.382 -3.398 1.00 0.00 C ATOM 264 CE1 HIS A 37 -1.521 -4.746 -4.352 1.00 0.00 C ATOM 265 NE2 HIS A 37 -2.385 -5.297 -3.503 1.00 0.00 N ATOM 0 H HIS A 37 -5.589 -0.348 -5.198 1.00 0.00 H new ATOM 0 HA HIS A 37 -5.091 -2.966 -6.035 1.00 0.00 H new ATOM 0 HB2 HIS A 37 -3.392 -1.374 -5.114 1.00 0.00 H new ATOM 0 HB3 HIS A 37 -4.131 -1.497 -3.530 1.00 0.00 H new ATOM 0 HD2 HIS A 37 -4.304 -4.510 -2.786 1.00 0.00 H new ATOM 0 HE1 HIS A 37 -0.592 -5.207 -4.654 1.00 0.00 H new ATOM 0 HE2 HIS A 37 -2.302 -6.197 -3.031 1.00 0.00 H new ATOM 273 N LEU A 38 -6.716 -2.683 -3.172 1.00 0.00 N ATOM 274 CA LEU A 38 -7.497 -3.432 -2.196 1.00 0.00 C ATOM 275 C LEU A 38 -8.621 -4.209 -2.870 1.00 0.00 C ATOM 276 O LEU A 38 -8.896 -5.344 -2.496 1.00 0.00 O ATOM 277 CB LEU A 38 -8.082 -2.479 -1.131 1.00 0.00 C ATOM 278 CG LEU A 38 -7.108 -2.344 0.059 1.00 0.00 C ATOM 279 CD1 LEU A 38 -7.368 -1.033 0.798 1.00 0.00 C ATOM 280 CD2 LEU A 38 -7.309 -3.521 1.034 1.00 0.00 C ATOM 0 H LEU A 38 -6.715 -1.673 -3.033 1.00 0.00 H new ATOM 0 HA LEU A 38 -6.830 -4.145 -1.711 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -8.267 -1.499 -1.572 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -9.043 -2.858 -0.782 1.00 0.00 H new ATOM 0 HG LEU A 38 -6.086 -2.352 -0.320 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -6.677 -0.945 1.636 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -7.220 -0.196 0.116 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -8.393 -1.022 1.170 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -6.619 -3.421 1.872 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -8.334 -3.515 1.405 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -7.116 -4.460 0.515 1.00 0.00 H new ATOM 292 N ILE A 39 -9.269 -3.602 -3.852 1.00 0.00 N ATOM 293 CA ILE A 39 -10.365 -4.282 -4.532 1.00 0.00 C ATOM 294 C ILE A 39 -9.859 -5.544 -5.232 1.00 0.00 C ATOM 295 O ILE A 39 -10.491 -6.597 -5.161 1.00 0.00 O ATOM 296 CB ILE A 39 -11.002 -3.337 -5.557 1.00 0.00 C ATOM 297 CG1 ILE A 39 -11.703 -2.195 -4.815 1.00 0.00 C ATOM 298 CG2 ILE A 39 -12.027 -4.101 -6.399 1.00 0.00 C ATOM 299 CD1 ILE A 39 -12.115 -1.110 -5.811 1.00 0.00 C ATOM 0 H ILE A 39 -9.064 -2.662 -4.191 1.00 0.00 H new ATOM 0 HA ILE A 39 -11.112 -4.571 -3.793 1.00 0.00 H new ATOM 0 HB ILE A 39 -10.229 -2.935 -6.212 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -12.581 -2.573 -4.291 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -11.037 -1.776 -4.060 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -12.477 -3.425 -7.126 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -11.531 -4.919 -6.922 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -12.804 -4.504 -5.749 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -12.613 -0.299 -5.280 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -11.229 -0.723 -6.315 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -12.796 -1.533 -6.549 1.00 0.00 H new ATOM 311 N LEU A 40 -8.728 -5.431 -5.912 1.00 0.00 N ATOM 312 CA LEU A 40 -8.160 -6.577 -6.616 1.00 0.00 C ATOM 313 C LEU A 40 -7.570 -7.595 -5.637 1.00 0.00 C ATOM 314 O LEU A 40 -7.763 -8.801 -5.793 1.00 0.00 O ATOM 315 CB LEU A 40 -7.079 -6.098 -7.586 1.00 0.00 C ATOM 316 CG LEU A 40 -7.647 -4.976 -8.465 1.00 0.00 C ATOM 317 CD1 LEU A 40 -6.552 -4.466 -9.407 1.00 0.00 C ATOM 318 CD2 LEU A 40 -8.833 -5.503 -9.291 1.00 0.00 C ATOM 0 H LEU A 40 -8.189 -4.569 -5.993 1.00 0.00 H new ATOM 0 HA LEU A 40 -8.959 -7.069 -7.170 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -6.211 -5.738 -7.033 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -6.739 -6.926 -8.208 1.00 0.00 H new ATOM 0 HG LEU A 40 -7.992 -4.161 -7.828 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -6.953 -3.669 -10.033 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -5.717 -4.082 -8.821 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -6.206 -5.284 -10.039 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -9.230 -4.700 -9.912 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -8.498 -6.322 -9.928 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -9.613 -5.862 -8.620 1.00 0.00 H new ATOM 330 N TRP A 41 -6.842 -7.103 -4.634 1.00 0.00 N ATOM 331 CA TRP A 41 -6.218 -7.981 -3.645 1.00 0.00 C ATOM 332 C TRP A 41 -7.260 -8.671 -2.766 1.00 0.00 C ATOM 333 O TRP A 41 -7.183 -9.877 -2.536 1.00 0.00 O ATOM 334 CB TRP A 41 -5.246 -7.169 -2.776 1.00 0.00 C ATOM 335 CG TRP A 41 -4.761 -7.993 -1.621 1.00 0.00 C ATOM 336 CD1 TRP A 41 -3.724 -8.860 -1.656 1.00 0.00 C ATOM 337 CD2 TRP A 41 -5.257 -8.005 -0.253 1.00 0.00 C ATOM 338 NE1 TRP A 41 -3.572 -9.424 -0.401 1.00 0.00 N ATOM 339 CE2 TRP A 41 -4.488 -8.920 0.498 1.00 0.00 C ATOM 340 CE3 TRP A 41 -6.294 -7.315 0.402 1.00 0.00 C ATOM 341 CZ2 TRP A 41 -4.740 -9.145 1.849 1.00 0.00 C ATOM 342 CZ3 TRP A 41 -6.541 -7.536 1.764 1.00 0.00 C ATOM 343 CH2 TRP A 41 -5.767 -8.448 2.484 1.00 0.00 C ATOM 0 H TRP A 41 -6.671 -6.108 -4.486 1.00 0.00 H new ATOM 0 HA TRP A 41 -5.672 -8.759 -4.179 1.00 0.00 H new ATOM 0 HB2 TRP A 41 -4.398 -6.841 -3.378 1.00 0.00 H new ATOM 0 HB3 TRP A 41 -5.742 -6.271 -2.407 1.00 0.00 H new ATOM 0 HD1 TRP A 41 -3.115 -9.077 -2.521 1.00 0.00 H new ATOM 0 HE1 TRP A 41 -2.869 -10.126 -0.170 1.00 0.00 H new ATOM 0 HE3 TRP A 41 -6.902 -6.612 -0.147 1.00 0.00 H new ATOM 0 HZ2 TRP A 41 -4.143 -9.855 2.402 1.00 0.00 H new ATOM 0 HZ3 TRP A 41 -7.335 -6.997 2.260 1.00 0.00 H new ATOM 0 HH2 TRP A 41 -5.964 -8.614 3.533 1.00 0.00 H new ATOM 354 N ILE A 42 -8.224 -7.906 -2.269 1.00 0.00 N ATOM 355 CA ILE A 42 -9.257 -8.473 -1.409 1.00 0.00 C ATOM 356 C ILE A 42 -10.100 -9.476 -2.192 1.00 0.00 C ATOM 357 O ILE A 42 -10.491 -10.518 -1.668 1.00 0.00 O ATOM 358 CB ILE A 42 -10.150 -7.355 -0.839 1.00 0.00 C ATOM 359 CG1 ILE A 42 -10.944 -7.888 0.357 1.00 0.00 C ATOM 360 CG2 ILE A 42 -11.128 -6.851 -1.912 1.00 0.00 C ATOM 361 CD1 ILE A 42 -11.696 -6.731 1.022 1.00 0.00 C ATOM 0 H ILE A 42 -8.313 -6.905 -2.443 1.00 0.00 H new ATOM 0 HA ILE A 42 -8.777 -8.991 -0.579 1.00 0.00 H new ATOM 0 HB ILE A 42 -9.513 -6.529 -0.521 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -11.647 -8.653 0.029 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -10.271 -8.359 1.074 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -11.752 -6.061 -1.493 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -10.567 -6.459 -2.760 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -11.760 -7.675 -2.244 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -12.262 -7.107 1.874 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -10.982 -5.981 1.363 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -12.379 -6.280 0.303 1.00 0.00 H new ATOM 373 N LEU A 43 -10.375 -9.148 -3.451 1.00 0.00 N ATOM 374 CA LEU A 43 -11.173 -10.023 -4.301 1.00 0.00 C ATOM 375 C LEU A 43 -10.481 -11.370 -4.487 1.00 0.00 C ATOM 376 O LEU A 43 -11.127 -12.417 -4.450 1.00 0.00 O ATOM 377 CB LEU A 43 -11.392 -9.361 -5.668 1.00 0.00 C ATOM 378 CG LEU A 43 -12.174 -10.299 -6.605 1.00 0.00 C ATOM 379 CD1 LEU A 43 -13.505 -10.709 -5.959 1.00 0.00 C ATOM 380 CD2 LEU A 43 -12.450 -9.567 -7.924 1.00 0.00 C ATOM 0 H LEU A 43 -10.059 -8.289 -3.902 1.00 0.00 H new ATOM 0 HA LEU A 43 -12.136 -10.190 -3.819 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -11.938 -8.426 -5.542 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -10.430 -9.111 -6.115 1.00 0.00 H new ATOM 0 HG LEU A 43 -11.584 -11.196 -6.791 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -14.047 -11.372 -6.633 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -13.309 -11.227 -5.020 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -14.104 -9.820 -5.765 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -13.004 -10.223 -8.595 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -13.038 -8.670 -7.727 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -11.505 -9.286 -8.389 1.00 0.00 H new ATOM 392 N ASP A 44 -9.171 -11.335 -4.694 1.00 0.00 N ATOM 393 CA ASP A 44 -8.411 -12.562 -4.892 1.00 0.00 C ATOM 394 C ASP A 44 -8.526 -13.459 -3.664 1.00 0.00 C ATOM 395 O ASP A 44 -8.702 -14.672 -3.783 1.00 0.00 O ATOM 396 CB ASP A 44 -6.938 -12.233 -5.151 1.00 0.00 C ATOM 397 CG ASP A 44 -6.772 -11.624 -6.540 1.00 0.00 C ATOM 398 OD1 ASP A 44 -7.695 -11.737 -7.329 1.00 0.00 O ATOM 399 OD2 ASP A 44 -5.723 -11.055 -6.795 1.00 0.00 O ATOM 0 H ASP A 44 -8.617 -10.479 -4.729 1.00 0.00 H new ATOM 0 HA ASP A 44 -8.819 -13.087 -5.756 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -6.575 -11.537 -4.395 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -6.335 -13.137 -5.068 1.00 0.00 H new ATOM 404 N ARG A 45 -8.429 -12.856 -2.485 1.00 0.00 N ATOM 405 CA ARG A 45 -8.527 -13.611 -1.243 1.00 0.00 C ATOM 406 C ARG A 45 -9.937 -14.165 -1.059 1.00 0.00 C ATOM 407 O ARG A 45 -10.143 -15.118 -0.310 1.00 0.00 O ATOM 408 CB ARG A 45 -8.165 -12.711 -0.051 1.00 0.00 C ATOM 409 CG ARG A 45 -8.280 -13.502 1.280 1.00 0.00 C ATOM 410 CD ARG A 45 -9.581 -13.140 2.012 1.00 0.00 C ATOM 411 NE ARG A 45 -9.534 -11.753 2.471 1.00 0.00 N ATOM 412 CZ ARG A 45 -8.949 -11.426 3.619 1.00 0.00 C ATOM 413 NH1 ARG A 45 -8.420 -12.354 4.368 1.00 0.00 N ATOM 414 NH2 ARG A 45 -8.913 -10.180 4.002 1.00 0.00 N ATOM 0 H ARG A 45 -8.284 -11.854 -2.364 1.00 0.00 H new ATOM 0 HA ARG A 45 -7.827 -14.445 -1.292 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -7.150 -12.331 -0.169 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -8.828 -11.846 -0.026 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -8.256 -14.573 1.077 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -7.424 -13.280 1.917 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -10.433 -13.282 1.346 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -9.726 -13.807 2.862 1.00 0.00 H new ATOM 0 HE ARG A 45 -9.958 -11.022 1.900 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -8.455 -13.330 4.073 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -7.971 -12.104 5.249 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -9.334 -9.455 3.421 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -8.464 -9.930 4.883 1.00 0.00 H new ATOM 428 N LEU A 46 -10.906 -13.560 -1.739 1.00 0.00 N ATOM 429 CA LEU A 46 -12.292 -14.006 -1.625 1.00 0.00 C ATOM 430 C LEU A 46 -12.429 -15.446 -2.129 1.00 0.00 C ATOM 431 O LEU A 46 -13.031 -16.290 -1.468 1.00 0.00 O ATOM 432 CB LEU A 46 -13.196 -13.070 -2.450 1.00 0.00 C ATOM 433 CG LEU A 46 -14.634 -13.092 -1.915 1.00 0.00 C ATOM 434 CD1 LEU A 46 -15.484 -12.101 -2.720 1.00 0.00 C ATOM 435 CD2 LEU A 46 -15.236 -14.502 -2.030 1.00 0.00 C ATOM 0 H LEU A 46 -10.761 -12.770 -2.367 1.00 0.00 H new ATOM 0 HA LEU A 46 -12.595 -13.976 -0.578 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -12.805 -12.053 -2.413 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -13.187 -13.377 -3.496 1.00 0.00 H new ATOM 0 HG LEU A 46 -14.624 -12.807 -0.863 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -16.507 -12.111 -2.345 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -15.070 -11.098 -2.616 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -15.480 -12.388 -3.771 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -16.256 -14.495 -1.645 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -15.245 -14.810 -3.076 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -14.635 -15.203 -1.451 1.00 0.00 H new ATOM 447 N PHE A 47 -11.855 -15.720 -3.297 1.00 0.00 N ATOM 448 CA PHE A 47 -11.923 -17.062 -3.870 1.00 0.00 C ATOM 449 C PHE A 47 -11.228 -18.071 -2.964 1.00 0.00 C ATOM 450 O PHE A 47 -11.765 -19.144 -2.686 1.00 0.00 O ATOM 451 CB PHE A 47 -11.263 -17.076 -5.253 1.00 0.00 C ATOM 452 CG PHE A 47 -12.134 -16.327 -6.235 1.00 0.00 C ATOM 453 CD1 PHE A 47 -11.989 -14.943 -6.387 1.00 0.00 C ATOM 454 CD2 PHE A 47 -13.084 -17.019 -6.997 1.00 0.00 C ATOM 455 CE1 PHE A 47 -12.794 -14.250 -7.298 1.00 0.00 C ATOM 456 CE2 PHE A 47 -13.889 -16.326 -7.910 1.00 0.00 C ATOM 457 CZ PHE A 47 -13.744 -14.941 -8.060 1.00 0.00 C ATOM 0 H PHE A 47 -11.343 -15.041 -3.860 1.00 0.00 H new ATOM 0 HA PHE A 47 -12.973 -17.340 -3.965 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -10.276 -16.616 -5.201 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -11.119 -18.103 -5.588 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -11.255 -14.410 -5.801 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -13.196 -18.087 -6.881 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -12.683 -13.182 -7.413 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -14.621 -16.859 -8.498 1.00 0.00 H new ATOM 0 HZ PHE A 47 -14.365 -14.406 -8.763 1.00 0.00 H new ATOM 467 N PHE A 48 -10.028 -17.721 -2.505 1.00 0.00 N ATOM 468 CA PHE A 48 -9.252 -18.599 -1.623 1.00 0.00 C ATOM 469 C PHE A 48 -9.126 -17.980 -0.235 1.00 0.00 C ATOM 470 O PHE A 48 -8.587 -16.886 -0.080 1.00 0.00 O ATOM 471 CB PHE A 48 -7.861 -18.816 -2.219 1.00 0.00 C ATOM 472 CG PHE A 48 -7.967 -19.720 -3.425 1.00 0.00 C ATOM 473 CD1 PHE A 48 -8.312 -19.184 -4.670 1.00 0.00 C ATOM 474 CD2 PHE A 48 -7.729 -21.093 -3.295 1.00 0.00 C ATOM 475 CE1 PHE A 48 -8.416 -20.020 -5.788 1.00 0.00 C ATOM 476 CE2 PHE A 48 -7.832 -21.930 -4.412 1.00 0.00 C ATOM 477 CZ PHE A 48 -8.176 -21.394 -5.659 1.00 0.00 C ATOM 0 H PHE A 48 -9.570 -16.837 -2.727 1.00 0.00 H new ATOM 0 HA PHE A 48 -9.766 -19.556 -1.533 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -7.423 -17.860 -2.505 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -7.200 -19.260 -1.475 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -8.498 -18.125 -4.769 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -7.466 -21.507 -2.333 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -8.681 -19.606 -6.750 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -7.646 -22.989 -4.312 1.00 0.00 H new ATOM 0 HZ PHE A 48 -8.256 -22.040 -6.521 1.00 0.00 H new ATOM 487 N LYS A 49 -9.625 -18.691 0.773 1.00 0.00 N ATOM 488 CA LYS A 49 -9.565 -18.207 2.152 1.00 0.00 C ATOM 489 C LYS A 49 -8.305 -18.717 2.843 1.00 0.00 C ATOM 490 O LYS A 49 -7.382 -19.102 2.144 1.00 0.00 O ATOM 491 CB LYS A 49 -10.799 -18.677 2.923 1.00 0.00 C ATOM 492 CG LYS A 49 -12.045 -17.992 2.357 1.00 0.00 C ATOM 493 CD LYS A 49 -13.283 -18.482 3.111 1.00 0.00 C ATOM 494 CE LYS A 49 -14.536 -17.853 2.494 1.00 0.00 C ATOM 495 NZ LYS A 49 -14.522 -16.383 2.733 1.00 0.00 N ATOM 496 OXT LYS A 49 -8.281 -18.715 4.063 1.00 0.00 O ATOM 0 H LYS A 49 -10.074 -19.600 0.663 1.00 0.00 H new ATOM 0 HA LYS A 49 -9.541 -17.117 2.136 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -10.899 -19.760 2.845 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -10.691 -18.442 3.982 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -11.953 -16.910 2.452 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -12.143 -18.212 1.294 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -13.346 -19.569 3.061 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -13.210 -18.215 4.165 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -14.570 -18.058 1.424 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -15.431 -18.295 2.932 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -15.476 -15.998 2.582 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -14.223 -16.193 3.711 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -13.857 -15.930 2.074 1.00 0.00 H new TER 510 LYS A 49 ATOM 511 N SER B 19 17.905 19.772 0.433 1.00 0.00 N ATOM 512 CA SER B 19 17.393 20.181 -0.905 1.00 0.00 C ATOM 513 C SER B 19 15.929 19.774 -1.029 1.00 0.00 C ATOM 514 O SER B 19 15.460 18.885 -0.316 1.00 0.00 O ATOM 515 CB SER B 19 18.216 19.493 -1.995 1.00 0.00 C ATOM 516 OG SER B 19 18.076 18.085 -1.872 1.00 0.00 O ATOM 0 HA SER B 19 17.479 21.262 -1.018 1.00 0.00 H new ATOM 0 HB2 SER B 19 17.881 19.818 -2.980 1.00 0.00 H new ATOM 0 HB3 SER B 19 19.265 19.775 -1.907 1.00 0.00 H new ATOM 0 HG SER B 19 18.007 17.845 -0.924 1.00 0.00 H new ATOM 524 N ASN B 20 15.212 20.428 -1.939 1.00 0.00 N ATOM 525 CA ASN B 20 13.800 20.120 -2.149 1.00 0.00 C ATOM 526 C ASN B 20 13.022 20.254 -0.844 1.00 0.00 C ATOM 527 O ASN B 20 12.147 19.440 -0.548 1.00 0.00 O ATOM 528 CB ASN B 20 13.648 18.701 -2.699 1.00 0.00 C ATOM 529 CG ASN B 20 14.307 18.597 -4.072 1.00 0.00 C ATOM 530 OD1 ASN B 20 14.397 19.658 -4.828 1.00 0.00 O flip ATOM 531 ND2 ASN B 20 14.754 17.520 -4.465 1.00 0.00 N flip ATOM 0 H ASN B 20 15.580 21.167 -2.537 1.00 0.00 H new ATOM 0 HA ASN B 20 13.397 20.830 -2.871 1.00 0.00 H new ATOM 0 HB2 ASN B 20 14.103 17.986 -2.013 1.00 0.00 H new ATOM 0 HB3 ASN B 20 12.592 18.443 -2.774 1.00 0.00 H new ATOM 0 HD21 ASN B 20 14.683 16.692 -3.874 1.00 0.00 H new ATOM 0 HD22 ASN B 20 15.195 17.455 -5.382 1.00 0.00 H new ATOM 538 N ASP B 21 13.353 21.277 -0.065 1.00 0.00 N ATOM 539 CA ASP B 21 12.683 21.502 1.209 1.00 0.00 C ATOM 540 C ASP B 21 11.188 21.726 1.004 1.00 0.00 C ATOM 541 O ASP B 21 10.366 21.242 1.783 1.00 0.00 O ATOM 542 CB ASP B 21 13.289 22.723 1.908 1.00 0.00 C ATOM 543 CG ASP B 21 12.577 22.975 3.232 1.00 0.00 C ATOM 544 OD1 ASP B 21 12.600 22.090 4.073 1.00 0.00 O ATOM 545 OD2 ASP B 21 12.019 24.049 3.387 1.00 0.00 O ATOM 0 H ASP B 21 14.076 21.959 -0.291 1.00 0.00 H new ATOM 0 HA ASP B 21 12.823 20.616 1.829 1.00 0.00 H new ATOM 0 HB2 ASP B 21 14.353 22.561 2.083 1.00 0.00 H new ATOM 0 HB3 ASP B 21 13.202 23.600 1.266 1.00 0.00 H new ATOM 550 N SER B 22 10.840 22.466 -0.045 1.00 0.00 N ATOM 551 CA SER B 22 9.437 22.748 -0.338 1.00 0.00 C ATOM 552 C SER B 22 8.671 21.453 -0.601 1.00 0.00 C ATOM 553 O SER B 22 7.559 21.266 -0.104 1.00 0.00 O ATOM 554 CB SER B 22 9.336 23.663 -1.557 1.00 0.00 C ATOM 555 OG SER B 22 7.969 23.962 -1.810 1.00 0.00 O ATOM 0 H SER B 22 11.503 22.878 -0.701 1.00 0.00 H new ATOM 0 HA SER B 22 8.996 23.244 0.526 1.00 0.00 H new ATOM 0 HB2 SER B 22 9.895 24.583 -1.383 1.00 0.00 H new ATOM 0 HB3 SER B 22 9.781 23.179 -2.427 1.00 0.00 H new ATOM 0 HG SER B 22 7.902 24.550 -2.591 1.00 0.00 H new ATOM 561 N SER B 23 9.275 20.559 -1.382 1.00 0.00 N ATOM 562 CA SER B 23 8.658 19.272 -1.711 1.00 0.00 C ATOM 563 C SER B 23 9.473 18.137 -1.099 1.00 0.00 C ATOM 564 O SER B 23 10.517 17.754 -1.628 1.00 0.00 O ATOM 565 CB SER B 23 8.605 19.094 -3.230 1.00 0.00 C ATOM 566 OG SER B 23 7.999 17.844 -3.536 1.00 0.00 O ATOM 0 H SER B 23 10.194 20.702 -1.801 1.00 0.00 H new ATOM 0 HA SER B 23 7.646 19.252 -1.308 1.00 0.00 H new ATOM 0 HB2 SER B 23 8.038 19.907 -3.683 1.00 0.00 H new ATOM 0 HB3 SER B 23 9.611 19.136 -3.648 1.00 0.00 H new ATOM 0 HG SER B 23 7.962 17.728 -4.508 1.00 0.00 H new ATOM 572 N ASP B 24 8.999 17.614 0.027 1.00 0.00 N ATOM 573 CA ASP B 24 9.703 16.534 0.707 1.00 0.00 C ATOM 574 C ASP B 24 9.810 15.301 -0.202 1.00 0.00 C ATOM 575 O ASP B 24 8.818 14.901 -0.813 1.00 0.00 O ATOM 576 CB ASP B 24 8.958 16.154 1.989 1.00 0.00 C ATOM 577 CG ASP B 24 9.853 15.297 2.881 1.00 0.00 C ATOM 578 OD1 ASP B 24 10.082 14.151 2.532 1.00 0.00 O ATOM 579 OD2 ASP B 24 10.295 15.800 3.899 1.00 0.00 O ATOM 0 H ASP B 24 8.139 17.917 0.484 1.00 0.00 H new ATOM 0 HA ASP B 24 10.707 16.880 0.953 1.00 0.00 H new ATOM 0 HB2 ASP B 24 8.654 17.054 2.523 1.00 0.00 H new ATOM 0 HB3 ASP B 24 8.048 15.608 1.742 1.00 0.00 H new ATOM 584 N PRO B 25 10.972 14.685 -0.318 1.00 0.00 N ATOM 585 CA PRO B 25 11.145 13.484 -1.191 1.00 0.00 C ATOM 586 C PRO B 25 10.450 12.246 -0.617 1.00 0.00 C ATOM 587 O PRO B 25 10.195 11.280 -1.335 1.00 0.00 O ATOM 588 CB PRO B 25 12.670 13.296 -1.256 1.00 0.00 C ATOM 589 CG PRO B 25 13.188 13.900 0.009 1.00 0.00 C ATOM 590 CD PRO B 25 12.238 15.049 0.357 1.00 0.00 C ATOM 0 HA PRO B 25 10.693 13.620 -2.173 1.00 0.00 H new ATOM 0 HB2 PRO B 25 12.935 12.241 -1.327 1.00 0.00 H new ATOM 0 HB3 PRO B 25 13.092 13.790 -2.131 1.00 0.00 H new ATOM 0 HG2 PRO B 25 13.215 13.161 0.810 1.00 0.00 H new ATOM 0 HG3 PRO B 25 14.207 14.264 -0.123 1.00 0.00 H new ATOM 0 HD2 PRO B 25 12.103 15.143 1.435 1.00 0.00 H new ATOM 0 HD3 PRO B 25 12.620 16.005 -0.001 1.00 0.00 H new ATOM 598 N LEU B 26 10.159 12.276 0.679 1.00 0.00 N ATOM 599 CA LEU B 26 9.508 11.141 1.327 1.00 0.00 C ATOM 600 C LEU B 26 8.128 10.895 0.720 1.00 0.00 C ATOM 601 O LEU B 26 7.764 9.755 0.430 1.00 0.00 O ATOM 602 CB LEU B 26 9.373 11.410 2.830 1.00 0.00 C ATOM 603 CG LEU B 26 8.756 10.197 3.544 1.00 0.00 C ATOM 604 CD1 LEU B 26 9.676 8.969 3.406 1.00 0.00 C ATOM 605 CD2 LEU B 26 8.567 10.535 5.028 1.00 0.00 C ATOM 0 H LEU B 26 10.360 13.063 1.296 1.00 0.00 H new ATOM 0 HA LEU B 26 10.120 10.253 1.171 1.00 0.00 H new ATOM 0 HB2 LEU B 26 10.352 11.629 3.255 1.00 0.00 H new ATOM 0 HB3 LEU B 26 8.751 12.290 2.993 1.00 0.00 H new ATOM 0 HG LEU B 26 7.793 9.963 3.089 1.00 0.00 H new ATOM 0 HD11 LEU B 26 9.226 8.118 3.917 1.00 0.00 H new ATOM 0 HD12 LEU B 26 9.809 8.730 2.351 1.00 0.00 H new ATOM 0 HD13 LEU B 26 10.646 9.189 3.853 1.00 0.00 H new ATOM 0 HD21 LEU B 26 8.129 9.680 5.543 1.00 0.00 H new ATOM 0 HD22 LEU B 26 9.533 10.771 5.473 1.00 0.00 H new ATOM 0 HD23 LEU B 26 7.904 11.395 5.124 1.00 0.00 H new ATOM 617 N VAL B 27 7.367 11.967 0.531 1.00 0.00 N ATOM 618 CA VAL B 27 6.030 11.849 -0.042 1.00 0.00 C ATOM 619 C VAL B 27 6.107 11.346 -1.481 1.00 0.00 C ATOM 620 O VAL B 27 5.356 10.455 -1.877 1.00 0.00 O ATOM 621 CB VAL B 27 5.324 13.207 -0.002 1.00 0.00 C ATOM 622 CG1 VAL B 27 3.986 13.116 -0.743 1.00 0.00 C ATOM 623 CG2 VAL B 27 5.069 13.603 1.457 1.00 0.00 C ATOM 0 H VAL B 27 7.649 12.919 0.763 1.00 0.00 H new ATOM 0 HA VAL B 27 5.461 11.130 0.548 1.00 0.00 H new ATOM 0 HB VAL B 27 5.953 13.956 -0.483 1.00 0.00 H new ATOM 0 HG11 VAL B 27 3.487 14.084 -0.712 1.00 0.00 H new ATOM 0 HG12 VAL B 27 4.163 12.832 -1.780 1.00 0.00 H new ATOM 0 HG13 VAL B 27 3.355 12.367 -0.264 1.00 0.00 H new ATOM 0 HG21 VAL B 27 4.566 14.570 1.489 1.00 0.00 H new ATOM 0 HG22 VAL B 27 4.440 12.851 1.934 1.00 0.00 H new ATOM 0 HG23 VAL B 27 6.019 13.670 1.987 1.00 0.00 H new ATOM 633 N VAL B 28 7.018 11.924 -2.256 1.00 0.00 N ATOM 634 CA VAL B 28 7.182 11.527 -3.651 1.00 0.00 C ATOM 635 C VAL B 28 7.641 10.076 -3.743 1.00 0.00 C ATOM 636 O VAL B 28 7.119 9.299 -4.543 1.00 0.00 O ATOM 637 CB VAL B 28 8.205 12.437 -4.334 1.00 0.00 C ATOM 638 CG1 VAL B 28 8.470 11.940 -5.757 1.00 0.00 C ATOM 639 CG2 VAL B 28 7.657 13.866 -4.387 1.00 0.00 C ATOM 0 H VAL B 28 7.650 12.663 -1.946 1.00 0.00 H new ATOM 0 HA VAL B 28 6.220 11.622 -4.155 1.00 0.00 H new ATOM 0 HB VAL B 28 9.137 12.422 -3.768 1.00 0.00 H new ATOM 0 HG11 VAL B 28 9.199 12.591 -6.240 1.00 0.00 H new ATOM 0 HG12 VAL B 28 8.860 10.923 -5.720 1.00 0.00 H new ATOM 0 HG13 VAL B 28 7.540 11.952 -6.326 1.00 0.00 H new ATOM 0 HG21 VAL B 28 8.384 14.517 -4.873 1.00 0.00 H new ATOM 0 HG22 VAL B 28 6.725 13.877 -4.952 1.00 0.00 H new ATOM 0 HG23 VAL B 28 7.472 14.222 -3.374 1.00 0.00 H new ATOM 649 N ALA B 29 8.620 9.717 -2.918 1.00 0.00 N ATOM 650 CA ALA B 29 9.141 8.356 -2.919 1.00 0.00 C ATOM 651 C ALA B 29 8.066 7.368 -2.485 1.00 0.00 C ATOM 652 O ALA B 29 7.965 6.268 -3.025 1.00 0.00 O ATOM 653 CB ALA B 29 10.340 8.253 -1.972 1.00 0.00 C ATOM 0 H ALA B 29 9.064 10.343 -2.247 1.00 0.00 H new ATOM 0 HA ALA B 29 9.456 8.111 -3.934 1.00 0.00 H new ATOM 0 HB1 ALA B 29 10.723 7.232 -1.979 1.00 0.00 H new ATOM 0 HB2 ALA B 29 11.123 8.936 -2.301 1.00 0.00 H new ATOM 0 HB3 ALA B 29 10.029 8.517 -0.961 1.00 0.00 H new ATOM 659 N ALA B 30 7.263 7.762 -1.503 1.00 0.00 N ATOM 660 CA ALA B 30 6.204 6.893 -1.006 1.00 0.00 C ATOM 661 C ALA B 30 5.269 6.483 -2.140 1.00 0.00 C ATOM 662 O ALA B 30 4.947 5.306 -2.294 1.00 0.00 O ATOM 663 CB ALA B 30 5.403 7.613 0.081 1.00 0.00 C ATOM 0 H ALA B 30 7.324 8.669 -1.039 1.00 0.00 H new ATOM 0 HA ALA B 30 6.663 5.998 -0.587 1.00 0.00 H new ATOM 0 HB1 ALA B 30 4.614 6.956 0.447 1.00 0.00 H new ATOM 0 HB2 ALA B 30 6.065 7.878 0.905 1.00 0.00 H new ATOM 0 HB3 ALA B 30 4.959 8.518 -0.334 1.00 0.00 H new ATOM 669 N ASN B 31 4.836 7.460 -2.929 1.00 0.00 N ATOM 670 CA ASN B 31 3.940 7.183 -4.044 1.00 0.00 C ATOM 671 C ASN B 31 4.625 6.299 -5.083 1.00 0.00 C ATOM 672 O ASN B 31 4.016 5.376 -5.624 1.00 0.00 O ATOM 673 CB ASN B 31 3.504 8.496 -4.695 1.00 0.00 C ATOM 674 CG ASN B 31 2.561 9.251 -3.764 1.00 0.00 C ATOM 675 OD1 ASN B 31 1.956 8.653 -2.875 1.00 0.00 O ATOM 676 ND2 ASN B 31 2.405 10.538 -3.910 1.00 0.00 N ATOM 0 H ASN B 31 5.088 8.442 -2.819 1.00 0.00 H new ATOM 0 HA ASN B 31 3.066 6.656 -3.661 1.00 0.00 H new ATOM 0 HB2 ASN B 31 4.377 9.109 -4.917 1.00 0.00 H new ATOM 0 HB3 ASN B 31 3.007 8.294 -5.644 1.00 0.00 H new ATOM 0 HD21 ASN B 31 1.781 11.050 -3.287 1.00 0.00 H new ATOM 0 HD22 ASN B 31 2.907 11.032 -4.647 1.00 0.00 H new ATOM 683 N ILE B 32 5.894 6.589 -5.359 1.00 0.00 N ATOM 684 CA ILE B 32 6.649 5.814 -6.337 1.00 0.00 C ATOM 685 C ILE B 32 6.821 4.372 -5.862 1.00 0.00 C ATOM 686 O ILE B 32 6.658 3.428 -6.636 1.00 0.00 O ATOM 687 CB ILE B 32 8.023 6.454 -6.562 1.00 0.00 C ATOM 688 CG1 ILE B 32 7.841 7.810 -7.249 1.00 0.00 C ATOM 689 CG2 ILE B 32 8.878 5.546 -7.451 1.00 0.00 C ATOM 690 CD1 ILE B 32 9.164 8.577 -7.229 1.00 0.00 C ATOM 0 H ILE B 32 6.417 7.349 -4.923 1.00 0.00 H new ATOM 0 HA ILE B 32 6.096 5.808 -7.276 1.00 0.00 H new ATOM 0 HB ILE B 32 8.521 6.590 -5.602 1.00 0.00 H new ATOM 0 HG12 ILE B 32 7.508 7.666 -8.277 1.00 0.00 H new ATOM 0 HG13 ILE B 32 7.068 8.386 -6.741 1.00 0.00 H new ATOM 0 HG21 ILE B 32 9.854 6.005 -7.608 1.00 0.00 H new ATOM 0 HG22 ILE B 32 9.006 4.578 -6.966 1.00 0.00 H new ATOM 0 HG23 ILE B 32 8.383 5.407 -8.412 1.00 0.00 H new ATOM 0 HD11 ILE B 32 9.033 9.542 -7.718 1.00 0.00 H new ATOM 0 HD12 ILE B 32 9.478 8.733 -6.197 1.00 0.00 H new ATOM 0 HD13 ILE B 32 9.925 8.003 -7.757 1.00 0.00 H new ATOM 702 N ILE B 33 7.152 4.211 -4.586 1.00 0.00 N ATOM 703 CA ILE B 33 7.343 2.883 -4.015 1.00 0.00 C ATOM 704 C ILE B 33 6.040 2.082 -4.052 1.00 0.00 C ATOM 705 O ILE B 33 6.041 0.900 -4.396 1.00 0.00 O ATOM 706 CB ILE B 33 7.851 3.007 -2.573 1.00 0.00 C ATOM 707 CG1 ILE B 33 9.285 3.548 -2.579 1.00 0.00 C ATOM 708 CG2 ILE B 33 7.825 1.637 -1.892 1.00 0.00 C ATOM 709 CD1 ILE B 33 9.689 3.950 -1.157 1.00 0.00 C ATOM 0 H ILE B 33 7.293 4.979 -3.930 1.00 0.00 H new ATOM 0 HA ILE B 33 8.084 2.351 -4.611 1.00 0.00 H new ATOM 0 HB ILE B 33 7.205 3.692 -2.024 1.00 0.00 H new ATOM 0 HG12 ILE B 33 9.969 2.790 -2.961 1.00 0.00 H new ATOM 0 HG13 ILE B 33 9.357 4.408 -3.245 1.00 0.00 H new ATOM 0 HG21 ILE B 33 8.187 1.733 -0.868 1.00 0.00 H new ATOM 0 HG22 ILE B 33 6.804 1.255 -1.882 1.00 0.00 H new ATOM 0 HG23 ILE B 33 8.465 0.946 -2.440 1.00 0.00 H new ATOM 0 HD11 ILE B 33 10.709 4.334 -1.163 1.00 0.00 H new ATOM 0 HD12 ILE B 33 9.012 4.722 -0.791 1.00 0.00 H new ATOM 0 HD13 ILE B 33 9.633 3.080 -0.503 1.00 0.00 H new ATOM 721 N GLY B 34 4.935 2.725 -3.694 1.00 0.00 N ATOM 722 CA GLY B 34 3.641 2.048 -3.690 1.00 0.00 C ATOM 723 C GLY B 34 3.278 1.563 -5.091 1.00 0.00 C ATOM 724 O GLY B 34 2.823 0.431 -5.271 1.00 0.00 O ATOM 0 H GLY B 34 4.906 3.703 -3.406 1.00 0.00 H new ATOM 0 HA2 GLY B 34 3.671 1.202 -3.004 1.00 0.00 H new ATOM 0 HA3 GLY B 34 2.871 2.728 -3.325 1.00 0.00 H new ATOM 728 N ILE B 35 3.487 2.423 -6.081 1.00 0.00 N ATOM 729 CA ILE B 35 3.185 2.075 -7.464 1.00 0.00 C ATOM 730 C ILE B 35 4.076 0.922 -7.922 1.00 0.00 C ATOM 731 O ILE B 35 3.615 -0.015 -8.580 1.00 0.00 O ATOM 732 CB ILE B 35 3.394 3.297 -8.363 1.00 0.00 C ATOM 733 CG1 ILE B 35 2.343 4.357 -8.020 1.00 0.00 C ATOM 734 CG2 ILE B 35 3.239 2.888 -9.830 1.00 0.00 C ATOM 735 CD1 ILE B 35 2.730 5.694 -8.656 1.00 0.00 C ATOM 0 H ILE B 35 3.863 3.363 -5.953 1.00 0.00 H new ATOM 0 HA ILE B 35 2.144 1.759 -7.533 1.00 0.00 H new ATOM 0 HB ILE B 35 4.394 3.701 -8.204 1.00 0.00 H new ATOM 0 HG12 ILE B 35 1.364 4.042 -8.381 1.00 0.00 H new ATOM 0 HG13 ILE B 35 2.264 4.467 -6.939 1.00 0.00 H new ATOM 0 HG21 ILE B 35 3.388 3.759 -10.468 1.00 0.00 H new ATOM 0 HG22 ILE B 35 3.980 2.127 -10.076 1.00 0.00 H new ATOM 0 HG23 ILE B 35 2.239 2.486 -9.992 1.00 0.00 H new ATOM 0 HD11 ILE B 35 1.979 6.445 -8.409 1.00 0.00 H new ATOM 0 HD12 ILE B 35 3.700 6.011 -8.274 1.00 0.00 H new ATOM 0 HD13 ILE B 35 2.786 5.579 -9.738 1.00 0.00 H new ATOM 747 N LEU B 36 5.353 0.997 -7.565 1.00 0.00 N ATOM 748 CA LEU B 36 6.301 -0.044 -7.940 1.00 0.00 C ATOM 749 C LEU B 36 5.868 -1.376 -7.344 1.00 0.00 C ATOM 750 O LEU B 36 5.993 -2.423 -7.984 1.00 0.00 O ATOM 751 CB LEU B 36 7.707 0.317 -7.442 1.00 0.00 C ATOM 752 CG LEU B 36 8.720 -0.760 -7.867 1.00 0.00 C ATOM 753 CD1 LEU B 36 8.774 -0.871 -9.401 1.00 0.00 C ATOM 754 CD2 LEU B 36 10.104 -0.377 -7.332 1.00 0.00 C ATOM 0 H LEU B 36 5.753 1.761 -7.021 1.00 0.00 H new ATOM 0 HA LEU B 36 6.322 -0.127 -9.027 1.00 0.00 H new ATOM 0 HB2 LEU B 36 8.005 1.285 -7.845 1.00 0.00 H new ATOM 0 HB3 LEU B 36 7.702 0.412 -6.356 1.00 0.00 H new ATOM 0 HG LEU B 36 8.413 -1.723 -7.459 1.00 0.00 H new ATOM 0 HD11 LEU B 36 9.495 -1.637 -9.685 1.00 0.00 H new ATOM 0 HD12 LEU B 36 7.789 -1.141 -9.781 1.00 0.00 H new ATOM 0 HD13 LEU B 36 9.076 0.087 -9.825 1.00 0.00 H new ATOM 0 HD21 LEU B 36 10.831 -1.134 -7.627 1.00 0.00 H new ATOM 0 HD22 LEU B 36 10.399 0.589 -7.743 1.00 0.00 H new ATOM 0 HD23 LEU B 36 10.069 -0.313 -6.244 1.00 0.00 H new ATOM 766 N HIS B 37 5.353 -1.333 -6.121 1.00 0.00 N ATOM 767 CA HIS B 37 4.903 -2.548 -5.457 1.00 0.00 C ATOM 768 C HIS B 37 3.832 -3.232 -6.295 1.00 0.00 C ATOM 769 O HIS B 37 3.828 -4.455 -6.435 1.00 0.00 O ATOM 770 CB HIS B 37 4.326 -2.215 -4.079 1.00 0.00 C ATOM 771 CG HIS B 37 3.914 -3.494 -3.400 1.00 0.00 C ATOM 772 ND1 HIS B 37 4.485 -3.923 -2.215 1.00 0.00 N ATOM 773 CD2 HIS B 37 2.995 -4.454 -3.736 1.00 0.00 C ATOM 774 CE1 HIS B 37 3.909 -5.096 -1.891 1.00 0.00 C ATOM 775 NE2 HIS B 37 2.995 -5.462 -2.786 1.00 0.00 N ATOM 0 H HIS B 37 5.238 -0.479 -5.575 1.00 0.00 H new ATOM 0 HA HIS B 37 5.757 -3.215 -5.339 1.00 0.00 H new ATOM 0 HB2 HIS B 37 5.068 -1.691 -3.477 1.00 0.00 H new ATOM 0 HB3 HIS B 37 3.469 -1.549 -4.180 1.00 0.00 H new ATOM 0 HD2 HIS B 37 2.364 -4.428 -4.612 1.00 0.00 H new ATOM 0 HE1 HIS B 37 4.159 -5.670 -1.011 1.00 0.00 H new ATOM 0 HE2 HIS B 37 2.419 -6.303 -2.775 1.00 0.00 H new ATOM 783 N LEU B 38 2.924 -2.439 -6.851 1.00 0.00 N ATOM 784 CA LEU B 38 1.850 -2.993 -7.671 1.00 0.00 C ATOM 785 C LEU B 38 2.408 -3.736 -8.876 1.00 0.00 C ATOM 786 O LEU B 38 1.893 -4.787 -9.245 1.00 0.00 O ATOM 787 CB LEU B 38 0.900 -1.868 -8.135 1.00 0.00 C ATOM 788 CG LEU B 38 -0.248 -1.683 -7.119 1.00 0.00 C ATOM 789 CD1 LEU B 38 -0.831 -0.277 -7.243 1.00 0.00 C ATOM 790 CD2 LEU B 38 -1.358 -2.717 -7.387 1.00 0.00 C ATOM 0 H LEU B 38 2.907 -1.424 -6.752 1.00 0.00 H new ATOM 0 HA LEU B 38 1.292 -3.704 -7.062 1.00 0.00 H new ATOM 0 HB2 LEU B 38 1.454 -0.936 -8.241 1.00 0.00 H new ATOM 0 HB3 LEU B 38 0.491 -2.110 -9.116 1.00 0.00 H new ATOM 0 HG LEU B 38 0.147 -1.826 -6.113 1.00 0.00 H new ATOM 0 HD11 LEU B 38 -1.640 -0.154 -6.523 1.00 0.00 H new ATOM 0 HD12 LEU B 38 -0.052 0.459 -7.043 1.00 0.00 H new ATOM 0 HD13 LEU B 38 -1.217 -0.131 -8.252 1.00 0.00 H new ATOM 0 HD21 LEU B 38 -2.164 -2.580 -6.666 1.00 0.00 H new ATOM 0 HD22 LEU B 38 -1.746 -2.581 -8.396 1.00 0.00 H new ATOM 0 HD23 LEU B 38 -0.950 -3.723 -7.288 1.00 0.00 H new ATOM 802 N ILE B 39 3.445 -3.192 -9.496 1.00 0.00 N ATOM 803 CA ILE B 39 4.021 -3.844 -10.664 1.00 0.00 C ATOM 804 C ILE B 39 4.570 -5.222 -10.295 1.00 0.00 C ATOM 805 O ILE B 39 4.361 -6.197 -11.017 1.00 0.00 O ATOM 806 CB ILE B 39 5.142 -2.974 -11.242 1.00 0.00 C ATOM 807 CG1 ILE B 39 4.534 -1.692 -11.818 1.00 0.00 C ATOM 808 CG2 ILE B 39 5.869 -3.736 -12.355 1.00 0.00 C ATOM 809 CD1 ILE B 39 5.648 -0.699 -12.157 1.00 0.00 C ATOM 0 H ILE B 39 3.897 -2.321 -9.219 1.00 0.00 H new ATOM 0 HA ILE B 39 3.239 -3.972 -11.413 1.00 0.00 H new ATOM 0 HB ILE B 39 5.853 -2.726 -10.454 1.00 0.00 H new ATOM 0 HG12 ILE B 39 3.955 -1.923 -12.712 1.00 0.00 H new ATOM 0 HG13 ILE B 39 3.846 -1.249 -11.098 1.00 0.00 H new ATOM 0 HG21 ILE B 39 6.665 -3.113 -12.763 1.00 0.00 H new ATOM 0 HG22 ILE B 39 6.297 -4.652 -11.949 1.00 0.00 H new ATOM 0 HG23 ILE B 39 5.162 -3.986 -13.147 1.00 0.00 H new ATOM 0 HD11 ILE B 39 5.211 0.212 -12.567 1.00 0.00 H new ATOM 0 HD12 ILE B 39 6.208 -0.458 -11.254 1.00 0.00 H new ATOM 0 HD13 ILE B 39 6.319 -1.142 -12.893 1.00 0.00 H new ATOM 821 N LEU B 40 5.277 -5.298 -9.176 1.00 0.00 N ATOM 822 CA LEU B 40 5.845 -6.566 -8.733 1.00 0.00 C ATOM 823 C LEU B 40 4.756 -7.511 -8.212 1.00 0.00 C ATOM 824 O LEU B 40 4.762 -8.704 -8.516 1.00 0.00 O ATOM 825 CB LEU B 40 6.882 -6.311 -7.642 1.00 0.00 C ATOM 826 CG LEU B 40 7.884 -5.253 -8.128 1.00 0.00 C ATOM 827 CD1 LEU B 40 8.897 -4.963 -7.018 1.00 0.00 C ATOM 828 CD2 LEU B 40 8.619 -5.763 -9.380 1.00 0.00 C ATOM 0 H LEU B 40 5.470 -4.506 -8.563 1.00 0.00 H new ATOM 0 HA LEU B 40 6.324 -7.044 -9.588 1.00 0.00 H new ATOM 0 HB2 LEU B 40 6.391 -5.971 -6.730 1.00 0.00 H new ATOM 0 HB3 LEU B 40 7.403 -7.236 -7.397 1.00 0.00 H new ATOM 0 HG LEU B 40 7.347 -4.338 -8.379 1.00 0.00 H new ATOM 0 HD11 LEU B 40 9.609 -4.212 -7.362 1.00 0.00 H new ATOM 0 HD12 LEU B 40 8.375 -4.591 -6.137 1.00 0.00 H new ATOM 0 HD13 LEU B 40 9.430 -5.879 -6.764 1.00 0.00 H new ATOM 0 HD21 LEU B 40 9.328 -5.007 -9.719 1.00 0.00 H new ATOM 0 HD22 LEU B 40 9.155 -6.681 -9.139 1.00 0.00 H new ATOM 0 HD23 LEU B 40 7.896 -5.962 -10.171 1.00 0.00 H new ATOM 840 N TRP B 41 3.834 -6.974 -7.414 1.00 0.00 N ATOM 841 CA TRP B 41 2.755 -7.780 -6.843 1.00 0.00 C ATOM 842 C TRP B 41 1.784 -8.261 -7.921 1.00 0.00 C ATOM 843 O TRP B 41 1.409 -9.432 -7.945 1.00 0.00 O ATOM 844 CB TRP B 41 2.008 -6.961 -5.781 1.00 0.00 C ATOM 845 CG TRP B 41 0.767 -7.682 -5.342 1.00 0.00 C ATOM 846 CD1 TRP B 41 0.713 -8.641 -4.388 1.00 0.00 C ATOM 847 CD2 TRP B 41 -0.598 -7.483 -5.799 1.00 0.00 C ATOM 848 NE1 TRP B 41 -0.598 -9.062 -4.255 1.00 0.00 N ATOM 849 CE2 TRP B 41 -1.442 -8.373 -5.099 1.00 0.00 C ATOM 850 CE3 TRP B 41 -1.180 -6.628 -6.749 1.00 0.00 C ATOM 851 CZ2 TRP B 41 -2.813 -8.411 -5.333 1.00 0.00 C ATOM 852 CZ3 TRP B 41 -2.563 -6.660 -6.980 1.00 0.00 C ATOM 853 CH2 TRP B 41 -3.376 -7.551 -6.276 1.00 0.00 C ATOM 0 H TRP B 41 3.812 -5.989 -7.149 1.00 0.00 H new ATOM 0 HA TRP B 41 3.196 -8.663 -6.380 1.00 0.00 H new ATOM 0 HB2 TRP B 41 2.658 -6.787 -4.923 1.00 0.00 H new ATOM 0 HB3 TRP B 41 1.745 -5.984 -6.185 1.00 0.00 H new ATOM 0 HD1 TRP B 41 1.554 -9.016 -3.824 1.00 0.00 H new ATOM 0 HE1 TRP B 41 -0.903 -9.792 -3.611 1.00 0.00 H new ATOM 0 HE3 TRP B 41 -0.559 -5.942 -7.305 1.00 0.00 H new ATOM 0 HZ2 TRP B 41 -3.438 -9.103 -4.787 1.00 0.00 H new ATOM 0 HZ3 TRP B 41 -3.002 -5.992 -7.706 1.00 0.00 H new ATOM 0 HH2 TRP B 41 -4.440 -7.574 -6.462 1.00 0.00 H new ATOM 864 N ILE B 42 1.369 -7.356 -8.799 1.00 0.00 N ATOM 865 CA ILE B 42 0.428 -7.716 -9.855 1.00 0.00 C ATOM 866 C ILE B 42 1.069 -8.724 -10.806 1.00 0.00 C ATOM 867 O ILE B 42 0.416 -9.654 -11.275 1.00 0.00 O ATOM 868 CB ILE B 42 -0.014 -6.460 -10.626 1.00 0.00 C ATOM 869 CG1 ILE B 42 -1.281 -6.768 -11.434 1.00 0.00 C ATOM 870 CG2 ILE B 42 1.095 -5.999 -11.585 1.00 0.00 C ATOM 871 CD1 ILE B 42 -1.812 -5.477 -12.059 1.00 0.00 C ATOM 0 H ILE B 42 1.664 -6.380 -8.803 1.00 0.00 H new ATOM 0 HA ILE B 42 -0.452 -8.172 -9.402 1.00 0.00 H new ATOM 0 HB ILE B 42 -0.216 -5.666 -9.907 1.00 0.00 H new ATOM 0 HG12 ILE B 42 -1.060 -7.498 -12.213 1.00 0.00 H new ATOM 0 HG13 ILE B 42 -2.039 -7.211 -10.788 1.00 0.00 H new ATOM 0 HG21 ILE B 42 0.765 -5.110 -12.122 1.00 0.00 H new ATOM 0 HG22 ILE B 42 1.995 -5.766 -11.016 1.00 0.00 H new ATOM 0 HG23 ILE B 42 1.313 -6.794 -12.299 1.00 0.00 H new ATOM 0 HD11 ILE B 42 -2.712 -5.694 -12.634 1.00 0.00 H new ATOM 0 HD12 ILE B 42 -2.048 -4.762 -11.271 1.00 0.00 H new ATOM 0 HD13 ILE B 42 -1.054 -5.054 -12.718 1.00 0.00 H new ATOM 883 N LEU B 43 2.354 -8.525 -11.084 1.00 0.00 N ATOM 884 CA LEU B 43 3.080 -9.418 -11.982 1.00 0.00 C ATOM 885 C LEU B 43 3.111 -10.833 -11.420 1.00 0.00 C ATOM 886 O LEU B 43 2.936 -11.805 -12.156 1.00 0.00 O ATOM 887 CB LEU B 43 4.514 -8.907 -12.177 1.00 0.00 C ATOM 888 CG LEU B 43 5.317 -9.872 -13.064 1.00 0.00 C ATOM 889 CD1 LEU B 43 4.604 -10.078 -14.408 1.00 0.00 C ATOM 890 CD2 LEU B 43 6.710 -9.282 -13.308 1.00 0.00 C ATOM 0 H LEU B 43 2.911 -7.760 -10.704 1.00 0.00 H new ATOM 0 HA LEU B 43 2.567 -9.435 -12.944 1.00 0.00 H new ATOM 0 HB2 LEU B 43 4.494 -7.917 -12.633 1.00 0.00 H new ATOM 0 HB3 LEU B 43 5.003 -8.802 -11.209 1.00 0.00 H new ATOM 0 HG LEU B 43 5.402 -10.836 -12.562 1.00 0.00 H new ATOM 0 HD11 LEU B 43 5.184 -10.764 -15.026 1.00 0.00 H new ATOM 0 HD12 LEU B 43 3.613 -10.496 -14.234 1.00 0.00 H new ATOM 0 HD13 LEU B 43 4.509 -9.120 -14.920 1.00 0.00 H new ATOM 0 HD21 LEU B 43 7.287 -9.960 -13.937 1.00 0.00 H new ATOM 0 HD22 LEU B 43 6.614 -8.318 -13.807 1.00 0.00 H new ATOM 0 HD23 LEU B 43 7.221 -9.148 -12.354 1.00 0.00 H new ATOM 902 N ASP B 44 3.342 -10.946 -10.117 1.00 0.00 N ATOM 903 CA ASP B 44 3.402 -12.254 -9.475 1.00 0.00 C ATOM 904 C ASP B 44 2.072 -12.981 -9.637 1.00 0.00 C ATOM 905 O ASP B 44 2.041 -14.178 -9.924 1.00 0.00 O ATOM 906 CB ASP B 44 3.722 -12.094 -7.987 1.00 0.00 C ATOM 907 CG ASP B 44 5.177 -11.675 -7.804 1.00 0.00 C ATOM 908 OD1 ASP B 44 5.932 -11.795 -8.755 1.00 0.00 O ATOM 909 OD2 ASP B 44 5.515 -11.240 -6.715 1.00 0.00 O ATOM 0 H ASP B 44 3.490 -10.156 -9.489 1.00 0.00 H new ATOM 0 HA ASP B 44 4.189 -12.840 -9.950 1.00 0.00 H new ATOM 0 HB2 ASP B 44 3.062 -11.348 -7.544 1.00 0.00 H new ATOM 0 HB3 ASP B 44 3.538 -13.033 -7.465 1.00 0.00 H new ATOM 914 N ARG B 45 0.978 -12.252 -9.454 1.00 0.00 N ATOM 915 CA ARG B 45 -0.350 -12.842 -9.586 1.00 0.00 C ATOM 916 C ARG B 45 -0.622 -13.237 -11.034 1.00 0.00 C ATOM 917 O ARG B 45 -1.485 -14.072 -11.306 1.00 0.00 O ATOM 918 CB ARG B 45 -1.417 -11.844 -9.113 1.00 0.00 C ATOM 919 CG ARG B 45 -2.836 -12.456 -9.262 1.00 0.00 C ATOM 920 CD ARG B 45 -3.539 -11.889 -10.504 1.00 0.00 C ATOM 921 NE ARG B 45 -3.824 -10.468 -10.322 1.00 0.00 N ATOM 922 CZ ARG B 45 -4.916 -10.063 -9.680 1.00 0.00 C ATOM 923 NH1 ARG B 45 -5.765 -10.939 -9.216 1.00 0.00 N ATOM 924 NH2 ARG B 45 -5.143 -8.787 -9.520 1.00 0.00 N ATOM 0 H ARG B 45 0.982 -11.260 -9.216 1.00 0.00 H new ATOM 0 HA ARG B 45 -0.392 -13.737 -8.966 1.00 0.00 H new ATOM 0 HB2 ARG B 45 -1.237 -11.576 -8.072 1.00 0.00 H new ATOM 0 HB3 ARG B 45 -1.348 -10.925 -9.695 1.00 0.00 H new ATOM 0 HG2 ARG B 45 -2.764 -13.541 -9.341 1.00 0.00 H new ATOM 0 HG3 ARG B 45 -3.427 -12.240 -8.372 1.00 0.00 H new ATOM 0 HD2 ARG B 45 -2.910 -12.031 -11.383 1.00 0.00 H new ATOM 0 HD3 ARG B 45 -4.466 -12.432 -10.685 1.00 0.00 H new ATOM 0 HE ARG B 45 -3.175 -9.775 -10.694 1.00 0.00 H new ATOM 0 HH11 ARG B 45 -5.591 -11.936 -9.346 1.00 0.00 H new ATOM 0 HH12 ARG B 45 -6.602 -10.627 -8.724 1.00 0.00 H new ATOM 0 HH21 ARG B 45 -4.483 -8.102 -9.887 1.00 0.00 H new ATOM 0 HH22 ARG B 45 -5.980 -8.476 -9.028 1.00 0.00 H new ATOM 938 N LEU B 46 0.110 -12.631 -11.963 1.00 0.00 N ATOM 939 CA LEU B 46 -0.078 -12.930 -13.380 1.00 0.00 C ATOM 940 C LEU B 46 0.243 -14.401 -13.660 1.00 0.00 C ATOM 941 O LEU B 46 -0.525 -15.102 -14.318 1.00 0.00 O ATOM 942 CB LEU B 46 0.839 -12.021 -14.218 1.00 0.00 C ATOM 943 CG LEU B 46 0.282 -11.843 -15.640 1.00 0.00 C ATOM 944 CD1 LEU B 46 1.189 -10.883 -16.417 1.00 0.00 C ATOM 945 CD2 LEU B 46 0.217 -13.196 -16.368 1.00 0.00 C ATOM 0 H LEU B 46 0.831 -11.937 -11.765 1.00 0.00 H new ATOM 0 HA LEU B 46 -1.118 -12.746 -13.651 1.00 0.00 H new ATOM 0 HB2 LEU B 46 0.933 -11.048 -13.735 1.00 0.00 H new ATOM 0 HB3 LEU B 46 1.839 -12.451 -14.266 1.00 0.00 H new ATOM 0 HG LEU B 46 -0.727 -11.435 -15.578 1.00 0.00 H new ATOM 0 HD11 LEU B 46 0.800 -10.752 -17.427 1.00 0.00 H new ATOM 0 HD12 LEU B 46 1.216 -9.918 -15.911 1.00 0.00 H new ATOM 0 HD13 LEU B 46 2.197 -11.295 -16.467 1.00 0.00 H new ATOM 0 HD21 LEU B 46 -0.180 -13.050 -17.373 1.00 0.00 H new ATOM 0 HD22 LEU B 46 1.218 -13.623 -16.432 1.00 0.00 H new ATOM 0 HD23 LEU B 46 -0.433 -13.875 -15.816 1.00 0.00 H new ATOM 957 N PHE B 47 1.380 -14.865 -13.146 1.00 0.00 N ATOM 958 CA PHE B 47 1.785 -16.253 -13.349 1.00 0.00 C ATOM 959 C PHE B 47 0.774 -17.207 -12.724 1.00 0.00 C ATOM 960 O PHE B 47 0.357 -18.184 -13.348 1.00 0.00 O ATOM 961 CB PHE B 47 3.164 -16.492 -12.731 1.00 0.00 C ATOM 962 CG PHE B 47 4.218 -15.791 -13.557 1.00 0.00 C ATOM 963 CD1 PHE B 47 4.537 -14.454 -13.293 1.00 0.00 C ATOM 964 CD2 PHE B 47 4.873 -16.478 -14.586 1.00 0.00 C ATOM 965 CE1 PHE B 47 5.514 -13.803 -14.057 1.00 0.00 C ATOM 966 CE2 PHE B 47 5.851 -15.828 -15.349 1.00 0.00 C ATOM 967 CZ PHE B 47 6.170 -14.490 -15.086 1.00 0.00 C ATOM 0 H PHE B 47 2.030 -14.307 -12.592 1.00 0.00 H new ATOM 0 HA PHE B 47 1.829 -16.443 -14.421 1.00 0.00 H new ATOM 0 HB2 PHE B 47 3.184 -16.120 -11.706 1.00 0.00 H new ATOM 0 HB3 PHE B 47 3.374 -17.561 -12.687 1.00 0.00 H new ATOM 0 HD1 PHE B 47 4.030 -13.924 -12.500 1.00 0.00 H new ATOM 0 HD2 PHE B 47 4.624 -17.509 -14.791 1.00 0.00 H new ATOM 0 HE1 PHE B 47 5.761 -12.772 -13.853 1.00 0.00 H new ATOM 0 HE2 PHE B 47 6.359 -16.359 -16.140 1.00 0.00 H new ATOM 0 HZ PHE B 47 6.922 -13.988 -15.677 1.00 0.00 H new ATOM 977 N PHE B 48 0.378 -16.918 -11.485 1.00 0.00 N ATOM 978 CA PHE B 48 -0.590 -17.751 -10.769 1.00 0.00 C ATOM 979 C PHE B 48 -1.891 -16.986 -10.549 1.00 0.00 C ATOM 980 O PHE B 48 -1.903 -15.934 -9.911 1.00 0.00 O ATOM 981 CB PHE B 48 -0.005 -18.166 -9.418 1.00 0.00 C ATOM 982 CG PHE B 48 1.080 -19.194 -9.638 1.00 0.00 C ATOM 983 CD1 PHE B 48 2.377 -18.781 -9.968 1.00 0.00 C ATOM 984 CD2 PHE B 48 0.788 -20.559 -9.520 1.00 0.00 C ATOM 985 CE1 PHE B 48 3.382 -19.732 -10.176 1.00 0.00 C ATOM 986 CE2 PHE B 48 1.794 -21.510 -9.731 1.00 0.00 C ATOM 987 CZ PHE B 48 3.091 -21.097 -10.058 1.00 0.00 C ATOM 0 H PHE B 48 0.712 -16.113 -10.955 1.00 0.00 H new ATOM 0 HA PHE B 48 -0.801 -18.638 -11.366 1.00 0.00 H new ATOM 0 HB2 PHE B 48 0.402 -17.296 -8.902 1.00 0.00 H new ATOM 0 HB3 PHE B 48 -0.788 -18.577 -8.781 1.00 0.00 H new ATOM 0 HD1 PHE B 48 2.601 -17.729 -10.062 1.00 0.00 H new ATOM 0 HD2 PHE B 48 -0.212 -20.878 -9.266 1.00 0.00 H new ATOM 0 HE1 PHE B 48 4.383 -19.413 -10.428 1.00 0.00 H new ATOM 0 HE2 PHE B 48 1.569 -22.563 -9.641 1.00 0.00 H new ATOM 0 HZ PHE B 48 3.867 -21.831 -10.219 1.00 0.00 H new ATOM 997 N LYS B 49 -2.986 -17.521 -11.083 1.00 0.00 N ATOM 998 CA LYS B 49 -4.294 -16.882 -10.941 1.00 0.00 C ATOM 999 C LYS B 49 -5.024 -17.421 -9.714 1.00 0.00 C ATOM 1000 O LYS B 49 -4.361 -17.971 -8.851 1.00 0.00 O ATOM 1001 CB LYS B 49 -5.136 -17.141 -12.192 1.00 0.00 C ATOM 1002 CG LYS B 49 -4.512 -16.417 -13.385 1.00 0.00 C ATOM 1003 CD LYS B 49 -5.338 -16.695 -14.642 1.00 0.00 C ATOM 1004 CE LYS B 49 -4.672 -16.031 -15.850 1.00 0.00 C ATOM 1005 NZ LYS B 49 -4.729 -14.550 -15.697 1.00 0.00 N ATOM 1006 OXT LYS B 49 -6.233 -17.274 -9.657 1.00 0.00 O ATOM 0 H LYS B 49 -2.995 -18.391 -11.616 1.00 0.00 H new ATOM 0 HA LYS B 49 -4.144 -15.810 -10.817 1.00 0.00 H new ATOM 0 HB2 LYS B 49 -5.191 -18.211 -12.391 1.00 0.00 H new ATOM 0 HB3 LYS B 49 -6.157 -16.793 -12.035 1.00 0.00 H new ATOM 0 HG2 LYS B 49 -4.473 -15.345 -13.193 1.00 0.00 H new ATOM 0 HG3 LYS B 49 -3.485 -16.752 -13.531 1.00 0.00 H new ATOM 0 HD2 LYS B 49 -5.421 -17.770 -14.805 1.00 0.00 H new ATOM 0 HD3 LYS B 49 -6.351 -16.312 -14.516 1.00 0.00 H new ATOM 0 HE2 LYS B 49 -3.636 -16.359 -15.933 1.00 0.00 H new ATOM 0 HE3 LYS B 49 -5.177 -16.332 -16.768 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 -4.549 -14.099 -16.617 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 -5.671 -14.272 -15.353 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 -4.007 -14.244 -15.014 1.00 0.00 H new TER 1020 LYS B 49 ATOM 1021 N SER C 19 1.939 18.358 19.188 1.00 0.00 N ATOM 1022 CA SER C 19 3.326 18.627 18.715 1.00 0.00 C ATOM 1023 C SER C 19 3.423 18.313 17.225 1.00 0.00 C ATOM 1024 O SER C 19 2.611 17.561 16.688 1.00 0.00 O ATOM 1025 CB SER C 19 4.307 17.748 19.495 1.00 0.00 C ATOM 1026 OG SER C 19 4.009 16.381 19.249 1.00 0.00 O ATOM 0 HA SER C 19 3.573 19.676 18.878 1.00 0.00 H new ATOM 0 HB2 SER C 19 5.331 17.969 19.193 1.00 0.00 H new ATOM 0 HB3 SER C 19 4.236 17.962 20.562 1.00 0.00 H new ATOM 0 HG SER C 19 3.039 16.267 19.171 1.00 0.00 H new ATOM 1034 N ASN C 20 4.420 18.894 16.565 1.00 0.00 N ATOM 1035 CA ASN C 20 4.613 18.664 15.138 1.00 0.00 C ATOM 1036 C ASN C 20 3.349 19.019 14.362 1.00 0.00 C ATOM 1037 O ASN C 20 2.966 18.316 13.427 1.00 0.00 O ATOM 1038 CB ASN C 20 4.981 17.201 14.886 1.00 0.00 C ATOM 1039 CG ASN C 20 6.319 16.875 15.546 1.00 0.00 C ATOM 1040 OD1 ASN C 20 7.201 17.820 15.721 1.00 0.00 O flip ATOM 1041 ND2 ASN C 20 6.563 15.727 15.915 1.00 0.00 N flip ATOM 0 H ASN C 20 5.101 19.522 16.991 1.00 0.00 H new ATOM 0 HA ASN C 20 5.426 19.303 14.794 1.00 0.00 H new ATOM 0 HB2 ASN C 20 4.203 16.549 15.282 1.00 0.00 H new ATOM 0 HB3 ASN C 20 5.040 17.012 13.814 1.00 0.00 H new ATOM 0 HD21 ASN C 20 5.872 14.989 15.777 1.00 0.00 H new ATOM 0 HD22 ASN C 20 7.456 15.513 16.359 1.00 0.00 H new ATOM 1048 N ASP C 21 2.702 20.108 14.760 1.00 0.00 N ATOM 1049 CA ASP C 21 1.476 20.543 14.100 1.00 0.00 C ATOM 1050 C ASP C 21 1.734 20.846 12.627 1.00 0.00 C ATOM 1051 O ASP C 21 0.915 20.523 11.767 1.00 0.00 O ATOM 1052 CB ASP C 21 0.930 21.795 14.789 1.00 0.00 C ATOM 1053 CG ASP C 21 -0.341 22.267 14.089 1.00 0.00 C ATOM 1054 OD1 ASP C 21 -1.286 21.498 14.039 1.00 0.00 O ATOM 1055 OD2 ASP C 21 -0.347 23.388 13.611 1.00 0.00 O ATOM 0 H ASP C 21 3.003 20.703 15.532 1.00 0.00 H new ATOM 0 HA ASP C 21 0.745 19.738 14.170 1.00 0.00 H new ATOM 0 HB2 ASP C 21 0.719 21.580 15.837 1.00 0.00 H new ATOM 0 HB3 ASP C 21 1.680 22.586 14.770 1.00 0.00 H new ATOM 1060 N SER C 22 2.873 21.467 12.341 1.00 0.00 N ATOM 1061 CA SER C 22 3.223 21.809 10.965 1.00 0.00 C ATOM 1062 C SER C 22 3.333 20.550 10.108 1.00 0.00 C ATOM 1063 O SER C 22 2.837 20.509 8.982 1.00 0.00 O ATOM 1064 CB SER C 22 4.552 22.567 10.941 1.00 0.00 C ATOM 1065 OG SER C 22 4.862 22.927 9.601 1.00 0.00 O ATOM 0 H SER C 22 3.566 21.743 13.037 1.00 0.00 H new ATOM 0 HA SER C 22 2.436 22.442 10.555 1.00 0.00 H new ATOM 0 HB2 SER C 22 4.487 23.459 11.564 1.00 0.00 H new ATOM 0 HB3 SER C 22 5.346 21.946 11.356 1.00 0.00 H new ATOM 0 HG SER C 22 5.712 23.414 9.581 1.00 0.00 H new ATOM 1071 N SER C 23 3.984 19.522 10.652 1.00 0.00 N ATOM 1072 CA SER C 23 4.156 18.250 9.944 1.00 0.00 C ATOM 1073 C SER C 23 3.390 17.149 10.668 1.00 0.00 C ATOM 1074 O SER C 23 3.851 16.627 11.685 1.00 0.00 O ATOM 1075 CB SER C 23 5.641 17.885 9.889 1.00 0.00 C ATOM 1076 OG SER C 23 5.795 16.653 9.194 1.00 0.00 O ATOM 0 H SER C 23 4.402 19.544 11.582 1.00 0.00 H new ATOM 0 HA SER C 23 3.770 18.352 8.930 1.00 0.00 H new ATOM 0 HB2 SER C 23 6.203 18.672 9.386 1.00 0.00 H new ATOM 0 HB3 SER C 23 6.044 17.800 10.898 1.00 0.00 H new ATOM 0 HG SER C 23 6.745 16.416 9.155 1.00 0.00 H new ATOM 1082 N ASP C 24 2.215 16.810 10.149 1.00 0.00 N ATOM 1083 CA ASP C 24 1.391 15.778 10.768 1.00 0.00 C ATOM 1084 C ASP C 24 2.136 14.434 10.790 1.00 0.00 C ATOM 1085 O ASP C 24 2.706 14.031 9.777 1.00 0.00 O ATOM 1086 CB ASP C 24 0.085 15.619 9.987 1.00 0.00 C ATOM 1087 CG ASP C 24 -0.922 14.822 10.810 1.00 0.00 C ATOM 1088 OD1 ASP C 24 -0.724 13.627 10.959 1.00 0.00 O ATOM 1089 OD2 ASP C 24 -1.880 15.417 11.280 1.00 0.00 O ATOM 0 H ASP C 24 1.815 17.230 9.310 1.00 0.00 H new ATOM 0 HA ASP C 24 1.173 16.079 11.792 1.00 0.00 H new ATOM 0 HB2 ASP C 24 -0.325 16.599 9.745 1.00 0.00 H new ATOM 0 HB3 ASP C 24 0.277 15.112 9.041 1.00 0.00 H new ATOM 1094 N PRO C 25 2.152 13.727 11.905 1.00 0.00 N ATOM 1095 CA PRO C 25 2.861 12.415 11.994 1.00 0.00 C ATOM 1096 C PRO C 25 2.146 11.314 11.208 1.00 0.00 C ATOM 1097 O PRO C 25 2.742 10.285 10.886 1.00 0.00 O ATOM 1098 CB PRO C 25 2.877 12.112 13.502 1.00 0.00 C ATOM 1099 CG PRO C 25 1.690 12.833 14.054 1.00 0.00 C ATOM 1100 CD PRO C 25 1.508 14.083 13.188 1.00 0.00 C ATOM 0 HA PRO C 25 3.859 12.456 11.558 1.00 0.00 H new ATOM 0 HB2 PRO C 25 2.810 11.040 13.690 1.00 0.00 H new ATOM 0 HB3 PRO C 25 3.801 12.460 13.965 1.00 0.00 H new ATOM 0 HG2 PRO C 25 0.801 12.203 14.020 1.00 0.00 H new ATOM 0 HG3 PRO C 25 1.849 13.103 15.098 1.00 0.00 H new ATOM 0 HD2 PRO C 25 0.454 14.324 13.052 1.00 0.00 H new ATOM 0 HD3 PRO C 25 1.978 14.955 13.642 1.00 0.00 H new ATOM 1108 N LEU C 26 0.869 11.531 10.910 1.00 0.00 N ATOM 1109 CA LEU C 26 0.095 10.539 10.172 1.00 0.00 C ATOM 1110 C LEU C 26 0.685 10.318 8.782 1.00 0.00 C ATOM 1111 O LEU C 26 0.836 9.181 8.336 1.00 0.00 O ATOM 1112 CB LEU C 26 -1.362 11.008 10.048 1.00 0.00 C ATOM 1113 CG LEU C 26 -2.215 9.942 9.341 1.00 0.00 C ATOM 1114 CD1 LEU C 26 -2.249 8.644 10.168 1.00 0.00 C ATOM 1115 CD2 LEU C 26 -3.638 10.481 9.165 1.00 0.00 C ATOM 0 H LEU C 26 0.353 12.374 11.164 1.00 0.00 H new ATOM 0 HA LEU C 26 0.130 9.596 10.717 1.00 0.00 H new ATOM 0 HB2 LEU C 26 -1.770 11.210 11.038 1.00 0.00 H new ATOM 0 HB3 LEU C 26 -1.402 11.943 9.489 1.00 0.00 H new ATOM 0 HG LEU C 26 -1.778 9.719 8.368 1.00 0.00 H new ATOM 0 HD11 LEU C 26 -2.857 7.900 9.653 1.00 0.00 H new ATOM 0 HD12 LEU C 26 -1.235 8.263 10.289 1.00 0.00 H new ATOM 0 HD13 LEU C 26 -2.679 8.848 11.148 1.00 0.00 H new ATOM 0 HD21 LEU C 26 -4.251 9.732 8.664 1.00 0.00 H new ATOM 0 HD22 LEU C 26 -4.065 10.706 10.142 1.00 0.00 H new ATOM 0 HD23 LEU C 26 -3.611 11.389 8.563 1.00 0.00 H new ATOM 1127 N VAL C 27 1.022 11.410 8.101 1.00 0.00 N ATOM 1128 CA VAL C 27 1.597 11.313 6.765 1.00 0.00 C ATOM 1129 C VAL C 27 2.958 10.625 6.816 1.00 0.00 C ATOM 1130 O VAL C 27 3.250 9.746 6.006 1.00 0.00 O ATOM 1131 CB VAL C 27 1.743 12.712 6.153 1.00 0.00 C ATOM 1132 CG1 VAL C 27 2.498 12.620 4.824 1.00 0.00 C ATOM 1133 CG2 VAL C 27 0.355 13.305 5.905 1.00 0.00 C ATOM 0 H VAL C 27 0.908 12.362 8.449 1.00 0.00 H new ATOM 0 HA VAL C 27 0.928 10.718 6.143 1.00 0.00 H new ATOM 0 HB VAL C 27 2.299 13.349 6.841 1.00 0.00 H new ATOM 0 HG11 VAL C 27 2.599 13.616 4.393 1.00 0.00 H new ATOM 0 HG12 VAL C 27 3.488 12.197 4.996 1.00 0.00 H new ATOM 0 HG13 VAL C 27 1.945 11.981 4.135 1.00 0.00 H new ATOM 0 HG21 VAL C 27 0.457 14.299 5.470 1.00 0.00 H new ATOM 0 HG22 VAL C 27 -0.197 12.663 5.219 1.00 0.00 H new ATOM 0 HG23 VAL C 27 -0.185 13.376 6.849 1.00 0.00 H new ATOM 1143 N VAL C 28 3.786 11.032 7.774 1.00 0.00 N ATOM 1144 CA VAL C 28 5.115 10.448 7.918 1.00 0.00 C ATOM 1145 C VAL C 28 5.013 8.966 8.271 1.00 0.00 C ATOM 1146 O VAL C 28 5.718 8.134 7.699 1.00 0.00 O ATOM 1147 CB VAL C 28 5.892 11.186 9.010 1.00 0.00 C ATOM 1148 CG1 VAL C 28 7.237 10.492 9.248 1.00 0.00 C ATOM 1149 CG2 VAL C 28 6.136 12.631 8.569 1.00 0.00 C ATOM 0 H VAL C 28 3.563 11.757 8.456 1.00 0.00 H new ATOM 0 HA VAL C 28 5.642 10.547 6.969 1.00 0.00 H new ATOM 0 HB VAL C 28 5.314 11.176 9.934 1.00 0.00 H new ATOM 0 HG11 VAL C 28 7.787 11.021 10.026 1.00 0.00 H new ATOM 0 HG12 VAL C 28 7.065 9.462 9.561 1.00 0.00 H new ATOM 0 HG13 VAL C 28 7.818 10.498 8.326 1.00 0.00 H new ATOM 0 HG21 VAL C 28 6.689 13.160 9.345 1.00 0.00 H new ATOM 0 HG22 VAL C 28 6.713 12.637 7.644 1.00 0.00 H new ATOM 0 HG23 VAL C 28 5.180 13.127 8.403 1.00 0.00 H new ATOM 1159 N ALA C 29 4.134 8.647 9.215 1.00 0.00 N ATOM 1160 CA ALA C 29 3.950 7.263 9.635 1.00 0.00 C ATOM 1161 C ALA C 29 3.413 6.419 8.484 1.00 0.00 C ATOM 1162 O ALA C 29 3.812 5.270 8.308 1.00 0.00 O ATOM 1163 CB ALA C 29 2.976 7.195 10.812 1.00 0.00 C ATOM 0 H ALA C 29 3.542 9.322 9.700 1.00 0.00 H new ATOM 0 HA ALA C 29 4.919 6.869 9.942 1.00 0.00 H new ATOM 0 HB1 ALA C 29 2.846 6.157 11.117 1.00 0.00 H new ATOM 0 HB2 ALA C 29 3.374 7.772 11.647 1.00 0.00 H new ATOM 0 HB3 ALA C 29 2.013 7.608 10.512 1.00 0.00 H new ATOM 1169 N ALA C 30 2.504 6.994 7.706 1.00 0.00 N ATOM 1170 CA ALA C 30 1.919 6.274 6.581 1.00 0.00 C ATOM 1171 C ALA C 30 3.006 5.791 5.628 1.00 0.00 C ATOM 1172 O ALA C 30 3.014 4.629 5.220 1.00 0.00 O ATOM 1173 CB ALA C 30 0.946 7.185 5.829 1.00 0.00 C ATOM 0 H ALA C 30 2.159 7.946 7.831 1.00 0.00 H new ATOM 0 HA ALA C 30 1.382 5.408 6.968 1.00 0.00 H new ATOM 0 HB1 ALA C 30 0.513 6.641 4.990 1.00 0.00 H new ATOM 0 HB2 ALA C 30 0.152 7.504 6.503 1.00 0.00 H new ATOM 0 HB3 ALA C 30 1.480 8.060 5.457 1.00 0.00 H new ATOM 1179 N ASN C 31 3.922 6.686 5.276 1.00 0.00 N ATOM 1180 CA ASN C 31 5.007 6.335 4.368 1.00 0.00 C ATOM 1181 C ASN C 31 5.913 5.276 4.995 1.00 0.00 C ATOM 1182 O ASN C 31 6.342 4.338 4.324 1.00 0.00 O ATOM 1183 CB ASN C 31 5.826 7.581 4.035 1.00 0.00 C ATOM 1184 CG ASN C 31 5.014 8.515 3.144 1.00 0.00 C ATOM 1185 OD1 ASN C 31 4.064 8.082 2.492 1.00 0.00 O ATOM 1186 ND2 ASN C 31 5.326 9.781 3.085 1.00 0.00 N ATOM 0 H ASN C 31 3.936 7.652 5.602 1.00 0.00 H new ATOM 0 HA ASN C 31 4.576 5.927 3.454 1.00 0.00 H new ATOM 0 HB2 ASN C 31 6.110 8.096 4.953 1.00 0.00 H new ATOM 0 HB3 ASN C 31 6.749 7.296 3.531 1.00 0.00 H new ATOM 0 HD21 ASN C 31 4.782 10.413 2.498 1.00 0.00 H new ATOM 0 HD22 ASN C 31 6.114 10.138 3.626 1.00 0.00 H new ATOM 1193 N ILE C 32 6.202 5.436 6.284 1.00 0.00 N ATOM 1194 CA ILE C 32 7.060 4.489 6.988 1.00 0.00 C ATOM 1195 C ILE C 32 6.402 3.111 7.049 1.00 0.00 C ATOM 1196 O ILE C 32 7.051 2.090 6.822 1.00 0.00 O ATOM 1197 CB ILE C 32 7.342 4.995 8.405 1.00 0.00 C ATOM 1198 CG1 ILE C 32 8.200 6.261 8.329 1.00 0.00 C ATOM 1199 CG2 ILE C 32 8.096 3.922 9.200 1.00 0.00 C ATOM 1200 CD1 ILE C 32 8.255 6.928 9.705 1.00 0.00 C ATOM 0 H ILE C 32 5.858 6.206 6.858 1.00 0.00 H new ATOM 0 HA ILE C 32 8.000 4.401 6.444 1.00 0.00 H new ATOM 0 HB ILE C 32 6.398 5.216 8.902 1.00 0.00 H new ATOM 0 HG12 ILE C 32 9.207 6.010 7.995 1.00 0.00 H new ATOM 0 HG13 ILE C 32 7.783 6.951 7.596 1.00 0.00 H new ATOM 0 HG21 ILE C 32 8.294 4.288 10.208 1.00 0.00 H new ATOM 0 HG22 ILE C 32 7.491 3.017 9.255 1.00 0.00 H new ATOM 0 HG23 ILE C 32 9.040 3.697 8.704 1.00 0.00 H new ATOM 0 HD11 ILE C 32 8.866 7.829 9.649 1.00 0.00 H new ATOM 0 HD12 ILE C 32 7.246 7.193 10.021 1.00 0.00 H new ATOM 0 HD13 ILE C 32 8.692 6.238 10.427 1.00 0.00 H new ATOM 1212 N ILE C 33 5.110 3.092 7.357 1.00 0.00 N ATOM 1213 CA ILE C 33 4.371 1.838 7.447 1.00 0.00 C ATOM 1214 C ILE C 33 4.328 1.135 6.090 1.00 0.00 C ATOM 1215 O ILE C 33 4.517 -0.079 6.007 1.00 0.00 O ATOM 1216 CB ILE C 33 2.947 2.109 7.950 1.00 0.00 C ATOM 1217 CG1 ILE C 33 2.997 2.542 9.421 1.00 0.00 C ATOM 1218 CG2 ILE C 33 2.094 0.844 7.820 1.00 0.00 C ATOM 1219 CD1 ILE C 33 1.633 3.096 9.839 1.00 0.00 C ATOM 0 H ILE C 33 4.555 3.926 7.548 1.00 0.00 H new ATOM 0 HA ILE C 33 4.882 1.183 8.153 1.00 0.00 H new ATOM 0 HB ILE C 33 2.503 2.902 7.349 1.00 0.00 H new ATOM 0 HG12 ILE C 33 3.265 1.694 10.051 1.00 0.00 H new ATOM 0 HG13 ILE C 33 3.767 3.300 9.562 1.00 0.00 H new ATOM 0 HG21 ILE C 33 1.085 1.047 8.180 1.00 0.00 H new ATOM 0 HG22 ILE C 33 2.052 0.539 6.774 1.00 0.00 H new ATOM 0 HG23 ILE C 33 2.537 0.044 8.413 1.00 0.00 H new ATOM 0 HD11 ILE C 33 1.670 3.403 10.884 1.00 0.00 H new ATOM 0 HD12 ILE C 33 1.383 3.955 9.217 1.00 0.00 H new ATOM 0 HD13 ILE C 33 0.873 2.325 9.714 1.00 0.00 H new ATOM 1231 N GLY C 34 4.074 1.897 5.032 1.00 0.00 N ATOM 1232 CA GLY C 34 4.007 1.318 3.692 1.00 0.00 C ATOM 1233 C GLY C 34 5.340 0.685 3.304 1.00 0.00 C ATOM 1234 O GLY C 34 5.382 -0.425 2.768 1.00 0.00 O ATOM 0 H GLY C 34 3.913 2.903 5.072 1.00 0.00 H new ATOM 0 HA2 GLY C 34 3.219 0.566 3.656 1.00 0.00 H new ATOM 0 HA3 GLY C 34 3.743 2.091 2.970 1.00 0.00 H new ATOM 1238 N ILE C 35 6.427 1.394 3.582 1.00 0.00 N ATOM 1239 CA ILE C 35 7.760 0.895 3.266 1.00 0.00 C ATOM 1240 C ILE C 35 8.053 -0.368 4.073 1.00 0.00 C ATOM 1241 O ILE C 35 8.593 -1.347 3.549 1.00 0.00 O ATOM 1242 CB ILE C 35 8.801 1.973 3.572 1.00 0.00 C ATOM 1243 CG1 ILE C 35 8.611 3.141 2.601 1.00 0.00 C ATOM 1244 CG2 ILE C 35 10.209 1.395 3.398 1.00 0.00 C ATOM 1245 CD1 ILE C 35 9.400 4.357 3.092 1.00 0.00 C ATOM 0 H ILE C 35 6.412 2.313 4.024 1.00 0.00 H new ATOM 0 HA ILE C 35 7.807 0.648 2.205 1.00 0.00 H new ATOM 0 HB ILE C 35 8.677 2.318 4.598 1.00 0.00 H new ATOM 0 HG12 ILE C 35 8.948 2.856 1.604 1.00 0.00 H new ATOM 0 HG13 ILE C 35 7.553 3.391 2.521 1.00 0.00 H new ATOM 0 HG21 ILE C 35 10.948 2.166 3.617 1.00 0.00 H new ATOM 0 HG22 ILE C 35 10.345 0.557 4.081 1.00 0.00 H new ATOM 0 HG23 ILE C 35 10.337 1.051 2.372 1.00 0.00 H new ATOM 0 HD11 ILE C 35 9.261 5.185 2.397 1.00 0.00 H new ATOM 0 HD12 ILE C 35 9.043 4.648 4.080 1.00 0.00 H new ATOM 0 HD13 ILE C 35 10.459 4.105 3.149 1.00 0.00 H new ATOM 1257 N LEU C 36 7.688 -0.340 5.350 1.00 0.00 N ATOM 1258 CA LEU C 36 7.911 -1.485 6.221 1.00 0.00 C ATOM 1259 C LEU C 36 7.158 -2.696 5.687 1.00 0.00 C ATOM 1260 O LEU C 36 7.654 -3.821 5.741 1.00 0.00 O ATOM 1261 CB LEU C 36 7.441 -1.165 7.646 1.00 0.00 C ATOM 1262 CG LEU C 36 7.708 -2.357 8.582 1.00 0.00 C ATOM 1263 CD1 LEU C 36 9.215 -2.668 8.636 1.00 0.00 C ATOM 1264 CD2 LEU C 36 7.203 -2.009 9.987 1.00 0.00 C ATOM 0 H LEU C 36 7.240 0.457 5.801 1.00 0.00 H new ATOM 0 HA LEU C 36 8.978 -1.708 6.244 1.00 0.00 H new ATOM 0 HB2 LEU C 36 7.960 -0.281 8.016 1.00 0.00 H new ATOM 0 HB3 LEU C 36 6.376 -0.931 7.640 1.00 0.00 H new ATOM 0 HG LEU C 36 7.185 -3.236 8.205 1.00 0.00 H new ATOM 0 HD11 LEU C 36 9.388 -3.513 9.302 1.00 0.00 H new ATOM 0 HD12 LEU C 36 9.572 -2.915 7.636 1.00 0.00 H new ATOM 0 HD13 LEU C 36 9.753 -1.796 9.008 1.00 0.00 H new ATOM 0 HD21 LEU C 36 7.388 -2.848 10.658 1.00 0.00 H new ATOM 0 HD22 LEU C 36 7.729 -1.128 10.355 1.00 0.00 H new ATOM 0 HD23 LEU C 36 6.133 -1.804 9.949 1.00 0.00 H new ATOM 1276 N HIS C 37 5.958 -2.457 5.167 1.00 0.00 N ATOM 1277 CA HIS C 37 5.151 -3.540 4.623 1.00 0.00 C ATOM 1278 C HIS C 37 5.913 -4.249 3.511 1.00 0.00 C ATOM 1279 O HIS C 37 5.891 -5.476 3.419 1.00 0.00 O ATOM 1280 CB HIS C 37 3.840 -2.991 4.060 1.00 0.00 C ATOM 1281 CG HIS C 37 3.009 -4.141 3.555 1.00 0.00 C ATOM 1282 ND1 HIS C 37 1.778 -4.463 4.097 1.00 0.00 N ATOM 1283 CD2 HIS C 37 3.234 -5.065 2.566 1.00 0.00 C ATOM 1284 CE1 HIS C 37 1.316 -5.541 3.438 1.00 0.00 C ATOM 1285 NE2 HIS C 37 2.165 -5.948 2.494 1.00 0.00 N ATOM 0 H HIS C 37 5.528 -1.534 5.112 1.00 0.00 H new ATOM 0 HA HIS C 37 4.933 -4.245 5.425 1.00 0.00 H new ATOM 0 HB2 HIS C 37 3.298 -2.444 4.831 1.00 0.00 H new ATOM 0 HB3 HIS C 37 4.041 -2.288 3.252 1.00 0.00 H new ATOM 0 HD2 HIS C 37 4.112 -5.100 1.937 1.00 0.00 H new ATOM 0 HE1 HIS C 37 0.371 -6.019 3.648 1.00 0.00 H new ATOM 0 HE2 HIS C 37 2.053 -6.737 1.857 1.00 0.00 H new ATOM 1293 N LEU C 38 6.583 -3.472 2.669 1.00 0.00 N ATOM 1294 CA LEU C 38 7.342 -4.048 1.564 1.00 0.00 C ATOM 1295 C LEU C 38 8.434 -4.978 2.075 1.00 0.00 C ATOM 1296 O LEU C 38 8.674 -6.027 1.487 1.00 0.00 O ATOM 1297 CB LEU C 38 7.964 -2.926 0.703 1.00 0.00 C ATOM 1298 CG LEU C 38 7.001 -2.529 -0.435 1.00 0.00 C ATOM 1299 CD1 LEU C 38 7.309 -1.108 -0.903 1.00 0.00 C ATOM 1300 CD2 LEU C 38 7.159 -3.498 -1.619 1.00 0.00 C ATOM 0 H LEU C 38 6.617 -2.454 2.727 1.00 0.00 H new ATOM 0 HA LEU C 38 6.656 -4.632 0.951 1.00 0.00 H new ATOM 0 HB2 LEU C 38 8.180 -2.058 1.326 1.00 0.00 H new ATOM 0 HB3 LEU C 38 8.913 -3.262 0.285 1.00 0.00 H new ATOM 0 HG LEU C 38 5.978 -2.576 -0.062 1.00 0.00 H new ATOM 0 HD11 LEU C 38 6.626 -0.833 -1.707 1.00 0.00 H new ATOM 0 HD12 LEU C 38 7.186 -0.416 -0.070 1.00 0.00 H new ATOM 0 HD13 LEU C 38 8.335 -1.059 -1.267 1.00 0.00 H new ATOM 0 HD21 LEU C 38 6.476 -3.211 -2.418 1.00 0.00 H new ATOM 0 HD22 LEU C 38 8.184 -3.459 -1.987 1.00 0.00 H new ATOM 0 HD23 LEU C 38 6.929 -4.512 -1.292 1.00 0.00 H new ATOM 1312 N ILE C 39 9.100 -4.594 3.152 1.00 0.00 N ATOM 1313 CA ILE C 39 10.167 -5.429 3.688 1.00 0.00 C ATOM 1314 C ILE C 39 9.616 -6.783 4.132 1.00 0.00 C ATOM 1315 O ILE C 39 10.212 -7.825 3.857 1.00 0.00 O ATOM 1316 CB ILE C 39 10.833 -4.721 4.875 1.00 0.00 C ATOM 1317 CG1 ILE C 39 11.575 -3.485 4.367 1.00 0.00 C ATOM 1318 CG2 ILE C 39 11.827 -5.670 5.551 1.00 0.00 C ATOM 1319 CD1 ILE C 39 12.020 -2.626 5.553 1.00 0.00 C ATOM 0 H ILE C 39 8.928 -3.729 3.664 1.00 0.00 H new ATOM 0 HA ILE C 39 10.907 -5.596 2.905 1.00 0.00 H new ATOM 0 HB ILE C 39 10.072 -4.425 5.597 1.00 0.00 H new ATOM 0 HG12 ILE C 39 12.442 -3.786 3.778 1.00 0.00 H new ATOM 0 HG13 ILE C 39 10.928 -2.906 3.709 1.00 0.00 H new ATOM 0 HG21 ILE C 39 12.298 -5.164 6.394 1.00 0.00 H new ATOM 0 HG22 ILE C 39 11.300 -6.555 5.908 1.00 0.00 H new ATOM 0 HG23 ILE C 39 12.591 -5.968 4.833 1.00 0.00 H new ATOM 0 HD11 ILE C 39 12.549 -1.746 5.187 1.00 0.00 H new ATOM 0 HD12 ILE C 39 11.146 -2.313 6.124 1.00 0.00 H new ATOM 0 HD13 ILE C 39 12.683 -3.207 6.194 1.00 0.00 H new ATOM 1331 N LEU C 40 8.486 -6.766 4.824 1.00 0.00 N ATOM 1332 CA LEU C 40 7.876 -8.006 5.292 1.00 0.00 C ATOM 1333 C LEU C 40 7.257 -8.795 4.135 1.00 0.00 C ATOM 1334 O LEU C 40 7.405 -10.014 4.056 1.00 0.00 O ATOM 1335 CB LEU C 40 6.807 -7.685 6.338 1.00 0.00 C ATOM 1336 CG LEU C 40 7.408 -6.776 7.418 1.00 0.00 C ATOM 1337 CD1 LEU C 40 6.328 -6.419 8.442 1.00 0.00 C ATOM 1338 CD2 LEU C 40 8.573 -7.492 8.123 1.00 0.00 C ATOM 0 H LEU C 40 7.976 -5.918 5.073 1.00 0.00 H new ATOM 0 HA LEU C 40 8.655 -8.625 5.738 1.00 0.00 H new ATOM 0 HB2 LEU C 40 5.956 -7.194 5.866 1.00 0.00 H new ATOM 0 HB3 LEU C 40 6.434 -8.605 6.788 1.00 0.00 H new ATOM 0 HG LEU C 40 7.783 -5.866 6.951 1.00 0.00 H new ATOM 0 HD11 LEU C 40 6.754 -5.773 9.210 1.00 0.00 H new ATOM 0 HD12 LEU C 40 5.511 -5.899 7.943 1.00 0.00 H new ATOM 0 HD13 LEU C 40 5.949 -7.331 8.904 1.00 0.00 H new ATOM 0 HD21 LEU C 40 8.993 -6.838 8.888 1.00 0.00 H new ATOM 0 HD22 LEU C 40 8.209 -8.408 8.589 1.00 0.00 H new ATOM 0 HD23 LEU C 40 9.344 -7.738 7.393 1.00 0.00 H new ATOM 1350 N TRP C 41 6.551 -8.093 3.248 1.00 0.00 N ATOM 1351 CA TRP C 41 5.902 -8.740 2.109 1.00 0.00 C ATOM 1352 C TRP C 41 6.924 -9.284 1.112 1.00 0.00 C ATOM 1353 O TRP C 41 6.806 -10.418 0.652 1.00 0.00 O ATOM 1354 CB TRP C 41 4.962 -7.744 1.416 1.00 0.00 C ATOM 1355 CG TRP C 41 4.455 -8.310 0.124 1.00 0.00 C ATOM 1356 CD1 TRP C 41 3.388 -9.133 -0.009 1.00 0.00 C ATOM 1357 CD2 TRP C 41 4.955 -8.075 -1.222 1.00 0.00 C ATOM 1358 NE1 TRP C 41 3.224 -9.438 -1.348 1.00 0.00 N ATOM 1359 CE2 TRP C 41 4.160 -8.803 -2.134 1.00 0.00 C ATOM 1360 CE3 TRP C 41 6.017 -7.306 -1.732 1.00 0.00 C ATOM 1361 CZ2 TRP C 41 4.410 -8.769 -3.503 1.00 0.00 C ATOM 1362 CZ3 TRP C 41 6.263 -7.268 -3.113 1.00 0.00 C ATOM 1363 CH2 TRP C 41 5.462 -7.998 -3.993 1.00 0.00 C ATOM 0 H TRP C 41 6.415 -7.083 3.296 1.00 0.00 H new ATOM 0 HA TRP C 41 5.326 -9.586 2.483 1.00 0.00 H new ATOM 0 HB2 TRP C 41 4.123 -7.511 2.071 1.00 0.00 H new ATOM 0 HB3 TRP C 41 5.489 -6.809 1.228 1.00 0.00 H new ATOM 0 HD1 TRP C 41 2.767 -9.492 0.798 1.00 0.00 H new ATOM 0 HE1 TRP C 41 2.499 -10.057 -1.709 1.00 0.00 H new ATOM 0 HE3 TRP C 41 6.645 -6.743 -1.058 1.00 0.00 H new ATOM 0 HZ2 TRP C 41 3.792 -9.337 -4.182 1.00 0.00 H new ATOM 0 HZ3 TRP C 41 7.077 -6.671 -3.497 1.00 0.00 H new ATOM 0 HH2 TRP C 41 5.658 -7.965 -5.055 1.00 0.00 H new ATOM 1374 N ILE C 42 7.917 -8.470 0.770 1.00 0.00 N ATOM 1375 CA ILE C 42 8.932 -8.896 -0.186 1.00 0.00 C ATOM 1376 C ILE C 42 9.736 -10.061 0.386 1.00 0.00 C ATOM 1377 O ILE C 42 10.093 -10.995 -0.330 1.00 0.00 O ATOM 1378 CB ILE C 42 9.865 -7.721 -0.529 1.00 0.00 C ATOM 1379 CG1 ILE C 42 10.648 -8.039 -1.809 1.00 0.00 C ATOM 1380 CG2 ILE C 42 10.855 -7.469 0.618 1.00 0.00 C ATOM 1381 CD1 ILE C 42 11.441 -6.804 -2.239 1.00 0.00 C ATOM 0 H ILE C 42 8.040 -7.525 1.134 1.00 0.00 H new ATOM 0 HA ILE C 42 8.438 -9.227 -1.100 1.00 0.00 H new ATOM 0 HB ILE C 42 9.258 -6.828 -0.679 1.00 0.00 H new ATOM 0 HG12 ILE C 42 11.324 -8.877 -1.637 1.00 0.00 H new ATOM 0 HG13 ILE C 42 9.963 -8.340 -2.602 1.00 0.00 H new ATOM 0 HG21 ILE C 42 11.507 -6.635 0.359 1.00 0.00 H new ATOM 0 HG22 ILE C 42 10.304 -7.230 1.528 1.00 0.00 H new ATOM 0 HG23 ILE C 42 11.457 -8.363 0.782 1.00 0.00 H new ATOM 0 HD11 ILE C 42 11.998 -7.028 -3.149 1.00 0.00 H new ATOM 0 HD12 ILE C 42 10.755 -5.979 -2.428 1.00 0.00 H new ATOM 0 HD13 ILE C 42 12.136 -6.524 -1.447 1.00 0.00 H new ATOM 1393 N LEU C 43 10.015 -9.994 1.684 1.00 0.00 N ATOM 1394 CA LEU C 43 10.778 -11.043 2.350 1.00 0.00 C ATOM 1395 C LEU C 43 10.041 -12.374 2.273 1.00 0.00 C ATOM 1396 O LEU C 43 10.648 -13.417 2.033 1.00 0.00 O ATOM 1397 CB LEU C 43 11.014 -10.665 3.820 1.00 0.00 C ATOM 1398 CG LEU C 43 11.757 -11.792 4.556 1.00 0.00 C ATOM 1399 CD1 LEU C 43 13.077 -12.119 3.839 1.00 0.00 C ATOM 1400 CD2 LEU C 43 12.052 -11.340 5.990 1.00 0.00 C ATOM 0 H LEU C 43 9.726 -9.228 2.293 1.00 0.00 H new ATOM 0 HA LEU C 43 11.738 -11.146 1.844 1.00 0.00 H new ATOM 0 HB2 LEU C 43 11.593 -9.743 3.876 1.00 0.00 H new ATOM 0 HB3 LEU C 43 10.059 -10.471 4.309 1.00 0.00 H new ATOM 0 HG LEU C 43 11.134 -12.686 4.566 1.00 0.00 H new ATOM 0 HD11 LEU C 43 13.592 -12.919 4.372 1.00 0.00 H new ATOM 0 HD12 LEU C 43 12.867 -12.439 2.818 1.00 0.00 H new ATOM 0 HD13 LEU C 43 13.709 -11.231 3.818 1.00 0.00 H new ATOM 0 HD21 LEU C 43 12.579 -12.133 6.520 1.00 0.00 H new ATOM 0 HD22 LEU C 43 12.672 -10.444 5.969 1.00 0.00 H new ATOM 0 HD23 LEU C 43 11.115 -11.121 6.503 1.00 0.00 H new ATOM 1412 N ASP C 44 8.730 -12.335 2.485 1.00 0.00 N ATOM 1413 CA ASP C 44 7.927 -13.551 2.444 1.00 0.00 C ATOM 1414 C ASP C 44 8.017 -14.197 1.065 1.00 0.00 C ATOM 1415 O ASP C 44 8.153 -15.414 0.947 1.00 0.00 O ATOM 1416 CB ASP C 44 6.465 -13.225 2.758 1.00 0.00 C ATOM 1417 CG ASP C 44 6.310 -12.886 4.236 1.00 0.00 C ATOM 1418 OD1 ASP C 44 7.220 -13.184 4.993 1.00 0.00 O ATOM 1419 OD2 ASP C 44 5.282 -12.334 4.591 1.00 0.00 O ATOM 0 H ASP C 44 8.205 -11.484 2.685 1.00 0.00 H new ATOM 0 HA ASP C 44 8.312 -14.246 3.191 1.00 0.00 H new ATOM 0 HB2 ASP C 44 6.132 -12.386 2.147 1.00 0.00 H new ATOM 0 HB3 ASP C 44 5.832 -14.075 2.503 1.00 0.00 H new ATOM 1424 N ARG C 45 7.945 -13.373 0.026 1.00 0.00 N ATOM 1425 CA ARG C 45 8.024 -13.878 -1.338 1.00 0.00 C ATOM 1426 C ARG C 45 9.415 -14.434 -1.630 1.00 0.00 C ATOM 1427 O ARG C 45 9.591 -15.232 -2.551 1.00 0.00 O ATOM 1428 CB ARG C 45 7.699 -12.753 -2.335 1.00 0.00 C ATOM 1429 CG ARG C 45 7.792 -13.275 -3.794 1.00 0.00 C ATOM 1430 CD ARG C 45 9.109 -12.823 -4.444 1.00 0.00 C ATOM 1431 NE ARG C 45 9.113 -11.374 -4.625 1.00 0.00 N ATOM 1432 CZ ARG C 45 8.545 -10.812 -5.689 1.00 0.00 C ATOM 1433 NH1 ARG C 45 7.988 -11.557 -6.602 1.00 0.00 N ATOM 1434 NH2 ARG C 45 8.553 -9.513 -5.822 1.00 0.00 N ATOM 0 H ARG C 45 7.833 -12.362 0.101 1.00 0.00 H new ATOM 0 HA ARG C 45 7.296 -14.682 -1.447 1.00 0.00 H new ATOM 0 HB2 ARG C 45 6.697 -12.368 -2.144 1.00 0.00 H new ATOM 0 HB3 ARG C 45 8.392 -11.923 -2.195 1.00 0.00 H new ATOM 0 HG2 ARG C 45 7.730 -14.363 -3.802 1.00 0.00 H new ATOM 0 HG3 ARG C 45 6.947 -12.904 -4.374 1.00 0.00 H new ATOM 0 HD2 ARG C 45 9.952 -13.121 -3.820 1.00 0.00 H new ATOM 0 HD3 ARG C 45 9.236 -13.317 -5.407 1.00 0.00 H new ATOM 0 HE ARG C 45 9.559 -10.783 -3.924 1.00 0.00 H new ATOM 0 HH11 ARG C 45 7.987 -12.572 -6.501 1.00 0.00 H new ATOM 0 HH12 ARG C 45 7.553 -11.125 -7.417 1.00 0.00 H new ATOM 0 HH21 ARG C 45 8.994 -8.930 -5.111 1.00 0.00 H new ATOM 0 HH22 ARG C 45 8.118 -9.081 -6.637 1.00 0.00 H new ATOM 1448 N LEU C 46 10.402 -14.007 -0.848 1.00 0.00 N ATOM 1449 CA LEU C 46 11.772 -14.469 -1.048 1.00 0.00 C ATOM 1450 C LEU C 46 11.856 -15.984 -0.832 1.00 0.00 C ATOM 1451 O LEU C 46 12.432 -16.706 -1.646 1.00 0.00 O ATOM 1452 CB LEU C 46 12.702 -13.744 -0.059 1.00 0.00 C ATOM 1453 CG LEU C 46 14.144 -13.711 -0.593 1.00 0.00 C ATOM 1454 CD1 LEU C 46 15.022 -12.925 0.387 1.00 0.00 C ATOM 1455 CD2 LEU C 46 14.695 -15.138 -0.751 1.00 0.00 C ATOM 0 H LEU C 46 10.282 -13.349 -0.078 1.00 0.00 H new ATOM 0 HA LEU C 46 12.082 -14.246 -2.069 1.00 0.00 H new ATOM 0 HB2 LEU C 46 12.346 -12.727 0.104 1.00 0.00 H new ATOM 0 HB3 LEU C 46 12.678 -14.248 0.907 1.00 0.00 H new ATOM 0 HG LEU C 46 14.151 -13.228 -1.570 1.00 0.00 H new ATOM 0 HD11 LEU C 46 16.046 -12.897 0.016 1.00 0.00 H new ATOM 0 HD12 LEU C 46 14.642 -11.908 0.481 1.00 0.00 H new ATOM 0 HD13 LEU C 46 15.003 -13.411 1.363 1.00 0.00 H new ATOM 0 HD21 LEU C 46 15.716 -15.094 -1.130 1.00 0.00 H new ATOM 0 HD22 LEU C 46 14.688 -15.640 0.217 1.00 0.00 H new ATOM 0 HD23 LEU C 46 14.072 -15.693 -1.452 1.00 0.00 H new ATOM 1467 N PHE C 47 11.267 -16.459 0.263 1.00 0.00 N ATOM 1468 CA PHE C 47 11.285 -17.887 0.567 1.00 0.00 C ATOM 1469 C PHE C 47 10.561 -18.678 -0.517 1.00 0.00 C ATOM 1470 O PHE C 47 11.062 -19.693 -0.998 1.00 0.00 O ATOM 1471 CB PHE C 47 10.619 -18.145 1.921 1.00 0.00 C ATOM 1472 CG PHE C 47 11.511 -17.631 3.028 1.00 0.00 C ATOM 1473 CD1 PHE C 47 11.413 -16.298 3.444 1.00 0.00 C ATOM 1474 CD2 PHE C 47 12.432 -18.489 3.640 1.00 0.00 C ATOM 1475 CE1 PHE C 47 12.238 -15.823 4.472 1.00 0.00 C ATOM 1476 CE2 PHE C 47 13.257 -18.015 4.667 1.00 0.00 C ATOM 1477 CZ PHE C 47 13.160 -16.681 5.083 1.00 0.00 C ATOM 0 H PHE C 47 10.777 -15.883 0.947 1.00 0.00 H new ATOM 0 HA PHE C 47 12.324 -18.214 0.606 1.00 0.00 H new ATOM 0 HB2 PHE C 47 9.649 -17.649 1.961 1.00 0.00 H new ATOM 0 HB3 PHE C 47 10.438 -19.212 2.052 1.00 0.00 H new ATOM 0 HD1 PHE C 47 10.702 -15.636 2.973 1.00 0.00 H new ATOM 0 HD2 PHE C 47 12.506 -19.518 3.320 1.00 0.00 H new ATOM 0 HE1 PHE C 47 12.163 -14.795 4.793 1.00 0.00 H new ATOM 0 HE2 PHE C 47 13.968 -18.678 5.138 1.00 0.00 H new ATOM 0 HZ PHE C 47 13.796 -16.315 5.875 1.00 0.00 H new ATOM 1487 N PHE C 48 9.376 -18.204 -0.898 1.00 0.00 N ATOM 1488 CA PHE C 48 8.575 -18.866 -1.930 1.00 0.00 C ATOM 1489 C PHE C 48 8.475 -17.989 -3.173 1.00 0.00 C ATOM 1490 O PHE C 48 7.976 -16.864 -3.112 1.00 0.00 O ATOM 1491 CB PHE C 48 7.173 -19.148 -1.386 1.00 0.00 C ATOM 1492 CG PHE C 48 7.243 -20.270 -0.377 1.00 0.00 C ATOM 1493 CD1 PHE C 48 7.599 -19.997 0.947 1.00 0.00 C ATOM 1494 CD2 PHE C 48 6.956 -21.582 -0.771 1.00 0.00 C ATOM 1495 CE1 PHE C 48 7.669 -21.036 1.882 1.00 0.00 C ATOM 1496 CE2 PHE C 48 7.026 -22.623 0.165 1.00 0.00 C ATOM 1497 CZ PHE C 48 7.383 -22.350 1.491 1.00 0.00 C ATOM 0 H PHE C 48 8.948 -17.364 -0.508 1.00 0.00 H new ATOM 0 HA PHE C 48 9.059 -19.804 -2.202 1.00 0.00 H new ATOM 0 HB2 PHE C 48 6.764 -18.251 -0.921 1.00 0.00 H new ATOM 0 HB3 PHE C 48 6.502 -19.419 -2.201 1.00 0.00 H new ATOM 0 HD1 PHE C 48 7.820 -18.984 1.248 1.00 0.00 H new ATOM 0 HD2 PHE C 48 6.681 -21.792 -1.794 1.00 0.00 H new ATOM 0 HE1 PHE C 48 7.944 -20.824 2.905 1.00 0.00 H new ATOM 0 HE2 PHE C 48 6.804 -23.636 -0.137 1.00 0.00 H new ATOM 0 HZ PHE C 48 7.438 -23.152 2.212 1.00 0.00 H new ATOM 1507 N LYS C 49 8.955 -18.508 -4.300 1.00 0.00 N ATOM 1508 CA LYS C 49 8.917 -17.763 -5.559 1.00 0.00 C ATOM 1509 C LYS C 49 7.645 -18.086 -6.334 1.00 0.00 C ATOM 1510 O LYS C 49 6.706 -18.567 -5.720 1.00 0.00 O ATOM 1511 CB LYS C 49 10.139 -18.119 -6.410 1.00 0.00 C ATOM 1512 CG LYS C 49 11.404 -17.602 -5.724 1.00 0.00 C ATOM 1513 CD LYS C 49 12.628 -17.977 -6.561 1.00 0.00 C ATOM 1514 CE LYS C 49 13.900 -17.524 -5.838 1.00 0.00 C ATOM 1515 NZ LYS C 49 13.938 -16.035 -5.788 1.00 0.00 N ATOM 1516 OXT LYS C 49 7.626 -17.847 -7.530 1.00 0.00 O ATOM 0 H LYS C 49 9.373 -19.436 -4.369 1.00 0.00 H new ATOM 0 HA LYS C 49 8.929 -16.697 -5.331 1.00 0.00 H new ATOM 0 HB2 LYS C 49 10.200 -19.199 -6.544 1.00 0.00 H new ATOM 0 HB3 LYS C 49 10.045 -17.679 -7.403 1.00 0.00 H new ATOM 0 HG2 LYS C 49 11.349 -16.520 -5.605 1.00 0.00 H new ATOM 0 HG3 LYS C 49 11.489 -18.029 -4.725 1.00 0.00 H new ATOM 0 HD2 LYS C 49 12.654 -19.054 -6.724 1.00 0.00 H new ATOM 0 HD3 LYS C 49 12.568 -17.507 -7.543 1.00 0.00 H new ATOM 0 HE2 LYS C 49 13.923 -17.933 -4.828 1.00 0.00 H new ATOM 0 HE3 LYS C 49 14.781 -17.904 -6.356 1.00 0.00 H new ATOM 0 HZ1 LYS C 49 14.901 -15.720 -5.551 1.00 0.00 H new ATOM 0 HZ2 LYS C 49 13.665 -15.649 -6.715 1.00 0.00 H new ATOM 0 HZ3 LYS C 49 13.275 -15.695 -5.063 1.00 0.00 H new TER 1530 LYS C 49 ATOM 1531 N SER D 19 -17.394 19.989 3.677 1.00 0.00 N ATOM 1532 CA SER D 19 -16.865 20.112 5.066 1.00 0.00 C ATOM 1533 C SER D 19 -15.413 19.648 5.095 1.00 0.00 C ATOM 1534 O SER D 19 -14.973 18.903 4.219 1.00 0.00 O ATOM 1535 CB SER D 19 -17.706 19.252 6.007 1.00 0.00 C ATOM 1536 OG SER D 19 -17.606 17.890 5.612 1.00 0.00 O ATOM 0 HA SER D 19 -16.916 21.151 5.390 1.00 0.00 H new ATOM 0 HB2 SER D 19 -17.361 19.371 7.034 1.00 0.00 H new ATOM 0 HB3 SER D 19 -18.747 19.575 5.981 1.00 0.00 H new ATOM 0 HG SER D 19 -17.466 17.840 4.643 1.00 0.00 H new ATOM 1544 N ASN D 20 -14.675 20.090 6.108 1.00 0.00 N ATOM 1545 CA ASN D 20 -13.273 19.708 6.244 1.00 0.00 C ATOM 1546 C ASN D 20 -12.494 20.069 4.983 1.00 0.00 C ATOM 1547 O ASN D 20 -11.643 19.307 4.527 1.00 0.00 O ATOM 1548 CB ASN D 20 -13.161 18.205 6.504 1.00 0.00 C ATOM 1549 CG ASN D 20 -13.819 17.853 7.835 1.00 0.00 C ATOM 1550 OD1 ASN D 20 -13.879 18.749 8.785 1.00 0.00 O flip ATOM 1551 ND2 ASN D 20 -14.297 16.734 8.015 1.00 0.00 N flip ATOM 0 H ASN D 20 -15.020 20.708 6.842 1.00 0.00 H new ATOM 0 HA ASN D 20 -12.849 20.253 7.088 1.00 0.00 H new ATOM 0 HB2 ASN D 20 -13.639 17.652 5.696 1.00 0.00 H new ATOM 0 HB3 ASN D 20 -12.112 17.907 6.518 1.00 0.00 H new ATOM 0 HD21 ASN D 20 -14.251 16.034 7.274 1.00 0.00 H new ATOM 0 HD22 ASN D 20 -14.740 16.506 8.905 1.00 0.00 H new ATOM 1558 N ASP D 21 -12.796 21.236 4.423 1.00 0.00 N ATOM 1559 CA ASP D 21 -12.123 21.688 3.209 1.00 0.00 C ATOM 1560 C ASP D 21 -10.620 21.824 3.444 1.00 0.00 C ATOM 1561 O ASP D 21 -9.816 21.475 2.580 1.00 0.00 O ATOM 1562 CB ASP D 21 -12.694 23.037 2.770 1.00 0.00 C ATOM 1563 CG ASP D 21 -11.978 23.523 1.514 1.00 0.00 C ATOM 1564 OD1 ASP D 21 -12.029 22.822 0.516 1.00 0.00 O ATOM 1565 OD2 ASP D 21 -11.389 24.590 1.567 1.00 0.00 O ATOM 0 H ASP D 21 -13.497 21.882 4.786 1.00 0.00 H new ATOM 0 HA ASP D 21 -12.291 20.947 2.427 1.00 0.00 H new ATOM 0 HB2 ASP D 21 -13.762 22.943 2.576 1.00 0.00 H new ATOM 0 HB3 ASP D 21 -12.578 23.768 3.570 1.00 0.00 H new ATOM 1570 N SER D 22 -10.248 22.334 4.614 1.00 0.00 N ATOM 1571 CA SER D 22 -8.838 22.513 4.945 1.00 0.00 C ATOM 1572 C SER D 22 -8.109 21.170 4.946 1.00 0.00 C ATOM 1573 O SER D 22 -7.006 21.052 4.413 1.00 0.00 O ATOM 1574 CB SER D 22 -8.707 23.169 6.319 1.00 0.00 C ATOM 1575 OG SER D 22 -7.332 23.373 6.614 1.00 0.00 O ATOM 0 H SER D 22 -10.897 22.629 5.344 1.00 0.00 H new ATOM 0 HA SER D 22 -8.385 23.155 4.190 1.00 0.00 H new ATOM 0 HB2 SER D 22 -9.238 24.121 6.332 1.00 0.00 H new ATOM 0 HB3 SER D 22 -9.164 22.538 7.081 1.00 0.00 H new ATOM 0 HG SER D 22 -7.245 23.795 7.494 1.00 0.00 H new ATOM 1581 N SER D 23 -8.739 20.158 5.541 1.00 0.00 N ATOM 1582 CA SER D 23 -8.160 18.814 5.608 1.00 0.00 C ATOM 1583 C SER D 23 -9.008 17.847 4.794 1.00 0.00 C ATOM 1584 O SER D 23 -10.061 17.395 5.246 1.00 0.00 O ATOM 1585 CB SER D 23 -8.108 18.343 7.063 1.00 0.00 C ATOM 1586 OG SER D 23 -7.539 17.040 7.114 1.00 0.00 O ATOM 0 H SER D 23 -9.653 20.242 5.985 1.00 0.00 H new ATOM 0 HA SER D 23 -7.149 18.842 5.201 1.00 0.00 H new ATOM 0 HB2 SER D 23 -7.515 19.035 7.661 1.00 0.00 H new ATOM 0 HB3 SER D 23 -9.111 18.332 7.490 1.00 0.00 H new ATOM 0 HG SER D 23 -7.502 16.735 8.045 1.00 0.00 H new ATOM 1592 N ASP D 24 -8.553 17.539 3.582 1.00 0.00 N ATOM 1593 CA ASP D 24 -9.291 16.632 2.709 1.00 0.00 C ATOM 1594 C ASP D 24 -9.431 15.249 3.363 1.00 0.00 C ATOM 1595 O ASP D 24 -8.451 14.710 3.876 1.00 0.00 O ATOM 1596 CB ASP D 24 -8.559 16.489 1.372 1.00 0.00 C ATOM 1597 CG ASP D 24 -9.481 15.849 0.340 1.00 0.00 C ATOM 1598 OD1 ASP D 24 -9.742 14.664 0.461 1.00 0.00 O ATOM 1599 OD2 ASP D 24 -9.909 16.553 -0.561 1.00 0.00 O ATOM 0 H ASP D 24 -7.685 17.900 3.186 1.00 0.00 H new ATOM 0 HA ASP D 24 -10.285 17.046 2.541 1.00 0.00 H new ATOM 0 HB2 ASP D 24 -8.230 17.467 1.021 1.00 0.00 H new ATOM 0 HB3 ASP D 24 -7.665 15.879 1.501 1.00 0.00 H new ATOM 1604 N PRO D 25 -10.611 14.657 3.365 1.00 0.00 N ATOM 1605 CA PRO D 25 -10.817 13.314 3.988 1.00 0.00 C ATOM 1606 C PRO D 25 -10.161 12.193 3.178 1.00 0.00 C ATOM 1607 O PRO D 25 -9.931 11.097 3.694 1.00 0.00 O ATOM 1608 CB PRO D 25 -12.346 13.161 4.027 1.00 0.00 C ATOM 1609 CG PRO D 25 -12.848 14.014 2.907 1.00 0.00 C ATOM 1610 CD PRO D 25 -11.865 15.181 2.785 1.00 0.00 C ATOM 0 HA PRO D 25 -10.358 13.243 4.974 1.00 0.00 H new ATOM 0 HB2 PRO D 25 -12.642 12.120 3.894 1.00 0.00 H new ATOM 0 HB3 PRO D 25 -12.751 13.488 4.985 1.00 0.00 H new ATOM 0 HG2 PRO D 25 -12.896 13.447 1.977 1.00 0.00 H new ATOM 0 HG3 PRO D 25 -13.856 14.374 3.113 1.00 0.00 H new ATOM 0 HD2 PRO D 25 -11.729 15.481 1.746 1.00 0.00 H new ATOM 0 HD3 PRO D 25 -12.219 16.059 3.326 1.00 0.00 H new ATOM 1618 N LEU D 26 -9.870 12.466 1.910 1.00 0.00 N ATOM 1619 CA LEU D 26 -9.255 11.462 1.049 1.00 0.00 C ATOM 1620 C LEU D 26 -7.881 11.063 1.585 1.00 0.00 C ATOM 1621 O LEU D 26 -7.550 9.878 1.645 1.00 0.00 O ATOM 1622 CB LEU D 26 -9.113 12.015 -0.375 1.00 0.00 C ATOM 1623 CG LEU D 26 -8.534 10.948 -1.318 1.00 0.00 C ATOM 1624 CD1 LEU D 26 -9.487 9.743 -1.413 1.00 0.00 C ATOM 1625 CD2 LEU D 26 -8.341 11.564 -2.707 1.00 0.00 C ATOM 0 H LEU D 26 -10.048 13.364 1.460 1.00 0.00 H new ATOM 0 HA LEU D 26 -9.894 10.579 1.035 1.00 0.00 H new ATOM 0 HB2 LEU D 26 -10.086 12.342 -0.742 1.00 0.00 H new ATOM 0 HB3 LEU D 26 -8.464 12.891 -0.367 1.00 0.00 H new ATOM 0 HG LEU D 26 -7.577 10.603 -0.927 1.00 0.00 H new ATOM 0 HD11 LEU D 26 -9.063 8.996 -2.084 1.00 0.00 H new ATOM 0 HD12 LEU D 26 -9.622 9.307 -0.423 1.00 0.00 H new ATOM 0 HD13 LEU D 26 -10.452 10.072 -1.799 1.00 0.00 H new ATOM 0 HD21 LEU D 26 -7.930 10.814 -3.384 1.00 0.00 H new ATOM 0 HD22 LEU D 26 -9.302 11.910 -3.088 1.00 0.00 H new ATOM 0 HD23 LEU D 26 -7.653 12.407 -2.639 1.00 0.00 H new ATOM 1637 N VAL D 27 -7.087 12.055 1.973 1.00 0.00 N ATOM 1638 CA VAL D 27 -5.755 11.789 2.502 1.00 0.00 C ATOM 1639 C VAL D 27 -5.845 11.016 3.815 1.00 0.00 C ATOM 1640 O VAL D 27 -5.120 10.044 4.025 1.00 0.00 O ATOM 1641 CB VAL D 27 -5.006 13.107 2.722 1.00 0.00 C ATOM 1642 CG1 VAL D 27 -3.672 12.834 3.422 1.00 0.00 C ATOM 1643 CG2 VAL D 27 -4.740 13.770 1.367 1.00 0.00 C ATOM 0 H VAL D 27 -7.340 13.042 1.932 1.00 0.00 H new ATOM 0 HA VAL D 27 -5.209 11.184 1.779 1.00 0.00 H new ATOM 0 HB VAL D 27 -5.611 13.767 3.344 1.00 0.00 H new ATOM 0 HG11 VAL D 27 -3.143 13.774 3.576 1.00 0.00 H new ATOM 0 HG12 VAL D 27 -3.857 12.359 4.386 1.00 0.00 H new ATOM 0 HG13 VAL D 27 -3.065 12.173 2.803 1.00 0.00 H new ATOM 0 HG21 VAL D 27 -4.207 14.708 1.520 1.00 0.00 H new ATOM 0 HG22 VAL D 27 -4.136 13.106 0.749 1.00 0.00 H new ATOM 0 HG23 VAL D 27 -5.688 13.968 0.867 1.00 0.00 H new ATOM 1653 N VAL D 28 -6.736 11.457 4.696 1.00 0.00 N ATOM 1654 CA VAL D 28 -6.909 10.801 5.988 1.00 0.00 C ATOM 1655 C VAL D 28 -7.410 9.374 5.798 1.00 0.00 C ATOM 1656 O VAL D 28 -6.911 8.441 6.427 1.00 0.00 O ATOM 1657 CB VAL D 28 -7.904 11.590 6.844 1.00 0.00 C ATOM 1658 CG1 VAL D 28 -8.180 10.831 8.144 1.00 0.00 C ATOM 1659 CG2 VAL D 28 -7.313 12.964 7.169 1.00 0.00 C ATOM 0 H VAL D 28 -7.346 12.260 4.542 1.00 0.00 H new ATOM 0 HA VAL D 28 -5.944 10.769 6.494 1.00 0.00 H new ATOM 0 HB VAL D 28 -8.838 11.714 6.295 1.00 0.00 H new ATOM 0 HG11 VAL D 28 -8.888 11.395 8.751 1.00 0.00 H new ATOM 0 HG12 VAL D 28 -8.600 9.852 7.912 1.00 0.00 H new ATOM 0 HG13 VAL D 28 -7.249 10.705 8.696 1.00 0.00 H new ATOM 0 HG21 VAL D 28 -8.019 13.529 7.778 1.00 0.00 H new ATOM 0 HG22 VAL D 28 -6.380 12.838 7.718 1.00 0.00 H new ATOM 0 HG23 VAL D 28 -7.119 13.505 6.243 1.00 0.00 H new ATOM 1669 N ALA D 29 -8.402 9.210 4.927 1.00 0.00 N ATOM 1670 CA ALA D 29 -8.963 7.891 4.665 1.00 0.00 C ATOM 1671 C ALA D 29 -7.919 6.976 4.038 1.00 0.00 C ATOM 1672 O ALA D 29 -7.850 5.791 4.353 1.00 0.00 O ATOM 1673 CB ALA D 29 -10.165 8.009 3.723 1.00 0.00 C ATOM 0 H ALA D 29 -8.830 9.968 4.395 1.00 0.00 H new ATOM 0 HA ALA D 29 -9.283 7.463 5.615 1.00 0.00 H new ATOM 0 HB1 ALA D 29 -10.577 7.018 3.533 1.00 0.00 H new ATOM 0 HB2 ALA D 29 -10.928 8.637 4.183 1.00 0.00 H new ATOM 0 HB3 ALA D 29 -9.847 8.456 2.781 1.00 0.00 H new ATOM 1679 N ALA D 30 -7.106 7.532 3.147 1.00 0.00 N ATOM 1680 CA ALA D 30 -6.074 6.747 2.481 1.00 0.00 C ATOM 1681 C ALA D 30 -5.149 6.096 3.505 1.00 0.00 C ATOM 1682 O ALA D 30 -4.862 4.903 3.424 1.00 0.00 O ATOM 1683 CB ALA D 30 -5.255 7.644 1.550 1.00 0.00 C ATOM 0 H ALA D 30 -7.140 8.513 2.871 1.00 0.00 H new ATOM 0 HA ALA D 30 -6.560 5.964 1.898 1.00 0.00 H new ATOM 0 HB1 ALA D 30 -4.486 7.050 1.056 1.00 0.00 H new ATOM 0 HB2 ALA D 30 -5.911 8.085 0.799 1.00 0.00 H new ATOM 0 HB3 ALA D 30 -4.784 8.437 2.131 1.00 0.00 H new ATOM 1689 N ASN D 31 -4.687 6.887 4.467 1.00 0.00 N ATOM 1690 CA ASN D 31 -3.796 6.372 5.499 1.00 0.00 C ATOM 1691 C ASN D 31 -4.506 5.322 6.352 1.00 0.00 C ATOM 1692 O ASN D 31 -3.923 4.294 6.697 1.00 0.00 O ATOM 1693 CB ASN D 31 -3.319 7.520 6.389 1.00 0.00 C ATOM 1694 CG ASN D 31 -2.357 8.414 5.611 1.00 0.00 C ATOM 1695 OD1 ASN D 31 -1.772 7.981 4.619 1.00 0.00 O ATOM 1696 ND2 ASN D 31 -2.165 9.643 6.001 1.00 0.00 N ATOM 0 H ASN D 31 -4.912 7.878 4.554 1.00 0.00 H new ATOM 0 HA ASN D 31 -2.939 5.904 5.014 1.00 0.00 H new ATOM 0 HB2 ASN D 31 -4.173 8.103 6.734 1.00 0.00 H new ATOM 0 HB3 ASN D 31 -2.824 7.123 7.276 1.00 0.00 H new ATOM 0 HD21 ASN D 31 -1.528 10.249 5.483 1.00 0.00 H new ATOM 0 HD22 ASN D 31 -2.652 9.999 6.824 1.00 0.00 H new ATOM 1703 N ILE D 32 -5.765 5.589 6.688 1.00 0.00 N ATOM 1704 CA ILE D 32 -6.541 4.660 7.502 1.00 0.00 C ATOM 1705 C ILE D 32 -6.756 3.344 6.755 1.00 0.00 C ATOM 1706 O ILE D 32 -6.618 2.263 7.329 1.00 0.00 O ATOM 1707 CB ILE D 32 -7.895 5.284 7.857 1.00 0.00 C ATOM 1708 CG1 ILE D 32 -7.671 6.473 8.796 1.00 0.00 C ATOM 1709 CG2 ILE D 32 -8.774 4.246 8.562 1.00 0.00 C ATOM 1710 CD1 ILE D 32 -8.970 7.268 8.935 1.00 0.00 C ATOM 0 H ILE D 32 -6.266 6.434 6.412 1.00 0.00 H new ATOM 0 HA ILE D 32 -5.988 4.454 8.418 1.00 0.00 H new ATOM 0 HB ILE D 32 -8.389 5.618 6.945 1.00 0.00 H new ATOM 0 HG12 ILE D 32 -7.342 6.121 9.774 1.00 0.00 H new ATOM 0 HG13 ILE D 32 -6.880 7.114 8.406 1.00 0.00 H new ATOM 0 HG21 ILE D 32 -9.736 4.694 8.813 1.00 0.00 H new ATOM 0 HG22 ILE D 32 -8.932 3.394 7.901 1.00 0.00 H new ATOM 0 HG23 ILE D 32 -8.281 3.911 9.475 1.00 0.00 H new ATOM 0 HD11 ILE D 32 -8.809 8.114 9.603 1.00 0.00 H new ATOM 0 HD12 ILE D 32 -9.280 7.633 7.956 1.00 0.00 H new ATOM 0 HD13 ILE D 32 -9.748 6.624 9.345 1.00 0.00 H new ATOM 1722 N ILE D 33 -7.094 3.445 5.474 1.00 0.00 N ATOM 1723 CA ILE D 33 -7.327 2.260 4.656 1.00 0.00 C ATOM 1724 C ILE D 33 -6.047 1.430 4.527 1.00 0.00 C ATOM 1725 O ILE D 33 -6.084 0.205 4.633 1.00 0.00 O ATOM 1726 CB ILE D 33 -7.830 2.677 3.268 1.00 0.00 C ATOM 1727 CG1 ILE D 33 -9.248 3.249 3.388 1.00 0.00 C ATOM 1728 CG2 ILE D 33 -7.847 1.466 2.333 1.00 0.00 C ATOM 1729 CD1 ILE D 33 -9.636 3.936 2.076 1.00 0.00 C ATOM 0 H ILE D 33 -7.212 4.330 4.982 1.00 0.00 H new ATOM 0 HA ILE D 33 -8.085 1.645 5.142 1.00 0.00 H new ATOM 0 HB ILE D 33 -7.162 3.435 2.859 1.00 0.00 H new ATOM 0 HG12 ILE D 33 -9.955 2.451 3.616 1.00 0.00 H new ATOM 0 HG13 ILE D 33 -9.295 3.962 4.211 1.00 0.00 H new ATOM 0 HG21 ILE D 33 -8.205 1.771 1.350 1.00 0.00 H new ATOM 0 HG22 ILE D 33 -6.839 1.062 2.243 1.00 0.00 H new ATOM 0 HG23 ILE D 33 -8.509 0.702 2.740 1.00 0.00 H new ATOM 0 HD11 ILE D 33 -10.644 4.342 2.162 1.00 0.00 H new ATOM 0 HD12 ILE D 33 -8.935 4.745 1.868 1.00 0.00 H new ATOM 0 HD13 ILE D 33 -9.605 3.211 1.263 1.00 0.00 H new ATOM 1741 N GLY D 34 -4.924 2.100 4.295 1.00 0.00 N ATOM 1742 CA GLY D 34 -3.650 1.398 4.150 1.00 0.00 C ATOM 1743 C GLY D 34 -3.298 0.640 5.426 1.00 0.00 C ATOM 1744 O GLY D 34 -2.878 -0.519 5.378 1.00 0.00 O ATOM 0 H GLY D 34 -4.867 3.114 4.204 1.00 0.00 H new ATOM 0 HA2 GLY D 34 -3.707 0.702 3.313 1.00 0.00 H new ATOM 0 HA3 GLY D 34 -2.861 2.113 3.917 1.00 0.00 H new ATOM 1748 N ILE D 35 -3.481 1.296 6.565 1.00 0.00 N ATOM 1749 CA ILE D 35 -3.185 0.676 7.853 1.00 0.00 C ATOM 1750 C ILE D 35 -4.108 -0.519 8.084 1.00 0.00 C ATOM 1751 O ILE D 35 -3.674 -1.579 8.541 1.00 0.00 O ATOM 1752 CB ILE D 35 -3.356 1.704 8.974 1.00 0.00 C ATOM 1753 CG1 ILE D 35 -2.274 2.781 8.835 1.00 0.00 C ATOM 1754 CG2 ILE D 35 -3.211 1.013 10.331 1.00 0.00 C ATOM 1755 CD1 ILE D 35 -2.617 3.978 9.723 1.00 0.00 C ATOM 0 H ILE D 35 -3.831 2.252 6.625 1.00 0.00 H new ATOM 0 HA ILE D 35 -2.154 0.323 7.852 1.00 0.00 H new ATOM 0 HB ILE D 35 -4.344 2.160 8.905 1.00 0.00 H new ATOM 0 HG12 ILE D 35 -1.304 2.373 9.118 1.00 0.00 H new ATOM 0 HG13 ILE D 35 -2.196 3.099 7.795 1.00 0.00 H new ATOM 0 HG21 ILE D 35 -3.333 1.747 11.128 1.00 0.00 H new ATOM 0 HG22 ILE D 35 -3.974 0.240 10.429 1.00 0.00 H new ATOM 0 HG23 ILE D 35 -2.223 0.559 10.404 1.00 0.00 H new ATOM 0 HD11 ILE D 35 -1.845 4.740 9.620 1.00 0.00 H new ATOM 0 HD12 ILE D 35 -3.578 4.392 9.420 1.00 0.00 H new ATOM 0 HD13 ILE D 35 -2.673 3.656 10.763 1.00 0.00 H new ATOM 1767 N LEU D 36 -5.384 -0.338 7.758 1.00 0.00 N ATOM 1768 CA LEU D 36 -6.362 -1.405 7.929 1.00 0.00 C ATOM 1769 C LEU D 36 -5.970 -2.608 7.081 1.00 0.00 C ATOM 1770 O LEU D 36 -6.125 -3.754 7.505 1.00 0.00 O ATOM 1771 CB LEU D 36 -7.758 -0.914 7.524 1.00 0.00 C ATOM 1772 CG LEU D 36 -8.802 -2.021 7.738 1.00 0.00 C ATOM 1773 CD1 LEU D 36 -8.855 -2.430 9.223 1.00 0.00 C ATOM 1774 CD2 LEU D 36 -10.176 -1.504 7.299 1.00 0.00 C ATOM 0 H LEU D 36 -5.762 0.530 7.377 1.00 0.00 H new ATOM 0 HA LEU D 36 -6.383 -1.698 8.979 1.00 0.00 H new ATOM 0 HB2 LEU D 36 -8.025 -0.036 8.111 1.00 0.00 H new ATOM 0 HB3 LEU D 36 -7.753 -0.608 6.478 1.00 0.00 H new ATOM 0 HG LEU D 36 -8.525 -2.893 7.146 1.00 0.00 H new ATOM 0 HD11 LEU D 36 -9.599 -3.215 9.358 1.00 0.00 H new ATOM 0 HD12 LEU D 36 -7.878 -2.799 9.534 1.00 0.00 H new ATOM 0 HD13 LEU D 36 -9.126 -1.565 9.829 1.00 0.00 H new ATOM 0 HD21 LEU D 36 -10.923 -2.284 7.448 1.00 0.00 H new ATOM 0 HD22 LEU D 36 -10.442 -0.629 7.892 1.00 0.00 H new ATOM 0 HD23 LEU D 36 -10.142 -1.231 6.244 1.00 0.00 H new ATOM 1786 N HIS D 37 -5.456 -2.340 5.886 1.00 0.00 N ATOM 1787 CA HIS D 37 -5.041 -3.414 4.995 1.00 0.00 C ATOM 1788 C HIS D 37 -3.991 -4.279 5.675 1.00 0.00 C ATOM 1789 O HIS D 37 -4.023 -5.505 5.573 1.00 0.00 O ATOM 1790 CB HIS D 37 -4.457 -2.836 3.704 1.00 0.00 C ATOM 1791 CG HIS D 37 -4.082 -3.967 2.786 1.00 0.00 C ATOM 1792 ND1 HIS D 37 -4.664 -4.140 1.542 1.00 0.00 N ATOM 1793 CD2 HIS D 37 -3.193 -5.002 2.923 1.00 0.00 C ATOM 1794 CE1 HIS D 37 -4.125 -5.243 0.992 1.00 0.00 C ATOM 1795 NE2 HIS D 37 -3.223 -5.804 1.792 1.00 0.00 N ATOM 0 H HIS D 37 -5.318 -1.400 5.516 1.00 0.00 H new ATOM 0 HA HIS D 37 -5.914 -4.021 4.756 1.00 0.00 H new ATOM 0 HB2 HIS D 37 -5.185 -2.184 3.220 1.00 0.00 H new ATOM 0 HB3 HIS D 37 -3.582 -2.226 3.927 1.00 0.00 H new ATOM 0 HD2 HIS D 37 -2.563 -5.168 3.784 1.00 0.00 H new ATOM 0 HE1 HIS D 37 -4.392 -5.627 0.018 1.00 0.00 H new ATOM 0 HE2 HIS D 37 -2.672 -6.643 1.612 1.00 0.00 H new ATOM 1803 N LEU D 38 -3.059 -3.637 6.369 1.00 0.00 N ATOM 1804 CA LEU D 38 -2.001 -4.370 7.056 1.00 0.00 C ATOM 1805 C LEU D 38 -2.579 -5.317 8.098 1.00 0.00 C ATOM 1806 O LEU D 38 -2.094 -6.435 8.250 1.00 0.00 O ATOM 1807 CB LEU D 38 -1.017 -3.385 7.723 1.00 0.00 C ATOM 1808 CG LEU D 38 0.134 -3.040 6.755 1.00 0.00 C ATOM 1809 CD1 LEU D 38 0.763 -1.700 7.145 1.00 0.00 C ATOM 1810 CD2 LEU D 38 1.214 -4.138 6.808 1.00 0.00 C ATOM 0 H LEU D 38 -3.013 -2.623 6.471 1.00 0.00 H new ATOM 0 HA LEU D 38 -1.465 -4.964 6.316 1.00 0.00 H new ATOM 0 HB2 LEU D 38 -1.543 -2.475 8.012 1.00 0.00 H new ATOM 0 HB3 LEU D 38 -0.614 -3.825 8.636 1.00 0.00 H new ATOM 0 HG LEU D 38 -0.269 -2.973 5.745 1.00 0.00 H new ATOM 0 HD11 LEU D 38 1.574 -1.465 6.456 1.00 0.00 H new ATOM 0 HD12 LEU D 38 0.008 -0.916 7.097 1.00 0.00 H new ATOM 0 HD13 LEU D 38 1.156 -1.764 8.160 1.00 0.00 H new ATOM 0 HD21 LEU D 38 2.023 -3.886 6.122 1.00 0.00 H new ATOM 0 HD22 LEU D 38 1.608 -4.212 7.822 1.00 0.00 H new ATOM 0 HD23 LEU D 38 0.776 -5.093 6.518 1.00 0.00 H new ATOM 1822 N ILE D 39 -3.597 -4.876 8.819 1.00 0.00 N ATOM 1823 CA ILE D 39 -4.191 -5.727 9.844 1.00 0.00 C ATOM 1824 C ILE D 39 -4.781 -6.990 9.216 1.00 0.00 C ATOM 1825 O ILE D 39 -4.599 -8.093 9.732 1.00 0.00 O ATOM 1826 CB ILE D 39 -5.284 -4.955 10.587 1.00 0.00 C ATOM 1827 CG1 ILE D 39 -4.638 -3.827 11.397 1.00 0.00 C ATOM 1828 CG2 ILE D 39 -6.030 -5.898 11.536 1.00 0.00 C ATOM 1829 CD1 ILE D 39 -5.721 -2.890 11.932 1.00 0.00 C ATOM 0 H ILE D 39 -4.024 -3.955 8.720 1.00 0.00 H new ATOM 0 HA ILE D 39 -3.413 -6.021 10.549 1.00 0.00 H new ATOM 0 HB ILE D 39 -5.989 -4.539 9.867 1.00 0.00 H new ATOM 0 HG12 ILE D 39 -4.063 -4.244 12.224 1.00 0.00 H new ATOM 0 HG13 ILE D 39 -3.940 -3.271 10.771 1.00 0.00 H new ATOM 0 HG21 ILE D 39 -6.807 -5.344 12.063 1.00 0.00 H new ATOM 0 HG22 ILE D 39 -6.485 -6.706 10.963 1.00 0.00 H new ATOM 0 HG23 ILE D 39 -5.329 -6.316 12.259 1.00 0.00 H new ATOM 0 HD11 ILE D 39 -5.257 -2.089 12.508 1.00 0.00 H new ATOM 0 HD12 ILE D 39 -6.277 -2.462 11.098 1.00 0.00 H new ATOM 0 HD13 ILE D 39 -6.402 -3.450 12.573 1.00 0.00 H new ATOM 1841 N LEU D 40 -5.492 -6.826 8.109 1.00 0.00 N ATOM 1842 CA LEU D 40 -6.097 -7.967 7.431 1.00 0.00 C ATOM 1843 C LEU D 40 -5.040 -8.822 6.728 1.00 0.00 C ATOM 1844 O LEU D 40 -5.080 -10.052 6.793 1.00 0.00 O ATOM 1845 CB LEU D 40 -7.129 -7.474 6.419 1.00 0.00 C ATOM 1846 CG LEU D 40 -8.099 -6.504 7.111 1.00 0.00 C ATOM 1847 CD1 LEU D 40 -9.105 -5.973 6.087 1.00 0.00 C ATOM 1848 CD2 LEU D 40 -8.846 -7.226 8.245 1.00 0.00 C ATOM 0 H LEU D 40 -5.664 -5.924 7.664 1.00 0.00 H new ATOM 0 HA LEU D 40 -6.587 -8.590 8.180 1.00 0.00 H new ATOM 0 HB2 LEU D 40 -6.630 -6.976 5.588 1.00 0.00 H new ATOM 0 HB3 LEU D 40 -7.678 -8.318 6.002 1.00 0.00 H new ATOM 0 HG LEU D 40 -7.534 -5.672 7.533 1.00 0.00 H new ATOM 0 HD11 LEU D 40 -9.794 -5.285 6.577 1.00 0.00 H new ATOM 0 HD12 LEU D 40 -8.573 -5.450 5.292 1.00 0.00 H new ATOM 0 HD13 LEU D 40 -9.665 -6.806 5.662 1.00 0.00 H new ATOM 0 HD21 LEU D 40 -9.531 -6.531 8.730 1.00 0.00 H new ATOM 0 HD22 LEU D 40 -9.410 -8.064 7.834 1.00 0.00 H new ATOM 0 HD23 LEU D 40 -8.127 -7.596 8.976 1.00 0.00 H new ATOM 1860 N TRP D 41 -4.105 -8.166 6.042 1.00 0.00 N ATOM 1861 CA TRP D 41 -3.051 -8.876 5.317 1.00 0.00 C ATOM 1862 C TRP D 41 -2.092 -9.585 6.273 1.00 0.00 C ATOM 1863 O TRP D 41 -1.753 -10.750 6.064 1.00 0.00 O ATOM 1864 CB TRP D 41 -2.282 -7.887 4.429 1.00 0.00 C ATOM 1865 CG TRP D 41 -1.067 -8.544 3.851 1.00 0.00 C ATOM 1866 CD1 TRP D 41 -1.041 -9.300 2.728 1.00 0.00 C ATOM 1867 CD2 TRP D 41 0.306 -8.480 4.328 1.00 0.00 C ATOM 1868 NE1 TRP D 41 0.256 -9.728 2.508 1.00 0.00 N ATOM 1869 CE2 TRP D 41 1.122 -9.241 3.463 1.00 0.00 C ATOM 1870 CE3 TRP D 41 0.916 -7.841 5.423 1.00 0.00 C ATOM 1871 CZ2 TRP D 41 2.490 -9.365 3.678 1.00 0.00 C ATOM 1872 CZ3 TRP D 41 2.297 -7.961 5.634 1.00 0.00 C ATOM 1873 CH2 TRP D 41 3.080 -8.722 4.764 1.00 0.00 C ATOM 0 H TRP D 41 -4.055 -7.150 5.973 1.00 0.00 H new ATOM 0 HA TRP D 41 -3.519 -9.639 4.695 1.00 0.00 H new ATOM 0 HB2 TRP D 41 -2.928 -7.531 3.626 1.00 0.00 H new ATOM 0 HB3 TRP D 41 -1.989 -7.015 5.013 1.00 0.00 H new ATOM 0 HD1 TRP D 41 -1.893 -9.531 2.106 1.00 0.00 H new ATOM 0 HE1 TRP D 41 0.537 -10.330 1.734 1.00 0.00 H new ATOM 0 HE3 TRP D 41 0.317 -7.255 6.105 1.00 0.00 H new ATOM 0 HZ2 TRP D 41 3.093 -9.957 3.006 1.00 0.00 H new ATOM 0 HZ3 TRP D 41 2.757 -7.462 6.474 1.00 0.00 H new ATOM 0 HH2 TRP D 41 4.143 -8.812 4.933 1.00 0.00 H new ATOM 1884 N ILE D 42 -1.647 -8.882 7.307 1.00 0.00 N ATOM 1885 CA ILE D 42 -0.715 -9.469 8.265 1.00 0.00 C ATOM 1886 C ILE D 42 -1.385 -10.623 9.006 1.00 0.00 C ATOM 1887 O ILE D 42 -0.758 -11.647 9.279 1.00 0.00 O ATOM 1888 CB ILE D 42 -0.235 -8.400 9.263 1.00 0.00 C ATOM 1889 CG1 ILE D 42 1.024 -8.897 9.986 1.00 0.00 C ATOM 1890 CG2 ILE D 42 -1.329 -8.105 10.302 1.00 0.00 C ATOM 1891 CD1 ILE D 42 1.594 -7.769 10.847 1.00 0.00 C ATOM 0 H ILE D 42 -1.911 -7.917 7.504 1.00 0.00 H new ATOM 0 HA ILE D 42 0.150 -9.854 7.725 1.00 0.00 H new ATOM 0 HB ILE D 42 -0.011 -7.487 8.712 1.00 0.00 H new ATOM 0 HG12 ILE D 42 0.783 -9.758 10.609 1.00 0.00 H new ATOM 0 HG13 ILE D 42 1.767 -9.227 9.260 1.00 0.00 H new ATOM 0 HG21 ILE D 42 -0.973 -7.347 11.000 1.00 0.00 H new ATOM 0 HG22 ILE D 42 -2.223 -7.741 9.796 1.00 0.00 H new ATOM 0 HG23 ILE D 42 -1.568 -9.018 10.848 1.00 0.00 H new ATOM 0 HD11 ILE D 42 2.488 -8.120 11.361 1.00 0.00 H new ATOM 0 HD12 ILE D 42 1.850 -6.921 10.212 1.00 0.00 H new ATOM 0 HD13 ILE D 42 0.850 -7.461 11.582 1.00 0.00 H new ATOM 1903 N LEU D 43 -2.662 -10.447 9.328 1.00 0.00 N ATOM 1904 CA LEU D 43 -3.412 -11.476 10.038 1.00 0.00 C ATOM 1905 C LEU D 43 -3.488 -12.754 9.212 1.00 0.00 C ATOM 1906 O LEU D 43 -3.339 -13.855 9.742 1.00 0.00 O ATOM 1907 CB LEU D 43 -4.830 -10.972 10.342 1.00 0.00 C ATOM 1908 CG LEU D 43 -5.660 -12.069 11.029 1.00 0.00 C ATOM 1909 CD1 LEU D 43 -4.950 -12.555 12.303 1.00 0.00 C ATOM 1910 CD2 LEU D 43 -7.033 -11.497 11.396 1.00 0.00 C ATOM 0 H LEU D 43 -3.197 -9.606 9.110 1.00 0.00 H new ATOM 0 HA LEU D 43 -2.896 -11.696 10.973 1.00 0.00 H new ATOM 0 HB2 LEU D 43 -4.779 -10.092 10.983 1.00 0.00 H new ATOM 0 HB3 LEU D 43 -5.318 -10.665 9.417 1.00 0.00 H new ATOM 0 HG LEU D 43 -5.775 -12.913 10.349 1.00 0.00 H new ATOM 0 HD11 LEU D 43 -5.549 -13.331 12.779 1.00 0.00 H new ATOM 0 HD12 LEU D 43 -3.972 -12.959 12.043 1.00 0.00 H new ATOM 0 HD13 LEU D 43 -4.826 -11.719 12.992 1.00 0.00 H new ATOM 0 HD21 LEU D 43 -7.630 -12.268 11.884 1.00 0.00 H new ATOM 0 HD22 LEU D 43 -6.906 -10.653 12.074 1.00 0.00 H new ATOM 0 HD23 LEU D 43 -7.542 -11.163 10.492 1.00 0.00 H new ATOM 1922 N ASP D 44 -3.724 -12.603 7.914 1.00 0.00 N ATOM 1923 CA ASP D 44 -3.822 -13.758 7.032 1.00 0.00 C ATOM 1924 C ASP D 44 -2.515 -14.541 7.036 1.00 0.00 C ATOM 1925 O ASP D 44 -2.517 -15.771 7.086 1.00 0.00 O ATOM 1926 CB ASP D 44 -4.141 -13.302 5.604 1.00 0.00 C ATOM 1927 CG ASP D 44 -5.584 -12.813 5.519 1.00 0.00 C ATOM 1928 OD1 ASP D 44 -6.341 -13.096 6.434 1.00 0.00 O ATOM 1929 OD2 ASP D 44 -5.912 -12.165 4.539 1.00 0.00 O ATOM 0 H ASP D 44 -3.850 -11.702 7.453 1.00 0.00 H new ATOM 0 HA ASP D 44 -4.623 -14.402 7.394 1.00 0.00 H new ATOM 0 HB2 ASP D 44 -3.460 -12.504 5.308 1.00 0.00 H new ATOM 0 HB3 ASP D 44 -3.987 -14.126 4.908 1.00 0.00 H new ATOM 1934 N ARG D 45 -1.400 -13.823 6.991 1.00 0.00 N ATOM 1935 CA ARG D 45 -0.091 -14.464 6.994 1.00 0.00 C ATOM 1936 C ARG D 45 0.173 -15.143 8.336 1.00 0.00 C ATOM 1937 O ARG D 45 1.012 -16.036 8.432 1.00 0.00 O ATOM 1938 CB ARG D 45 1.005 -13.423 6.718 1.00 0.00 C ATOM 1939 CG ARG D 45 2.405 -14.093 6.734 1.00 0.00 C ATOM 1940 CD ARG D 45 3.127 -13.800 8.059 1.00 0.00 C ATOM 1941 NE ARG D 45 3.454 -12.379 8.154 1.00 0.00 N ATOM 1942 CZ ARG D 45 4.557 -11.888 7.597 1.00 0.00 C ATOM 1943 NH1 ARG D 45 5.382 -12.682 6.970 1.00 0.00 N ATOM 1944 NH2 ARG D 45 4.821 -10.612 7.686 1.00 0.00 N ATOM 0 H ARG D 45 -1.375 -12.804 6.952 1.00 0.00 H new ATOM 0 HA ARG D 45 -0.078 -15.221 6.210 1.00 0.00 H new ATOM 0 HB2 ARG D 45 0.832 -12.951 5.751 1.00 0.00 H new ATOM 0 HB3 ARG D 45 0.964 -12.634 7.469 1.00 0.00 H new ATOM 0 HG2 ARG D 45 2.301 -15.170 6.600 1.00 0.00 H new ATOM 0 HG3 ARG D 45 3.001 -13.724 5.899 1.00 0.00 H new ATOM 0 HD2 ARG D 45 2.495 -14.092 8.898 1.00 0.00 H new ATOM 0 HD3 ARG D 45 4.038 -14.395 8.124 1.00 0.00 H new ATOM 0 HE ARG D 45 2.825 -11.753 8.656 1.00 0.00 H new ATOM 0 HH11 ARG D 45 5.181 -13.680 6.907 1.00 0.00 H new ATOM 0 HH12 ARG D 45 6.228 -12.304 6.543 1.00 0.00 H new ATOM 0 HH21 ARG D 45 4.181 -9.992 8.183 1.00 0.00 H new ATOM 0 HH22 ARG D 45 5.667 -10.235 7.259 1.00 0.00 H new ATOM 1958 N LEU D 46 -0.538 -14.708 9.373 1.00 0.00 N ATOM 1959 CA LEU D 46 -0.356 -15.282 10.702 1.00 0.00 C ATOM 1960 C LEU D 46 -0.722 -16.771 10.691 1.00 0.00 C ATOM 1961 O LEU D 46 0.028 -17.608 11.193 1.00 0.00 O ATOM 1962 CB LEU D 46 -1.245 -14.529 11.708 1.00 0.00 C ATOM 1963 CG LEU D 46 -0.680 -14.648 13.131 1.00 0.00 C ATOM 1964 CD1 LEU D 46 -1.555 -13.832 14.088 1.00 0.00 C ATOM 1965 CD2 LEU D 46 -0.652 -16.119 13.582 1.00 0.00 C ATOM 0 H LEU D 46 -1.238 -13.968 9.320 1.00 0.00 H new ATOM 0 HA LEU D 46 0.689 -15.184 10.996 1.00 0.00 H new ATOM 0 HB2 LEU D 46 -1.312 -13.478 11.425 1.00 0.00 H new ATOM 0 HB3 LEU D 46 -2.257 -14.932 11.679 1.00 0.00 H new ATOM 0 HG LEU D 46 0.340 -14.265 13.141 1.00 0.00 H new ATOM 0 HD11 LEU D 46 -1.159 -13.912 15.101 1.00 0.00 H new ATOM 0 HD12 LEU D 46 -1.554 -12.786 13.780 1.00 0.00 H new ATOM 0 HD13 LEU D 46 -2.575 -14.216 14.066 1.00 0.00 H new ATOM 0 HD21 LEU D 46 -0.248 -16.182 14.593 1.00 0.00 H new ATOM 0 HD22 LEU D 46 -1.664 -16.523 13.570 1.00 0.00 H new ATOM 0 HD23 LEU D 46 -0.023 -16.696 12.904 1.00 0.00 H new ATOM 1977 N PHE D 47 -1.872 -17.092 10.105 1.00 0.00 N ATOM 1978 CA PHE D 47 -2.316 -18.482 10.036 1.00 0.00 C ATOM 1979 C PHE D 47 -1.335 -19.324 9.228 1.00 0.00 C ATOM 1980 O PHE D 47 -0.948 -20.415 9.646 1.00 0.00 O ATOM 1981 CB PHE D 47 -3.704 -18.556 9.395 1.00 0.00 C ATOM 1982 CG PHE D 47 -4.735 -17.998 10.349 1.00 0.00 C ATOM 1983 CD1 PHE D 47 -5.016 -16.628 10.355 1.00 0.00 C ATOM 1984 CD2 PHE D 47 -5.408 -18.855 11.230 1.00 0.00 C ATOM 1985 CE1 PHE D 47 -5.971 -16.111 11.239 1.00 0.00 C ATOM 1986 CE2 PHE D 47 -6.364 -18.338 12.115 1.00 0.00 C ATOM 1987 CZ PHE D 47 -6.645 -16.967 12.119 1.00 0.00 C ATOM 0 H PHE D 47 -2.507 -16.419 9.676 1.00 0.00 H new ATOM 0 HA PHE D 47 -2.362 -18.877 11.051 1.00 0.00 H new ATOM 0 HB2 PHE D 47 -3.715 -17.993 8.462 1.00 0.00 H new ATOM 0 HB3 PHE D 47 -3.946 -19.589 9.146 1.00 0.00 H new ATOM 0 HD1 PHE D 47 -4.496 -15.968 9.677 1.00 0.00 H new ATOM 0 HD2 PHE D 47 -5.190 -19.913 11.227 1.00 0.00 H new ATOM 0 HE1 PHE D 47 -6.188 -15.053 11.242 1.00 0.00 H new ATOM 0 HE2 PHE D 47 -6.884 -18.998 12.794 1.00 0.00 H new ATOM 0 HZ PHE D 47 -7.382 -16.569 12.801 1.00 0.00 H new ATOM 1997 N PHE D 48 -0.935 -18.809 8.068 1.00 0.00 N ATOM 1998 CA PHE D 48 0.007 -19.514 7.196 1.00 0.00 C ATOM 1999 C PHE D 48 1.329 -18.758 7.119 1.00 0.00 C ATOM 2000 O PHE D 48 1.370 -17.602 6.697 1.00 0.00 O ATOM 2001 CB PHE D 48 -0.594 -19.641 5.793 1.00 0.00 C ATOM 2002 CG PHE D 48 -1.708 -20.660 5.817 1.00 0.00 C ATOM 2003 CD1 PHE D 48 -2.992 -20.282 6.231 1.00 0.00 C ATOM 2004 CD2 PHE D 48 -1.458 -21.983 5.434 1.00 0.00 C ATOM 2005 CE1 PHE D 48 -4.025 -21.226 6.258 1.00 0.00 C ATOM 2006 CE2 PHE D 48 -2.490 -22.928 5.461 1.00 0.00 C ATOM 2007 CZ PHE D 48 -3.774 -22.550 5.874 1.00 0.00 C ATOM 0 H PHE D 48 -1.247 -17.907 7.708 1.00 0.00 H new ATOM 0 HA PHE D 48 0.194 -20.506 7.608 1.00 0.00 H new ATOM 0 HB2 PHE D 48 -0.976 -18.676 5.460 1.00 0.00 H new ATOM 0 HB3 PHE D 48 0.175 -19.943 5.082 1.00 0.00 H new ATOM 0 HD1 PHE D 48 -3.185 -19.262 6.529 1.00 0.00 H new ATOM 0 HD2 PHE D 48 -0.468 -22.275 5.117 1.00 0.00 H new ATOM 0 HE1 PHE D 48 -5.015 -20.934 6.575 1.00 0.00 H new ATOM 0 HE2 PHE D 48 -2.296 -23.948 5.164 1.00 0.00 H new ATOM 0 HZ PHE D 48 -4.571 -23.279 5.896 1.00 0.00 H new ATOM 2017 N LYS D 49 2.410 -19.419 7.528 1.00 0.00 N ATOM 2018 CA LYS D 49 3.736 -18.802 7.505 1.00 0.00 C ATOM 2019 C LYS D 49 4.447 -19.112 6.190 1.00 0.00 C ATOM 2020 O LYS D 49 3.766 -19.463 5.240 1.00 0.00 O ATOM 2021 CB LYS D 49 4.573 -19.324 8.672 1.00 0.00 C ATOM 2022 CG LYS D 49 3.971 -18.829 9.990 1.00 0.00 C ATOM 2023 CD LYS D 49 4.793 -19.371 11.162 1.00 0.00 C ATOM 2024 CE LYS D 49 4.149 -18.937 12.480 1.00 0.00 C ATOM 2025 NZ LYS D 49 4.248 -17.456 12.619 1.00 0.00 N ATOM 2026 OXT LYS D 49 5.658 -18.992 6.154 1.00 0.00 O ATOM 0 H LYS D 49 2.395 -20.377 7.878 1.00 0.00 H new ATOM 0 HA LYS D 49 3.617 -17.722 7.596 1.00 0.00 H new ATOM 0 HB2 LYS D 49 4.598 -20.414 8.657 1.00 0.00 H new ATOM 0 HB3 LYS D 49 5.603 -18.980 8.578 1.00 0.00 H new ATOM 0 HG2 LYS D 49 3.962 -17.739 10.011 1.00 0.00 H new ATOM 0 HG3 LYS D 49 2.935 -19.158 10.075 1.00 0.00 H new ATOM 0 HD2 LYS D 49 4.845 -20.459 11.111 1.00 0.00 H new ATOM 0 HD3 LYS D 49 5.816 -19.000 11.105 1.00 0.00 H new ATOM 0 HE2 LYS D 49 3.104 -19.246 12.505 1.00 0.00 H new ATOM 0 HE3 LYS D 49 4.646 -19.425 13.318 1.00 0.00 H new ATOM 0 HZ1 LYS D 49 4.066 -17.187 13.607 1.00 0.00 H new ATOM 0 HZ2 LYS D 49 5.202 -17.145 12.346 1.00 0.00 H new ATOM 0 HZ3 LYS D 49 3.545 -17.002 12.001 1.00 0.00 H new TER 2040 LYS D 49 HETATM 2041 O A2Y A 100 0.143 11.566 2.924 1.00 0.00 O HETATM 2042 S A2Y A 100 0.134 14.435 3.003 1.00 0.00 S HETATM 2043 C1 A2Y A 100 0.094 15.744 2.352 1.00 0.00 C HETATM 2044 N1 A2Y A 100 0.325 10.277 2.682 1.00 0.00 N HETATM 2045 C2 A2Y A 100 0.205 15.661 1.026 1.00 0.00 C HETATM 2046 N2 A2Y A 100 -0.139 7.860 1.141 1.00 0.00 N HETATM 2047 C3 A2Y A 100 0.321 14.374 0.691 1.00 0.00 C HETATM 2048 C4 A2Y A 100 0.739 11.313 0.914 1.00 0.00 C HETATM 2049 C5 A2Y A 100 0.981 8.772 0.878 1.00 0.00 C HETATM 2050 C9 A2Y A 100 0.683 10.108 1.485 1.00 0.00 C HETATM 2051 C10 A2Y A 100 -0.001 6.432 0.750 1.00 0.00 C HETATM 2052 C11 A2Y A 100 0.381 12.204 1.887 1.00 0.00 C HETATM 2053 C12 A2Y A 100 0.290 13.587 1.806 1.00 0.00 C HETATM 2054 C61 A2Y A 100 -1.288 5.634 1.108 1.00 0.00 C HETATM 2055 C62 A2Y A 100 1.189 5.734 1.481 1.00 0.00 C HETATM 2056 C63 A2Y A 100 0.227 6.258 -0.783 1.00 0.00 C HETATM 2057 C71 A2Y A 100 -1.162 4.146 0.713 1.00 0.00 C HETATM 2058 C72 A2Y A 100 1.302 4.249 1.078 1.00 0.00 C HETATM 2059 C73 A2Y A 100 0.350 4.769 -1.171 1.00 0.00 C HETATM 2060 C81 A2Y A 100 0.017 3.503 1.453 1.00 0.00 C HETATM 2061 C82 A2Y A 100 1.536 4.133 -0.434 1.00 0.00 C HETATM 2062 C83 A2Y A 100 -0.935 4.021 -0.799 1.00 0.00 C HETATM 0 H683 A2Y A 100 -0.856 2.972 -1.083 1.00 0.00 H new HETATM 0 H663 A2Y A 100 -0.601 6.710 -1.329 1.00 0.00 H new HETATM 0 H583 A2Y A 100 -1.784 4.436 -1.343 1.00 0.00 H new HETATM 0 H563 A2Y A 100 1.132 6.788 -1.080 1.00 0.00 H new HETATM 0 H482 A2Y A 100 2.464 4.633 -0.711 1.00 0.00 H new HETATM 0 H462 A2Y A 100 2.119 6.250 1.241 1.00 0.00 H new HETATM 0 H382 A2Y A 100 1.640 3.086 -0.720 1.00 0.00 H new HETATM 0 H373 A2Y A 100 0.510 4.700 -2.247 1.00 0.00 H new HETATM 0 H362 A2Y A 100 1.051 5.811 2.560 1.00 0.00 H new HETATM 0 H2N2 A2Y A 100 -0.334 7.890 2.142 1.00 0.00 H new HETATM 0 H281 A2Y A 100 -0.144 3.547 2.530 1.00 0.00 H new HETATM 0 H272 A2Y A 100 2.144 3.805 1.610 1.00 0.00 H new HETATM 0 H261 A2Y A 100 -1.479 5.712 2.178 1.00 0.00 H new HETATM 0 H1N2 A2Y A 100 -0.961 8.233 0.666 1.00 0.00 H new HETATM 0 H181 A2Y A 100 0.101 2.449 1.186 1.00 0.00 H new HETATM 0 H171 A2Y A 100 -2.085 3.635 0.986 1.00 0.00 H new HETATM 0 H161 A2Y A 100 -2.144 6.075 0.598 1.00 0.00 H new HETATM 0 H44 A2Y A 100 1.014 11.540 -0.116 1.00 0.00 H new HETATM 0 H3 A2Y A 100 0.426 14.004 -0.329 1.00 0.00 H new HETATM 0 H25 A2Y A 100 1.902 8.366 1.297 1.00 0.00 H new HETATM 0 H2 A2Y A 100 0.202 16.502 0.333 1.00 0.00 H new HETATM 0 H15 A2Y A 100 1.138 8.874 -0.196 1.00 0.00 H new HETATM 0 H1 A2Y A 100 -0.015 16.685 2.892 1.00 0.00 H new