USER MOD reduce.3.24.130724 H: found=0, std=0, add=1036, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 1065 hydrogens (21 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 19 SER OG : rot 40:sc= 0.0335 USER MOD Single : A 20 ASN :FLIP amide:sc= -0.0233 F(o=-1.2,f=-0.023) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 35:sc= 0.844 USER MOD Single : A 31 ASN : amide:sc= -2.35! C(o=-2.3!,f=-4.8!) USER MOD Single : A 37 HIS : no HD1:sc= -9! C(o=-9!,f=-11!) USER MOD Single : A 49 LYS NZ :NH3+ -165:sc= -0.0137 (180deg=-0.327) USER MOD Single : B 19 SER OG : rot 28:sc= 0.0408 USER MOD Single : B 20 ASN :FLIP amide:sc= -0.0445 F(o=-1,f=-0.045) USER MOD Single : B 22 SER OG : rot 180:sc= 0 USER MOD Single : B 23 SER OG : rot 31:sc= 0.986 USER MOD Single : B 31 ASN : amide:sc= -2.02! C(o=-2!,f=-4.6!) USER MOD Single : B 37 HIS : no HD1:sc= -9.79! C(o=-9.8!,f=-11!) USER MOD Single : B 49 LYS NZ :NH3+ -163:sc= -0.0308 (180deg=-0.302) USER MOD Single : C 19 SER OG : rot 30:sc= 0.0428 USER MOD Single : C 20 ASN :FLIP amide:sc= -0.0465 F(o=-1,f=-0.046) USER MOD Single : C 22 SER OG : rot 180:sc= 0 USER MOD Single : C 23 SER OG : rot 26:sc= 0.839 USER MOD Single : C 31 ASN : amide:sc= -2.33! C(o=-2.3!,f=-5!) USER MOD Single : C 37 HIS : no HD1:sc= -9.34! C(o=-9.3!,f=-11!) USER MOD Single : C 49 LYS NZ :NH3+ -163:sc=-0.00289 (180deg=-0.332) USER MOD Single : D 19 SER OG : rot 26:sc= 0.0333 USER MOD Single : D 20 ASN :FLIP amide:sc= -0.0509 F(o=-1.1!,f=-0.051) USER MOD Single : D 22 SER OG : rot 180:sc= 0 USER MOD Single : D 23 SER OG : rot 38:sc= 0.882 USER MOD Single : D 31 ASN : amide:sc= -2! C(o=-2!,f=-4.8!) USER MOD Single : D 37 HIS : no HD1:sc= -9.49! C(o=-9.5!,f=-11!) USER MOD Single : D 49 LYS NZ :NH3+ -164:sc= -0.0323 (180deg=-0.306) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 19 -6.915 25.878 2.002 1.00 0.00 N ATOM 2 CA SER A 19 -7.678 24.753 2.612 1.00 0.00 C ATOM 3 C SER A 19 -7.611 23.537 1.694 1.00 0.00 C ATOM 4 O SER A 19 -6.720 22.697 1.822 1.00 0.00 O ATOM 5 CB SER A 19 -9.135 25.175 2.809 1.00 0.00 C ATOM 6 OG SER A 19 -9.193 26.230 3.762 1.00 0.00 O ATOM 0 HA SER A 19 -7.244 24.497 3.578 1.00 0.00 H new ATOM 0 HB2 SER A 19 -9.563 25.502 1.861 1.00 0.00 H new ATOM 0 HB3 SER A 19 -9.728 24.327 3.151 1.00 0.00 H new ATOM 0 HG SER A 19 -8.447 26.848 3.612 1.00 0.00 H new ATOM 14 N ASN A 20 -8.561 23.450 0.769 1.00 0.00 N ATOM 15 CA ASN A 20 -8.604 22.333 -0.167 1.00 0.00 C ATOM 16 C ASN A 20 -7.362 22.331 -1.054 1.00 0.00 C ATOM 17 O ASN A 20 -6.796 21.278 -1.346 1.00 0.00 O ATOM 18 CB ASN A 20 -9.857 22.434 -1.039 1.00 0.00 C ATOM 19 CG ASN A 20 -11.106 22.167 -0.203 1.00 0.00 C ATOM 20 OD1 ASN A 20 -11.056 21.307 0.778 1.00 0.00 O flip ATOM 21 ND2 ASN A 20 -12.157 22.756 -0.453 1.00 0.00 N flip ATOM 0 H ASN A 20 -9.307 24.135 0.648 1.00 0.00 H new ATOM 0 HA ASN A 20 -8.631 21.404 0.402 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -9.917 23.425 -1.488 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -9.798 21.716 -1.857 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -12.195 23.428 -1.220 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -12.990 22.573 0.106 1.00 0.00 H new ATOM 28 N ASP A 21 -6.945 23.520 -1.481 1.00 0.00 N ATOM 29 CA ASP A 21 -5.770 23.644 -2.336 1.00 0.00 C ATOM 30 C ASP A 21 -4.525 23.149 -1.604 1.00 0.00 C ATOM 31 O ASP A 21 -3.671 22.483 -2.191 1.00 0.00 O ATOM 32 CB ASP A 21 -5.574 25.106 -2.746 1.00 0.00 C ATOM 33 CG ASP A 21 -4.368 25.231 -3.670 1.00 0.00 C ATOM 34 OD1 ASP A 21 -3.677 24.241 -3.847 1.00 0.00 O ATOM 35 OD2 ASP A 21 -4.150 26.316 -4.183 1.00 0.00 O ATOM 0 H ASP A 21 -7.399 24.404 -1.251 1.00 0.00 H new ATOM 0 HA ASP A 21 -5.924 23.035 -3.227 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -6.468 25.474 -3.249 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -5.430 25.725 -1.860 1.00 0.00 H new ATOM 40 N SER A 22 -4.431 23.478 -0.320 1.00 0.00 N ATOM 41 CA SER A 22 -3.289 23.062 0.485 1.00 0.00 C ATOM 42 C SER A 22 -3.203 21.541 0.551 1.00 0.00 C ATOM 43 O SER A 22 -2.120 20.965 0.444 1.00 0.00 O ATOM 44 CB SER A 22 -3.410 23.631 1.899 1.00 0.00 C ATOM 45 OG SER A 22 -2.271 23.250 2.659 1.00 0.00 O ATOM 0 H SER A 22 -5.127 24.028 0.183 1.00 0.00 H new ATOM 0 HA SER A 22 -2.382 23.445 0.017 1.00 0.00 H new ATOM 0 HB2 SER A 22 -3.489 24.717 1.860 1.00 0.00 H new ATOM 0 HB3 SER A 22 -4.319 23.262 2.375 1.00 0.00 H new ATOM 0 HG SER A 22 -2.346 23.615 3.565 1.00 0.00 H new ATOM 51 N SER A 23 -4.356 20.893 0.726 1.00 0.00 N ATOM 52 CA SER A 23 -4.414 19.435 0.805 1.00 0.00 C ATOM 53 C SER A 23 -5.604 18.913 0.007 1.00 0.00 C ATOM 54 O SER A 23 -6.757 19.198 0.333 1.00 0.00 O ATOM 55 CB SER A 23 -4.548 18.999 2.263 1.00 0.00 C ATOM 56 OG SER A 23 -5.750 19.534 2.802 1.00 0.00 O ATOM 0 H SER A 23 -5.261 21.356 0.815 1.00 0.00 H new ATOM 0 HA SER A 23 -3.495 19.024 0.387 1.00 0.00 H new ATOM 0 HB2 SER A 23 -4.558 17.911 2.330 1.00 0.00 H new ATOM 0 HB3 SER A 23 -3.691 19.346 2.839 1.00 0.00 H new ATOM 0 HG SER A 23 -6.440 19.555 2.106 1.00 0.00 H new ATOM 62 N ASP A 24 -5.314 18.152 -1.041 1.00 0.00 N ATOM 63 CA ASP A 24 -6.364 17.596 -1.890 1.00 0.00 C ATOM 64 C ASP A 24 -7.017 16.385 -1.207 1.00 0.00 C ATOM 65 O ASP A 24 -6.389 15.718 -0.387 1.00 0.00 O ATOM 66 CB ASP A 24 -5.771 17.185 -3.252 1.00 0.00 C ATOM 67 CG ASP A 24 -4.313 16.768 -3.083 1.00 0.00 C ATOM 68 OD1 ASP A 24 -3.513 17.616 -2.724 1.00 0.00 O ATOM 69 OD2 ASP A 24 -4.018 15.608 -3.317 1.00 0.00 O ATOM 0 H ASP A 24 -4.365 17.906 -1.324 1.00 0.00 H new ATOM 0 HA ASP A 24 -7.129 18.356 -2.050 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -6.347 16.361 -3.675 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -5.841 18.016 -3.954 1.00 0.00 H new ATOM 74 N PRO A 25 -8.258 16.093 -1.528 1.00 0.00 N ATOM 75 CA PRO A 25 -8.996 14.936 -0.929 1.00 0.00 C ATOM 76 C PRO A 25 -8.388 13.594 -1.344 1.00 0.00 C ATOM 77 O PRO A 25 -8.643 12.566 -0.717 1.00 0.00 O ATOM 78 CB PRO A 25 -10.430 15.095 -1.468 1.00 0.00 C ATOM 79 CG PRO A 25 -10.284 15.891 -2.726 1.00 0.00 C ATOM 80 CD PRO A 25 -9.097 16.827 -2.495 1.00 0.00 C ATOM 0 HA PRO A 25 -8.952 14.937 0.160 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -10.887 14.125 -1.665 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -11.068 15.608 -0.748 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -10.107 15.240 -3.582 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -11.192 16.456 -2.938 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -8.559 17.028 -3.421 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -9.417 17.790 -2.098 1.00 0.00 H new ATOM 88 N LEU A 26 -7.589 13.613 -2.405 1.00 0.00 N ATOM 89 CA LEU A 26 -6.960 12.393 -2.897 1.00 0.00 C ATOM 90 C LEU A 26 -6.031 11.804 -1.838 1.00 0.00 C ATOM 91 O LEU A 26 -6.011 10.591 -1.627 1.00 0.00 O ATOM 92 CB LEU A 26 -6.157 12.697 -4.166 1.00 0.00 C ATOM 93 CG LEU A 26 -7.108 13.032 -5.328 1.00 0.00 C ATOM 94 CD1 LEU A 26 -6.294 13.632 -6.481 1.00 0.00 C ATOM 95 CD2 LEU A 26 -7.841 11.765 -5.819 1.00 0.00 C ATOM 0 H LEU A 26 -7.363 14.453 -2.938 1.00 0.00 H new ATOM 0 HA LEU A 26 -7.742 11.668 -3.123 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -5.482 13.533 -3.986 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -5.539 11.839 -4.428 1.00 0.00 H new ATOM 0 HG LEU A 26 -7.853 13.747 -4.980 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -6.960 13.873 -7.310 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -5.795 14.540 -6.141 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -5.547 12.911 -6.813 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -8.508 12.026 -6.641 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -7.111 11.032 -6.163 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -8.423 11.341 -5.000 1.00 0.00 H new ATOM 107 N VAL A 27 -5.265 12.667 -1.178 1.00 0.00 N ATOM 108 CA VAL A 27 -4.341 12.213 -0.144 1.00 0.00 C ATOM 109 C VAL A 27 -5.109 11.604 1.027 1.00 0.00 C ATOM 110 O VAL A 27 -4.748 10.544 1.534 1.00 0.00 O ATOM 111 CB VAL A 27 -3.493 13.388 0.354 1.00 0.00 C ATOM 112 CG1 VAL A 27 -2.610 12.930 1.519 1.00 0.00 C ATOM 113 CG2 VAL A 27 -2.611 13.896 -0.789 1.00 0.00 C ATOM 0 H VAL A 27 -5.265 13.674 -1.338 1.00 0.00 H new ATOM 0 HA VAL A 27 -3.689 11.453 -0.573 1.00 0.00 H new ATOM 0 HB VAL A 27 -4.148 14.190 0.694 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -2.008 13.768 1.871 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -3.239 12.569 2.332 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -1.953 12.127 1.184 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -2.006 14.732 -0.438 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -1.957 13.093 -1.129 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -3.241 14.225 -1.616 1.00 0.00 H new ATOM 123 N VAL A 28 -6.170 12.287 1.445 1.00 0.00 N ATOM 124 CA VAL A 28 -6.986 11.810 2.556 1.00 0.00 C ATOM 125 C VAL A 28 -7.652 10.484 2.201 1.00 0.00 C ATOM 126 O VAL A 28 -7.671 9.553 3.006 1.00 0.00 O ATOM 127 CB VAL A 28 -8.058 12.847 2.901 1.00 0.00 C ATOM 128 CG1 VAL A 28 -8.972 12.297 3.997 1.00 0.00 C ATOM 129 CG2 VAL A 28 -7.384 14.129 3.396 1.00 0.00 C ATOM 0 H VAL A 28 -6.483 13.167 1.035 1.00 0.00 H new ATOM 0 HA VAL A 28 -6.338 11.658 3.419 1.00 0.00 H new ATOM 0 HB VAL A 28 -8.650 13.065 2.012 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -9.734 13.037 4.241 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -9.452 11.384 3.646 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -8.382 12.078 4.887 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -8.146 14.869 3.642 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -6.791 13.909 4.284 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -6.734 14.523 2.615 1.00 0.00 H new ATOM 139 N ALA A 29 -8.200 10.407 0.992 1.00 0.00 N ATOM 140 CA ALA A 29 -8.867 9.189 0.544 1.00 0.00 C ATOM 141 C ALA A 29 -7.884 8.026 0.497 1.00 0.00 C ATOM 142 O ALA A 29 -8.217 6.905 0.884 1.00 0.00 O ATOM 143 CB ALA A 29 -9.470 9.402 -0.844 1.00 0.00 C ATOM 0 H ALA A 29 -8.196 11.166 0.310 1.00 0.00 H new ATOM 0 HA ALA A 29 -9.661 8.953 1.253 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -9.966 8.487 -1.170 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -10.196 10.214 -0.805 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -8.679 9.657 -1.549 1.00 0.00 H new ATOM 149 N ALA A 30 -6.672 8.294 0.025 1.00 0.00 N ATOM 150 CA ALA A 30 -5.656 7.253 -0.061 1.00 0.00 C ATOM 151 C ALA A 30 -5.301 6.740 1.329 1.00 0.00 C ATOM 152 O ALA A 30 -5.132 5.539 1.534 1.00 0.00 O ATOM 153 CB ALA A 30 -4.398 7.798 -0.742 1.00 0.00 C ATOM 0 H ALA A 30 -6.371 9.213 -0.301 1.00 0.00 H new ATOM 0 HA ALA A 30 -6.057 6.430 -0.652 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -3.646 7.011 -0.800 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -4.647 8.138 -1.747 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -4.004 8.634 -0.164 1.00 0.00 H new ATOM 159 N ASN A 31 -5.189 7.661 2.282 1.00 0.00 N ATOM 160 CA ASN A 31 -4.854 7.285 3.650 1.00 0.00 C ATOM 161 C ASN A 31 -5.961 6.431 4.268 1.00 0.00 C ATOM 162 O ASN A 31 -5.688 5.416 4.901 1.00 0.00 O ATOM 163 CB ASN A 31 -4.647 8.541 4.498 1.00 0.00 C ATOM 164 CG ASN A 31 -4.328 8.154 5.938 1.00 0.00 C ATOM 165 OD1 ASN A 31 -4.342 6.970 6.279 1.00 0.00 O ATOM 166 ND2 ASN A 31 -4.042 9.084 6.807 1.00 0.00 N ATOM 0 H ASN A 31 -5.324 8.661 2.134 1.00 0.00 H new ATOM 0 HA ASN A 31 -3.934 6.700 3.627 1.00 0.00 H new ATOM 0 HB2 ASN A 31 -3.834 9.138 4.085 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -5.544 9.160 4.470 1.00 0.00 H new ATOM 0 HD21 ASN A 31 -3.829 8.832 7.772 1.00 0.00 H new ATOM 0 HD22 ASN A 31 -4.031 10.063 6.521 1.00 0.00 H new ATOM 173 N ILE A 32 -7.208 6.849 4.079 1.00 0.00 N ATOM 174 CA ILE A 32 -8.338 6.107 4.631 1.00 0.00 C ATOM 175 C ILE A 32 -8.440 4.727 3.987 1.00 0.00 C ATOM 176 O ILE A 32 -8.638 3.723 4.673 1.00 0.00 O ATOM 177 CB ILE A 32 -9.633 6.891 4.396 1.00 0.00 C ATOM 178 CG1 ILE A 32 -9.601 8.177 5.228 1.00 0.00 C ATOM 179 CG2 ILE A 32 -10.835 6.043 4.824 1.00 0.00 C ATOM 180 CD1 ILE A 32 -10.735 9.103 4.784 1.00 0.00 C ATOM 0 H ILE A 32 -7.461 7.687 3.555 1.00 0.00 H new ATOM 0 HA ILE A 32 -8.183 5.977 5.702 1.00 0.00 H new ATOM 0 HB ILE A 32 -9.722 7.136 3.338 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -9.705 7.940 6.287 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -8.640 8.677 5.106 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -11.754 6.604 4.655 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -10.858 5.124 4.239 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -10.749 5.797 5.882 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -10.711 10.017 5.377 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -10.611 9.350 3.730 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -11.692 8.602 4.929 1.00 0.00 H new ATOM 192 N ILE A 33 -8.295 4.685 2.667 1.00 0.00 N ATOM 193 CA ILE A 33 -8.364 3.426 1.934 1.00 0.00 C ATOM 194 C ILE A 33 -7.213 2.504 2.328 1.00 0.00 C ATOM 195 O ILE A 33 -7.409 1.306 2.535 1.00 0.00 O ATOM 196 CB ILE A 33 -8.325 3.710 0.428 1.00 0.00 C ATOM 197 CG1 ILE A 33 -9.631 4.396 0.011 1.00 0.00 C ATOM 198 CG2 ILE A 33 -8.159 2.400 -0.350 1.00 0.00 C ATOM 199 CD1 ILE A 33 -9.496 4.929 -1.416 1.00 0.00 C ATOM 0 H ILE A 33 -8.129 5.506 2.084 1.00 0.00 H new ATOM 0 HA ILE A 33 -9.298 2.924 2.185 1.00 0.00 H new ATOM 0 HB ILE A 33 -7.480 4.361 0.205 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -10.459 3.690 0.070 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -9.859 5.213 0.695 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -8.132 2.612 -1.419 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -7.229 1.916 -0.053 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -8.998 1.739 -0.132 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -10.425 5.417 -1.712 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -8.679 5.649 -1.460 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -9.288 4.102 -2.095 1.00 0.00 H new ATOM 211 N GLY A 34 -6.013 3.066 2.432 1.00 0.00 N ATOM 212 CA GLY A 34 -4.842 2.277 2.801 1.00 0.00 C ATOM 213 C GLY A 34 -4.988 1.697 4.204 1.00 0.00 C ATOM 214 O GLY A 34 -4.659 0.535 4.447 1.00 0.00 O ATOM 0 H GLY A 34 -5.826 4.055 2.268 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -4.704 1.469 2.083 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -3.950 2.901 2.754 1.00 0.00 H new ATOM 218 N ILE A 35 -5.487 2.513 5.126 1.00 0.00 N ATOM 219 CA ILE A 35 -5.674 2.063 6.500 1.00 0.00 C ATOM 220 C ILE A 35 -6.701 0.932 6.544 1.00 0.00 C ATOM 221 O ILE A 35 -6.502 -0.075 7.228 1.00 0.00 O ATOM 222 CB ILE A 35 -6.154 3.239 7.368 1.00 0.00 C ATOM 223 CG1 ILE A 35 -5.030 4.298 7.502 1.00 0.00 C ATOM 224 CG2 ILE A 35 -6.577 2.728 8.753 1.00 0.00 C ATOM 225 CD1 ILE A 35 -4.056 3.951 8.636 1.00 0.00 C ATOM 0 H ILE A 35 -5.766 3.478 4.950 1.00 0.00 H new ATOM 0 HA ILE A 35 -4.725 1.693 6.888 1.00 0.00 H new ATOM 0 HB ILE A 35 -7.014 3.707 6.889 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -4.483 4.369 6.562 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -5.472 5.277 7.689 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -6.916 3.566 9.362 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -7.388 2.008 8.643 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -5.728 2.247 9.238 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -3.283 4.717 8.698 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -4.598 3.905 9.580 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -3.594 2.984 8.436 1.00 0.00 H new ATOM 237 N LEU A 36 -7.795 1.101 5.802 1.00 0.00 N ATOM 238 CA LEU A 36 -8.846 0.087 5.760 1.00 0.00 C ATOM 239 C LEU A 36 -8.288 -1.216 5.214 1.00 0.00 C ATOM 240 O LEU A 36 -8.653 -2.301 5.670 1.00 0.00 O ATOM 241 CB LEU A 36 -10.013 0.561 4.883 1.00 0.00 C ATOM 242 CG LEU A 36 -11.131 -0.497 4.856 1.00 0.00 C ATOM 243 CD1 LEU A 36 -11.659 -0.761 6.277 1.00 0.00 C ATOM 244 CD2 LEU A 36 -12.274 0.012 3.971 1.00 0.00 C ATOM 0 H LEU A 36 -7.975 1.924 5.227 1.00 0.00 H new ATOM 0 HA LEU A 36 -9.213 -0.076 6.773 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -10.405 1.503 5.267 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -9.660 0.752 3.870 1.00 0.00 H new ATOM 0 HG LEU A 36 -10.732 -1.429 4.456 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -12.449 -1.511 6.238 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -10.846 -1.122 6.906 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -12.057 0.164 6.695 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -13.072 -0.730 3.945 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -12.661 0.946 4.378 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -11.903 0.182 2.960 1.00 0.00 H new ATOM 256 N HIS A 37 -7.395 -1.106 4.238 1.00 0.00 N ATOM 257 CA HIS A 37 -6.796 -2.291 3.647 1.00 0.00 C ATOM 258 C HIS A 37 -6.116 -3.115 4.729 1.00 0.00 C ATOM 259 O HIS A 37 -6.224 -4.341 4.745 1.00 0.00 O ATOM 260 CB HIS A 37 -5.763 -1.896 2.595 1.00 0.00 C ATOM 261 CG HIS A 37 -5.175 -3.144 2.000 1.00 0.00 C ATOM 262 ND1 HIS A 37 -5.322 -3.468 0.664 1.00 0.00 N ATOM 263 CD2 HIS A 37 -4.452 -4.171 2.554 1.00 0.00 C ATOM 264 CE1 HIS A 37 -4.705 -4.645 0.462 1.00 0.00 C ATOM 265 NE2 HIS A 37 -4.156 -5.115 1.581 1.00 0.00 N ATOM 0 H HIS A 37 -7.075 -0.221 3.845 1.00 0.00 H new ATOM 0 HA HIS A 37 -7.582 -2.879 3.173 1.00 0.00 H new ATOM 0 HB2 HIS A 37 -6.229 -1.291 1.817 1.00 0.00 H new ATOM 0 HB3 HIS A 37 -4.979 -1.287 3.046 1.00 0.00 H new ATOM 0 HD2 HIS A 37 -4.158 -4.235 3.591 1.00 0.00 H new ATOM 0 HE1 HIS A 37 -4.660 -5.149 -0.492 1.00 0.00 H new ATOM 0 HE2 HIS A 37 -3.631 -5.982 1.697 1.00 0.00 H new ATOM 273 N LEU A 38 -5.411 -2.439 5.633 1.00 0.00 N ATOM 274 CA LEU A 38 -4.719 -3.137 6.715 1.00 0.00 C ATOM 275 C LEU A 38 -5.705 -3.878 7.609 1.00 0.00 C ATOM 276 O LEU A 38 -5.416 -4.977 8.076 1.00 0.00 O ATOM 277 CB LEU A 38 -3.872 -2.151 7.555 1.00 0.00 C ATOM 278 CG LEU A 38 -2.446 -2.029 6.976 1.00 0.00 C ATOM 279 CD1 LEU A 38 -1.760 -0.780 7.544 1.00 0.00 C ATOM 280 CD2 LEU A 38 -1.613 -3.274 7.347 1.00 0.00 C ATOM 0 H LEU A 38 -5.304 -1.425 5.640 1.00 0.00 H new ATOM 0 HA LEU A 38 -4.051 -3.869 6.261 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -4.350 -1.172 7.567 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -3.823 -2.495 8.588 1.00 0.00 H new ATOM 0 HG LEU A 38 -2.516 -1.950 5.891 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -0.754 -0.698 7.132 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -2.335 0.106 7.274 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -1.702 -0.858 8.630 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -0.609 -3.177 6.933 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -1.552 -3.361 8.432 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -2.089 -4.165 6.938 1.00 0.00 H new ATOM 292 N ILE A 39 -6.856 -3.283 7.862 1.00 0.00 N ATOM 293 CA ILE A 39 -7.834 -3.932 8.721 1.00 0.00 C ATOM 294 C ILE A 39 -8.206 -5.308 8.165 1.00 0.00 C ATOM 295 O ILE A 39 -8.165 -6.304 8.887 1.00 0.00 O ATOM 296 CB ILE A 39 -9.091 -3.061 8.814 1.00 0.00 C ATOM 297 CG1 ILE A 39 -8.709 -1.641 9.265 1.00 0.00 C ATOM 298 CG2 ILE A 39 -10.081 -3.675 9.805 1.00 0.00 C ATOM 299 CD1 ILE A 39 -7.922 -1.678 10.582 1.00 0.00 C ATOM 0 H ILE A 39 -7.135 -2.373 7.496 1.00 0.00 H new ATOM 0 HA ILE A 39 -7.400 -4.060 9.713 1.00 0.00 H new ATOM 0 HB ILE A 39 -9.561 -3.009 7.832 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -8.110 -1.158 8.492 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -9.610 -1.041 9.392 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -10.971 -3.049 9.865 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -10.361 -4.673 9.468 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -9.617 -3.741 10.789 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -7.663 -0.662 10.880 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -8.533 -2.139 11.358 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -7.010 -2.259 10.445 1.00 0.00 H new ATOM 311 N LEU A 40 -8.563 -5.361 6.885 1.00 0.00 N ATOM 312 CA LEU A 40 -8.935 -6.631 6.258 1.00 0.00 C ATOM 313 C LEU A 40 -7.724 -7.560 6.103 1.00 0.00 C ATOM 314 O LEU A 40 -7.816 -8.760 6.361 1.00 0.00 O ATOM 315 CB LEU A 40 -9.571 -6.366 4.885 1.00 0.00 C ATOM 316 CG LEU A 40 -11.032 -5.943 5.068 1.00 0.00 C ATOM 317 CD1 LEU A 40 -11.095 -4.684 5.937 1.00 0.00 C ATOM 318 CD2 LEU A 40 -11.654 -5.651 3.701 1.00 0.00 C ATOM 0 H LEU A 40 -8.603 -4.552 6.266 1.00 0.00 H new ATOM 0 HA LEU A 40 -9.656 -7.128 6.907 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -9.019 -5.585 4.362 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -9.516 -7.263 4.268 1.00 0.00 H new ATOM 0 HG LEU A 40 -11.584 -6.747 5.554 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -12.135 -4.383 6.067 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -10.653 -4.892 6.911 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -10.542 -3.879 5.452 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -12.694 -5.350 3.831 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -11.102 -4.847 3.214 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -11.611 -6.547 3.082 1.00 0.00 H new ATOM 330 N TRP A 41 -6.595 -7.003 5.670 1.00 0.00 N ATOM 331 CA TRP A 41 -5.381 -7.799 5.471 1.00 0.00 C ATOM 332 C TRP A 41 -4.883 -8.372 6.798 1.00 0.00 C ATOM 333 O TRP A 41 -4.444 -9.524 6.862 1.00 0.00 O ATOM 334 CB TRP A 41 -4.303 -6.943 4.796 1.00 0.00 C ATOM 335 CG TRP A 41 -3.041 -7.731 4.625 1.00 0.00 C ATOM 336 CD1 TRP A 41 -2.777 -8.583 3.604 1.00 0.00 C ATOM 337 CD2 TRP A 41 -1.837 -7.695 5.443 1.00 0.00 C ATOM 338 NE1 TRP A 41 -1.506 -9.102 3.774 1.00 0.00 N ATOM 339 CE2 TRP A 41 -0.885 -8.576 4.887 1.00 0.00 C ATOM 340 CE3 TRP A 41 -1.491 -6.994 6.609 1.00 0.00 C ATOM 341 CZ2 TRP A 41 0.368 -8.754 5.468 1.00 0.00 C ATOM 342 CZ3 TRP A 41 -0.228 -7.166 7.191 1.00 0.00 C ATOM 343 CH2 TRP A 41 0.697 -8.043 6.620 1.00 0.00 C ATOM 0 H TRP A 41 -6.493 -6.012 5.451 1.00 0.00 H new ATOM 0 HA TRP A 41 -5.613 -8.641 4.818 1.00 0.00 H new ATOM 0 HB2 TRP A 41 -4.659 -6.599 3.825 1.00 0.00 H new ATOM 0 HB3 TRP A 41 -4.106 -6.055 5.397 1.00 0.00 H new ATOM 0 HD1 TRP A 41 -3.449 -8.818 2.791 1.00 0.00 H new ATOM 0 HE1 TRP A 41 -1.080 -9.790 3.152 1.00 0.00 H new ATOM 0 HE3 TRP A 41 -2.202 -6.318 7.060 1.00 0.00 H new ATOM 0 HZ2 TRP A 41 1.079 -9.438 5.029 1.00 0.00 H new ATOM 0 HZ3 TRP A 41 0.031 -6.618 8.085 1.00 0.00 H new ATOM 0 HH2 TRP A 41 1.669 -8.170 7.072 1.00 0.00 H new ATOM 354 N ILE A 42 -4.973 -7.575 7.856 1.00 0.00 N ATOM 355 CA ILE A 42 -4.544 -8.022 9.177 1.00 0.00 C ATOM 356 C ILE A 42 -5.388 -9.220 9.612 1.00 0.00 C ATOM 357 O ILE A 42 -4.862 -10.214 10.112 1.00 0.00 O ATOM 358 CB ILE A 42 -4.694 -6.865 10.184 1.00 0.00 C ATOM 359 CG1 ILE A 42 -3.533 -5.879 10.007 1.00 0.00 C ATOM 360 CG2 ILE A 42 -4.689 -7.400 11.624 1.00 0.00 C ATOM 361 CD1 ILE A 42 -3.865 -4.568 10.720 1.00 0.00 C ATOM 0 H ILE A 42 -5.336 -6.622 7.827 1.00 0.00 H new ATOM 0 HA ILE A 42 -3.498 -8.325 9.141 1.00 0.00 H new ATOM 0 HB ILE A 42 -5.642 -6.361 9.998 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -2.615 -6.304 10.414 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -3.357 -5.695 8.947 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -4.796 -6.569 12.321 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -5.519 -8.094 11.757 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -3.749 -7.917 11.817 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -3.040 -3.867 10.595 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -4.772 -4.141 10.293 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -4.020 -4.760 11.782 1.00 0.00 H new ATOM 373 N LEU A 43 -6.695 -9.116 9.411 1.00 0.00 N ATOM 374 CA LEU A 43 -7.603 -10.195 9.779 1.00 0.00 C ATOM 375 C LEU A 43 -7.287 -11.448 8.970 1.00 0.00 C ATOM 376 O LEU A 43 -7.333 -12.559 9.494 1.00 0.00 O ATOM 377 CB LEU A 43 -9.053 -9.769 9.531 1.00 0.00 C ATOM 378 CG LEU A 43 -9.457 -8.667 10.525 1.00 0.00 C ATOM 379 CD1 LEU A 43 -10.777 -8.040 10.067 1.00 0.00 C ATOM 380 CD2 LEU A 43 -9.627 -9.247 11.945 1.00 0.00 C ATOM 0 H LEU A 43 -7.148 -8.301 8.998 1.00 0.00 H new ATOM 0 HA LEU A 43 -7.472 -10.415 10.838 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -9.164 -9.406 8.509 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -9.716 -10.627 9.638 1.00 0.00 H new ATOM 0 HG LEU A 43 -8.672 -7.911 10.553 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -11.070 -7.258 10.767 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -10.650 -7.609 9.074 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -11.552 -8.806 10.034 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -9.913 -8.450 12.632 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -10.403 -10.013 11.935 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -8.686 -9.688 12.273 1.00 0.00 H new ATOM 392 N ASP A 44 -6.961 -11.265 7.695 1.00 0.00 N ATOM 393 CA ASP A 44 -6.637 -12.398 6.834 1.00 0.00 C ATOM 394 C ASP A 44 -5.556 -13.254 7.484 1.00 0.00 C ATOM 395 O ASP A 44 -5.631 -14.483 7.468 1.00 0.00 O ATOM 396 CB ASP A 44 -6.144 -11.905 5.470 1.00 0.00 C ATOM 397 CG ASP A 44 -6.003 -13.081 4.510 1.00 0.00 C ATOM 398 OD1 ASP A 44 -6.138 -14.208 4.958 1.00 0.00 O ATOM 399 OD2 ASP A 44 -5.756 -12.839 3.339 1.00 0.00 O ATOM 0 H ASP A 44 -6.914 -10.354 7.238 1.00 0.00 H new ATOM 0 HA ASP A 44 -7.538 -12.996 6.694 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -6.844 -11.175 5.063 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -5.185 -11.399 5.582 1.00 0.00 H new ATOM 404 N ARG A 45 -4.554 -12.598 8.060 1.00 0.00 N ATOM 405 CA ARG A 45 -3.467 -13.313 8.719 1.00 0.00 C ATOM 406 C ARG A 45 -3.996 -14.161 9.873 1.00 0.00 C ATOM 407 O ARG A 45 -3.461 -15.231 10.164 1.00 0.00 O ATOM 408 CB ARG A 45 -2.429 -12.323 9.256 1.00 0.00 C ATOM 409 CG ARG A 45 -1.650 -11.709 8.091 1.00 0.00 C ATOM 410 CD ARG A 45 -0.683 -10.656 8.629 1.00 0.00 C ATOM 411 NE ARG A 45 0.262 -11.266 9.560 1.00 0.00 N ATOM 412 CZ ARG A 45 1.388 -11.831 9.139 1.00 0.00 C ATOM 413 NH1 ARG A 45 1.669 -11.855 7.866 1.00 0.00 N ATOM 414 NH2 ARG A 45 2.213 -12.363 10.000 1.00 0.00 N ATOM 0 H ARG A 45 -4.472 -11.582 8.084 1.00 0.00 H new ATOM 0 HA ARG A 45 -3.001 -13.967 7.982 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -2.923 -11.538 9.829 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -1.745 -12.831 9.936 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -1.101 -12.484 7.557 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -2.338 -11.256 7.377 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -0.143 -10.192 7.803 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -1.239 -9.864 9.131 1.00 0.00 H new ATOM 0 HE ARG A 45 0.052 -11.258 10.558 1.00 0.00 H new ATOM 0 HH11 ARG A 45 1.024 -11.440 7.193 1.00 0.00 H new ATOM 0 HH12 ARG A 45 2.534 -12.289 7.543 1.00 0.00 H new ATOM 0 HH21 ARG A 45 1.993 -12.345 10.996 1.00 0.00 H new ATOM 0 HH22 ARG A 45 3.078 -12.797 9.677 1.00 0.00 H new ATOM 428 N LEU A 46 -5.037 -13.677 10.541 1.00 0.00 N ATOM 429 CA LEU A 46 -5.607 -14.406 11.670 1.00 0.00 C ATOM 430 C LEU A 46 -6.120 -15.777 11.223 1.00 0.00 C ATOM 431 O LEU A 46 -5.839 -16.792 11.861 1.00 0.00 O ATOM 432 CB LEU A 46 -6.769 -13.602 12.265 1.00 0.00 C ATOM 433 CG LEU A 46 -7.216 -14.216 13.612 1.00 0.00 C ATOM 434 CD1 LEU A 46 -6.399 -13.607 14.752 1.00 0.00 C ATOM 435 CD2 LEU A 46 -8.700 -13.922 13.855 1.00 0.00 C ATOM 0 H LEU A 46 -5.499 -12.794 10.325 1.00 0.00 H new ATOM 0 HA LEU A 46 -4.829 -14.548 12.420 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -6.464 -12.566 12.414 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -7.607 -13.591 11.567 1.00 0.00 H new ATOM 0 HG LEU A 46 -7.058 -15.294 13.576 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -6.716 -14.042 15.700 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -5.341 -13.816 14.593 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -6.556 -12.529 14.777 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -9.006 -14.358 14.806 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -8.858 -12.844 13.883 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -9.293 -14.355 13.049 1.00 0.00 H new ATOM 447 N PHE A 47 -6.872 -15.800 10.125 1.00 0.00 N ATOM 448 CA PHE A 47 -7.416 -17.051 9.602 1.00 0.00 C ATOM 449 C PHE A 47 -6.307 -17.945 9.052 1.00 0.00 C ATOM 450 O PHE A 47 -6.301 -19.154 9.280 1.00 0.00 O ATOM 451 CB PHE A 47 -8.436 -16.755 8.495 1.00 0.00 C ATOM 452 CG PHE A 47 -9.704 -16.216 9.116 1.00 0.00 C ATOM 453 CD1 PHE A 47 -9.699 -14.955 9.719 1.00 0.00 C ATOM 454 CD2 PHE A 47 -10.881 -16.976 9.099 1.00 0.00 C ATOM 455 CE1 PHE A 47 -10.863 -14.450 10.304 1.00 0.00 C ATOM 456 CE2 PHE A 47 -12.049 -16.471 9.682 1.00 0.00 C ATOM 457 CZ PHE A 47 -12.040 -15.208 10.286 1.00 0.00 C ATOM 0 H PHE A 47 -7.118 -14.972 9.583 1.00 0.00 H new ATOM 0 HA PHE A 47 -7.907 -17.576 10.421 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -8.026 -16.031 7.791 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -8.651 -17.662 7.930 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -8.792 -14.369 9.733 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -10.887 -17.952 8.636 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -10.855 -13.476 10.770 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -12.957 -17.056 9.666 1.00 0.00 H new ATOM 0 HZ PHE A 47 -12.940 -14.819 10.738 1.00 0.00 H new ATOM 467 N PHE A 48 -5.371 -17.341 8.319 1.00 0.00 N ATOM 468 CA PHE A 48 -4.254 -18.084 7.726 1.00 0.00 C ATOM 469 C PHE A 48 -2.922 -17.505 8.188 1.00 0.00 C ATOM 470 O PHE A 48 -2.730 -16.291 8.190 1.00 0.00 O ATOM 471 CB PHE A 48 -4.343 -18.006 6.201 1.00 0.00 C ATOM 472 CG PHE A 48 -5.477 -18.877 5.719 1.00 0.00 C ATOM 473 CD1 PHE A 48 -6.783 -18.372 5.685 1.00 0.00 C ATOM 474 CD2 PHE A 48 -5.225 -20.192 5.311 1.00 0.00 C ATOM 475 CE1 PHE A 48 -7.836 -19.184 5.242 1.00 0.00 C ATOM 476 CE2 PHE A 48 -6.276 -21.001 4.868 1.00 0.00 C ATOM 477 CZ PHE A 48 -7.583 -20.497 4.835 1.00 0.00 C ATOM 0 H PHE A 48 -5.362 -16.340 8.121 1.00 0.00 H new ATOM 0 HA PHE A 48 -4.314 -19.124 8.047 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -4.504 -16.974 5.888 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -3.404 -18.332 5.754 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -6.978 -17.358 6.000 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -4.218 -20.582 5.338 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -8.843 -18.795 5.215 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -6.080 -22.015 4.551 1.00 0.00 H new ATOM 0 HZ PHE A 48 -8.395 -21.123 4.495 1.00 0.00 H new ATOM 487 N LYS A 49 -2.005 -18.383 8.576 1.00 0.00 N ATOM 488 CA LYS A 49 -0.694 -17.945 9.036 1.00 0.00 C ATOM 489 C LYS A 49 0.147 -17.447 7.867 1.00 0.00 C ATOM 490 O LYS A 49 0.972 -18.209 7.390 1.00 0.00 O ATOM 491 CB LYS A 49 0.026 -19.101 9.734 1.00 0.00 C ATOM 492 CG LYS A 49 -0.724 -19.472 11.014 1.00 0.00 C ATOM 493 CD LYS A 49 -0.018 -20.643 11.699 1.00 0.00 C ATOM 494 CE LYS A 49 -0.818 -21.074 12.930 1.00 0.00 C ATOM 495 NZ LYS A 49 -0.796 -19.982 13.944 1.00 0.00 N ATOM 496 OXT LYS A 49 -0.045 -16.312 7.465 1.00 0.00 O ATOM 0 H LYS A 49 -2.143 -19.394 8.581 1.00 0.00 H new ATOM 0 HA LYS A 49 -0.832 -17.125 9.741 1.00 0.00 H new ATOM 0 HB2 LYS A 49 0.081 -19.963 9.069 1.00 0.00 H new ATOM 0 HB3 LYS A 49 1.051 -18.815 9.971 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -0.764 -18.615 11.686 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -1.754 -19.742 10.779 1.00 0.00 H new ATOM 0 HD2 LYS A 49 0.080 -21.478 11.005 1.00 0.00 H new ATOM 0 HD3 LYS A 49 0.991 -20.352 11.992 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -1.846 -21.302 12.648 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -0.394 -21.985 13.352 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -1.111 -20.355 14.863 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 0.171 -19.611 14.034 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -1.434 -19.217 13.644 1.00 0.00 H new TER 510 LYS A 49 ATOM 511 N SER B 19 0.688 24.652 -10.600 1.00 0.00 N ATOM 512 CA SER B 19 -0.061 23.502 -11.180 1.00 0.00 C ATOM 513 C SER B 19 0.728 22.218 -10.953 1.00 0.00 C ATOM 514 O SER B 19 0.543 21.531 -9.948 1.00 0.00 O ATOM 515 CB SER B 19 -0.260 23.732 -12.679 1.00 0.00 C ATOM 516 OG SER B 19 -1.100 24.862 -12.872 1.00 0.00 O ATOM 0 HA SER B 19 -1.034 23.415 -10.697 1.00 0.00 H new ATOM 0 HB2 SER B 19 0.702 23.892 -13.165 1.00 0.00 H new ATOM 0 HB3 SER B 19 -0.706 22.850 -13.138 1.00 0.00 H new ATOM 0 HG SER B 19 -0.999 25.478 -12.116 1.00 0.00 H new ATOM 524 N ASN B 20 1.608 21.896 -11.896 1.00 0.00 N ATOM 525 CA ASN B 20 2.423 20.691 -11.793 1.00 0.00 C ATOM 526 C ASN B 20 3.344 20.773 -10.580 1.00 0.00 C ATOM 527 O ASN B 20 3.541 19.785 -9.872 1.00 0.00 O ATOM 528 CB ASN B 20 3.258 20.517 -13.063 1.00 0.00 C ATOM 529 CG ASN B 20 2.356 20.166 -14.244 1.00 0.00 C ATOM 530 OD1 ASN B 20 1.294 19.432 -14.054 1.00 0.00 O flip ATOM 531 ND2 ASN B 20 2.633 20.569 -15.376 1.00 0.00 N flip ATOM 0 H ASN B 20 1.774 22.450 -12.736 1.00 0.00 H new ATOM 0 HA ASN B 20 1.761 19.833 -11.675 1.00 0.00 H new ATOM 0 HB2 ASN B 20 3.806 21.435 -13.275 1.00 0.00 H new ATOM 0 HB3 ASN B 20 3.998 19.731 -12.915 1.00 0.00 H new ATOM 0 HD21 ASN B 20 3.463 21.143 -15.524 1.00 0.00 H new ATOM 0 HD22 ASN B 20 2.032 20.329 -16.164 1.00 0.00 H new ATOM 538 N ASP B 21 3.906 21.955 -10.349 1.00 0.00 N ATOM 539 CA ASP B 21 4.806 22.154 -9.219 1.00 0.00 C ATOM 540 C ASP B 21 4.069 21.924 -7.902 1.00 0.00 C ATOM 541 O ASP B 21 4.613 21.329 -6.972 1.00 0.00 O ATOM 542 CB ASP B 21 5.373 23.575 -9.246 1.00 0.00 C ATOM 543 CG ASP B 21 6.341 23.773 -8.085 1.00 0.00 C ATOM 544 OD1 ASP B 21 6.436 22.879 -7.259 1.00 0.00 O ATOM 545 OD2 ASP B 21 6.977 24.813 -8.041 1.00 0.00 O ATOM 0 H ASP B 21 3.756 22.784 -10.924 1.00 0.00 H new ATOM 0 HA ASP B 21 5.622 21.436 -9.298 1.00 0.00 H new ATOM 0 HB2 ASP B 21 5.885 23.753 -10.192 1.00 0.00 H new ATOM 0 HB3 ASP B 21 4.562 24.300 -9.182 1.00 0.00 H new ATOM 550 N SER B 22 2.830 22.396 -7.835 1.00 0.00 N ATOM 551 CA SER B 22 2.023 22.238 -6.631 1.00 0.00 C ATOM 552 C SER B 22 1.803 20.760 -6.323 1.00 0.00 C ATOM 553 O SER B 22 1.885 20.338 -5.171 1.00 0.00 O ATOM 554 CB SER B 22 0.674 22.933 -6.810 1.00 0.00 C ATOM 555 OG SER B 22 -0.082 22.803 -5.614 1.00 0.00 O ATOM 0 H SER B 22 2.364 22.889 -8.596 1.00 0.00 H new ATOM 0 HA SER B 22 2.556 22.694 -5.797 1.00 0.00 H new ATOM 0 HB2 SER B 22 0.823 23.986 -7.047 1.00 0.00 H new ATOM 0 HB3 SER B 22 0.132 22.491 -7.646 1.00 0.00 H new ATOM 0 HG SER B 22 -0.948 23.249 -5.724 1.00 0.00 H new ATOM 561 N SER B 23 1.524 19.977 -7.366 1.00 0.00 N ATOM 562 CA SER B 23 1.293 18.541 -7.210 1.00 0.00 C ATOM 563 C SER B 23 1.992 17.774 -8.325 1.00 0.00 C ATOM 564 O SER B 23 1.662 17.926 -9.501 1.00 0.00 O ATOM 565 CB SER B 23 -0.206 18.251 -7.254 1.00 0.00 C ATOM 566 OG SER B 23 -0.727 18.660 -8.510 1.00 0.00 O ATOM 0 H SER B 23 1.453 20.313 -8.326 1.00 0.00 H new ATOM 0 HA SER B 23 1.697 18.222 -6.249 1.00 0.00 H new ATOM 0 HB2 SER B 23 -0.387 17.187 -7.102 1.00 0.00 H new ATOM 0 HB3 SER B 23 -0.714 18.779 -6.447 1.00 0.00 H new ATOM 0 HG SER B 23 -0.034 18.569 -9.197 1.00 0.00 H new ATOM 572 N ASP B 24 2.964 16.954 -7.945 1.00 0.00 N ATOM 573 CA ASP B 24 3.716 16.165 -8.919 1.00 0.00 C ATOM 574 C ASP B 24 2.890 14.953 -9.378 1.00 0.00 C ATOM 575 O ASP B 24 2.028 14.474 -8.642 1.00 0.00 O ATOM 576 CB ASP B 24 5.050 15.700 -8.296 1.00 0.00 C ATOM 577 CG ASP B 24 4.887 15.518 -6.790 1.00 0.00 C ATOM 578 OD1 ASP B 24 4.638 16.506 -6.118 1.00 0.00 O ATOM 579 OD2 ASP B 24 5.016 14.395 -6.332 1.00 0.00 O ATOM 0 H ASP B 24 3.251 16.817 -6.976 1.00 0.00 H new ATOM 0 HA ASP B 24 3.928 16.786 -9.789 1.00 0.00 H new ATOM 0 HB2 ASP B 24 5.366 14.762 -8.752 1.00 0.00 H new ATOM 0 HB3 ASP B 24 5.831 16.433 -8.500 1.00 0.00 H new ATOM 584 N PRO B 25 3.139 14.454 -10.568 1.00 0.00 N ATOM 585 CA PRO B 25 2.397 13.277 -11.118 1.00 0.00 C ATOM 586 C PRO B 25 2.691 11.998 -10.329 1.00 0.00 C ATOM 587 O PRO B 25 1.951 11.018 -10.420 1.00 0.00 O ATOM 588 CB PRO B 25 2.902 13.170 -12.571 1.00 0.00 C ATOM 589 CG PRO B 25 4.241 13.838 -12.564 1.00 0.00 C ATOM 590 CD PRO B 25 4.146 14.954 -11.523 1.00 0.00 C ATOM 0 HA PRO B 25 1.316 13.403 -11.055 1.00 0.00 H new ATOM 0 HB2 PRO B 25 2.981 12.130 -12.886 1.00 0.00 H new ATOM 0 HB3 PRO B 25 2.219 13.662 -13.264 1.00 0.00 H new ATOM 0 HG2 PRO B 25 5.029 13.130 -12.307 1.00 0.00 H new ATOM 0 HG3 PRO B 25 4.482 14.241 -13.548 1.00 0.00 H new ATOM 0 HD2 PRO B 25 5.105 15.132 -11.037 1.00 0.00 H new ATOM 0 HD3 PRO B 25 3.837 15.897 -11.974 1.00 0.00 H new ATOM 598 N LEU B 26 3.774 12.017 -9.562 1.00 0.00 N ATOM 599 CA LEU B 26 4.158 10.853 -8.768 1.00 0.00 C ATOM 600 C LEU B 26 3.074 10.519 -7.747 1.00 0.00 C ATOM 601 O LEU B 26 2.738 9.352 -7.548 1.00 0.00 O ATOM 602 CB LEU B 26 5.476 11.133 -8.040 1.00 0.00 C ATOM 603 CG LEU B 26 6.638 11.198 -9.049 1.00 0.00 C ATOM 604 CD1 LEU B 26 7.869 11.787 -8.353 1.00 0.00 C ATOM 605 CD2 LEU B 26 6.974 9.791 -9.585 1.00 0.00 C ATOM 0 H LEU B 26 4.399 12.818 -9.472 1.00 0.00 H new ATOM 0 HA LEU B 26 4.284 10.003 -9.439 1.00 0.00 H new ATOM 0 HB2 LEU B 26 5.406 12.074 -7.494 1.00 0.00 H new ATOM 0 HB3 LEU B 26 5.667 10.351 -7.305 1.00 0.00 H new ATOM 0 HG LEU B 26 6.343 11.826 -9.889 1.00 0.00 H new ATOM 0 HD11 LEU B 26 8.697 11.837 -9.060 1.00 0.00 H new ATOM 0 HD12 LEU B 26 7.638 12.790 -7.993 1.00 0.00 H new ATOM 0 HD13 LEU B 26 8.148 11.154 -7.511 1.00 0.00 H new ATOM 0 HD21 LEU B 26 7.797 9.860 -10.296 1.00 0.00 H new ATOM 0 HD22 LEU B 26 7.263 9.145 -8.756 1.00 0.00 H new ATOM 0 HD23 LEU B 26 6.099 9.373 -10.082 1.00 0.00 H new ATOM 617 N VAL B 27 2.533 11.547 -7.101 1.00 0.00 N ATOM 618 CA VAL B 27 1.489 11.343 -6.102 1.00 0.00 C ATOM 619 C VAL B 27 0.237 10.761 -6.756 1.00 0.00 C ATOM 620 O VAL B 27 -0.367 9.825 -6.236 1.00 0.00 O ATOM 621 CB VAL B 27 1.147 12.671 -5.422 1.00 0.00 C ATOM 622 CG1 VAL B 27 -0.035 12.474 -4.467 1.00 0.00 C ATOM 623 CG2 VAL B 27 2.365 13.161 -4.634 1.00 0.00 C ATOM 0 H VAL B 27 2.797 12.521 -7.249 1.00 0.00 H new ATOM 0 HA VAL B 27 1.856 10.641 -5.353 1.00 0.00 H new ATOM 0 HB VAL B 27 0.877 13.408 -6.178 1.00 0.00 H new ATOM 0 HG11 VAL B 27 -0.275 13.422 -3.985 1.00 0.00 H new ATOM 0 HG12 VAL B 27 -0.901 12.122 -5.028 1.00 0.00 H new ATOM 0 HG13 VAL B 27 0.229 11.738 -3.708 1.00 0.00 H new ATOM 0 HG21 VAL B 27 2.127 14.107 -4.147 1.00 0.00 H new ATOM 0 HG22 VAL B 27 2.631 12.421 -3.879 1.00 0.00 H new ATOM 0 HG23 VAL B 27 3.205 13.304 -5.314 1.00 0.00 H new ATOM 633 N VAL B 28 -0.144 11.327 -7.896 1.00 0.00 N ATOM 634 CA VAL B 28 -1.324 10.861 -8.615 1.00 0.00 C ATOM 635 C VAL B 28 -1.131 9.423 -9.088 1.00 0.00 C ATOM 636 O VAL B 28 -2.029 8.592 -8.960 1.00 0.00 O ATOM 637 CB VAL B 28 -1.595 11.766 -9.819 1.00 0.00 C ATOM 638 CG1 VAL B 28 -2.771 11.213 -10.626 1.00 0.00 C ATOM 639 CG2 VAL B 28 -1.933 13.177 -9.331 1.00 0.00 C ATOM 0 H VAL B 28 0.344 12.105 -8.340 1.00 0.00 H new ATOM 0 HA VAL B 28 -2.176 10.896 -7.937 1.00 0.00 H new ATOM 0 HB VAL B 28 -0.707 11.800 -10.451 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -2.961 11.860 -11.482 1.00 0.00 H new ATOM 0 HG12 VAL B 28 -2.532 10.209 -10.976 1.00 0.00 H new ATOM 0 HG13 VAL B 28 -3.659 11.176 -9.995 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -2.126 13.822 -10.188 1.00 0.00 H new ATOM 0 HG22 VAL B 28 -2.819 13.140 -8.698 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -1.095 13.575 -8.759 1.00 0.00 H new ATOM 649 N ALA B 29 0.045 9.140 -9.640 1.00 0.00 N ATOM 650 CA ALA B 29 0.340 7.798 -10.133 1.00 0.00 C ATOM 651 C ALA B 29 0.299 6.787 -8.994 1.00 0.00 C ATOM 652 O ALA B 29 -0.210 5.679 -9.155 1.00 0.00 O ATOM 653 CB ALA B 29 1.724 7.774 -10.785 1.00 0.00 C ATOM 0 H ALA B 29 0.802 9.813 -9.757 1.00 0.00 H new ATOM 0 HA ALA B 29 -0.416 7.529 -10.871 1.00 0.00 H new ATOM 0 HB1 ALA B 29 1.937 6.769 -11.150 1.00 0.00 H new ATOM 0 HB2 ALA B 29 1.746 8.475 -11.619 1.00 0.00 H new ATOM 0 HB3 ALA B 29 2.477 8.060 -10.051 1.00 0.00 H new ATOM 659 N ALA B 30 0.838 7.173 -7.843 1.00 0.00 N ATOM 660 CA ALA B 30 0.852 6.284 -6.690 1.00 0.00 C ATOM 661 C ALA B 30 -0.572 5.981 -6.236 1.00 0.00 C ATOM 662 O ALA B 30 -0.896 4.846 -5.889 1.00 0.00 O ATOM 663 CB ALA B 30 1.628 6.926 -5.539 1.00 0.00 C ATOM 0 H ALA B 30 1.266 8.085 -7.685 1.00 0.00 H new ATOM 0 HA ALA B 30 1.340 5.353 -6.979 1.00 0.00 H new ATOM 0 HB1 ALA B 30 1.632 6.252 -4.682 1.00 0.00 H new ATOM 0 HB2 ALA B 30 2.654 7.118 -5.854 1.00 0.00 H new ATOM 0 HB3 ALA B 30 1.152 7.866 -5.259 1.00 0.00 H new ATOM 669 N ASN B 31 -1.422 7.003 -6.243 1.00 0.00 N ATOM 670 CA ASN B 31 -2.808 6.830 -5.828 1.00 0.00 C ATOM 671 C ASN B 31 -3.548 5.898 -6.786 1.00 0.00 C ATOM 672 O ASN B 31 -4.275 5.007 -6.358 1.00 0.00 O ATOM 673 CB ASN B 31 -3.514 8.187 -5.790 1.00 0.00 C ATOM 674 CG ASN B 31 -4.974 8.004 -5.392 1.00 0.00 C ATOM 675 OD1 ASN B 31 -5.436 6.874 -5.226 1.00 0.00 O ATOM 676 ND2 ASN B 31 -5.734 9.053 -5.228 1.00 0.00 N ATOM 0 H ASN B 31 -1.178 7.951 -6.529 1.00 0.00 H new ATOM 0 HA ASN B 31 -2.814 6.386 -4.832 1.00 0.00 H new ATOM 0 HB2 ASN B 31 -3.015 8.846 -5.080 1.00 0.00 H new ATOM 0 HB3 ASN B 31 -3.452 8.666 -6.767 1.00 0.00 H new ATOM 0 HD21 ASN B 31 -6.712 8.938 -4.962 1.00 0.00 H new ATOM 0 HD22 ASN B 31 -5.350 9.988 -5.366 1.00 0.00 H new ATOM 683 N ILE B 32 -3.358 6.111 -8.086 1.00 0.00 N ATOM 684 CA ILE B 32 -4.023 5.280 -9.086 1.00 0.00 C ATOM 685 C ILE B 32 -3.529 3.836 -8.997 1.00 0.00 C ATOM 686 O ILE B 32 -4.322 2.894 -9.034 1.00 0.00 O ATOM 687 CB ILE B 32 -3.752 5.841 -10.486 1.00 0.00 C ATOM 688 CG1 ILE B 32 -4.444 7.199 -10.626 1.00 0.00 C ATOM 689 CG2 ILE B 32 -4.304 4.882 -11.543 1.00 0.00 C ATOM 690 CD1 ILE B 32 -3.944 7.902 -11.890 1.00 0.00 C ATOM 0 H ILE B 32 -2.757 6.842 -8.468 1.00 0.00 H new ATOM 0 HA ILE B 32 -5.096 5.291 -8.894 1.00 0.00 H new ATOM 0 HB ILE B 32 -2.677 5.956 -10.629 1.00 0.00 H new ATOM 0 HG12 ILE B 32 -5.525 7.064 -10.676 1.00 0.00 H new ATOM 0 HG13 ILE B 32 -4.239 7.815 -9.750 1.00 0.00 H new ATOM 0 HG21 ILE B 32 -4.109 5.285 -12.537 1.00 0.00 H new ATOM 0 HG22 ILE B 32 -3.818 3.912 -11.443 1.00 0.00 H new ATOM 0 HG23 ILE B 32 -5.379 4.766 -11.403 1.00 0.00 H new ATOM 0 HD11 ILE B 32 -4.438 8.869 -11.988 1.00 0.00 H new ATOM 0 HD12 ILE B 32 -2.866 8.050 -11.822 1.00 0.00 H new ATOM 0 HD13 ILE B 32 -4.171 7.288 -12.762 1.00 0.00 H new ATOM 702 N ILE B 33 -2.218 3.676 -8.872 1.00 0.00 N ATOM 703 CA ILE B 33 -1.620 2.349 -8.770 1.00 0.00 C ATOM 704 C ILE B 33 -2.070 1.648 -7.488 1.00 0.00 C ATOM 705 O ILE B 33 -2.404 0.464 -7.504 1.00 0.00 O ATOM 706 CB ILE B 33 -0.093 2.473 -8.804 1.00 0.00 C ATOM 707 CG1 ILE B 33 0.344 2.917 -10.204 1.00 0.00 C ATOM 708 CG2 ILE B 33 0.550 1.126 -8.463 1.00 0.00 C ATOM 709 CD1 ILE B 33 1.820 3.318 -10.174 1.00 0.00 C ATOM 0 H ILE B 33 -1.549 4.445 -8.839 1.00 0.00 H new ATOM 0 HA ILE B 33 -1.951 1.746 -9.616 1.00 0.00 H new ATOM 0 HB ILE B 33 0.227 3.211 -8.069 1.00 0.00 H new ATOM 0 HG12 ILE B 33 0.190 2.108 -10.918 1.00 0.00 H new ATOM 0 HG13 ILE B 33 -0.265 3.757 -10.538 1.00 0.00 H new ATOM 0 HG21 ILE B 33 1.635 1.224 -8.490 1.00 0.00 H new ATOM 0 HG22 ILE B 33 0.238 0.816 -7.466 1.00 0.00 H new ATOM 0 HG23 ILE B 33 0.235 0.378 -9.191 1.00 0.00 H new ATOM 0 HD11 ILE B 33 2.132 3.634 -11.170 1.00 0.00 H new ATOM 0 HD12 ILE B 33 1.959 4.140 -9.472 1.00 0.00 H new ATOM 0 HD13 ILE B 33 2.422 2.466 -9.859 1.00 0.00 H new ATOM 721 N GLY B 34 -2.075 2.385 -6.381 1.00 0.00 N ATOM 722 CA GLY B 34 -2.484 1.816 -5.100 1.00 0.00 C ATOM 723 C GLY B 34 -3.945 1.375 -5.138 1.00 0.00 C ATOM 724 O GLY B 34 -4.297 0.305 -4.638 1.00 0.00 O ATOM 0 H GLY B 34 -1.804 3.368 -6.344 1.00 0.00 H new ATOM 0 HA2 GLY B 34 -1.849 0.964 -4.858 1.00 0.00 H new ATOM 0 HA3 GLY B 34 -2.343 2.553 -4.309 1.00 0.00 H new ATOM 728 N ILE B 35 -4.792 2.203 -5.733 1.00 0.00 N ATOM 729 CA ILE B 35 -6.212 1.883 -5.829 1.00 0.00 C ATOM 730 C ILE B 35 -6.407 0.627 -6.679 1.00 0.00 C ATOM 731 O ILE B 35 -7.184 -0.261 -6.323 1.00 0.00 O ATOM 732 CB ILE B 35 -6.968 3.065 -6.457 1.00 0.00 C ATOM 733 CG1 ILE B 35 -6.955 4.281 -5.497 1.00 0.00 C ATOM 734 CG2 ILE B 35 -8.411 2.651 -6.776 1.00 0.00 C ATOM 735 CD1 ILE B 35 -8.085 4.199 -4.460 1.00 0.00 C ATOM 0 H ILE B 35 -4.526 3.093 -6.153 1.00 0.00 H new ATOM 0 HA ILE B 35 -6.606 1.697 -4.830 1.00 0.00 H new ATOM 0 HB ILE B 35 -6.471 3.352 -7.384 1.00 0.00 H new ATOM 0 HG12 ILE B 35 -5.994 4.330 -4.985 1.00 0.00 H new ATOM 0 HG13 ILE B 35 -7.056 5.201 -6.073 1.00 0.00 H new ATOM 0 HG21 ILE B 35 -8.941 3.493 -7.221 1.00 0.00 H new ATOM 0 HG22 ILE B 35 -8.404 1.816 -7.477 1.00 0.00 H new ATOM 0 HG23 ILE B 35 -8.915 2.349 -5.857 1.00 0.00 H new ATOM 0 HD11 ILE B 35 -8.042 5.070 -3.805 1.00 0.00 H new ATOM 0 HD12 ILE B 35 -9.047 4.177 -4.971 1.00 0.00 H new ATOM 0 HD13 ILE B 35 -7.969 3.292 -3.866 1.00 0.00 H new ATOM 747 N LEU B 36 -5.690 0.558 -7.799 1.00 0.00 N ATOM 748 CA LEU B 36 -5.786 -0.594 -8.691 1.00 0.00 C ATOM 749 C LEU B 36 -5.360 -1.856 -7.959 1.00 0.00 C ATOM 750 O LEU B 36 -5.938 -2.927 -8.157 1.00 0.00 O ATOM 751 CB LEU B 36 -4.902 -0.389 -9.931 1.00 0.00 C ATOM 752 CG LEU B 36 -5.021 -1.594 -10.883 1.00 0.00 C ATOM 753 CD1 LEU B 36 -6.479 -1.776 -11.341 1.00 0.00 C ATOM 754 CD2 LEU B 36 -4.126 -1.350 -12.104 1.00 0.00 C ATOM 0 H LEU B 36 -5.041 1.281 -8.108 1.00 0.00 H new ATOM 0 HA LEU B 36 -6.822 -0.698 -9.012 1.00 0.00 H new ATOM 0 HB2 LEU B 36 -5.199 0.523 -10.450 1.00 0.00 H new ATOM 0 HB3 LEU B 36 -3.863 -0.259 -9.627 1.00 0.00 H new ATOM 0 HG LEU B 36 -4.707 -2.498 -10.361 1.00 0.00 H new ATOM 0 HD11 LEU B 36 -6.545 -2.632 -12.013 1.00 0.00 H new ATOM 0 HD12 LEU B 36 -7.115 -1.947 -10.472 1.00 0.00 H new ATOM 0 HD13 LEU B 36 -6.811 -0.878 -11.863 1.00 0.00 H new ATOM 0 HD21 LEU B 36 -4.202 -2.197 -12.786 1.00 0.00 H new ATOM 0 HD22 LEU B 36 -4.448 -0.443 -12.615 1.00 0.00 H new ATOM 0 HD23 LEU B 36 -3.091 -1.237 -11.780 1.00 0.00 H new ATOM 766 N HIS B 37 -4.351 -1.727 -7.108 1.00 0.00 N ATOM 767 CA HIS B 37 -3.866 -2.870 -6.355 1.00 0.00 C ATOM 768 C HIS B 37 -5.006 -3.466 -5.543 1.00 0.00 C ATOM 769 O HIS B 37 -5.153 -4.686 -5.473 1.00 0.00 O ATOM 770 CB HIS B 37 -2.749 -2.447 -5.402 1.00 0.00 C ATOM 771 CG HIS B 37 -2.271 -3.655 -4.647 1.00 0.00 C ATOM 772 ND1 HIS B 37 -0.979 -4.128 -4.758 1.00 0.00 N ATOM 773 CD2 HIS B 37 -2.906 -4.507 -3.779 1.00 0.00 C ATOM 774 CE1 HIS B 37 -0.879 -5.221 -3.982 1.00 0.00 C ATOM 775 NE2 HIS B 37 -2.025 -5.496 -3.363 1.00 0.00 N ATOM 0 H HIS B 37 -3.859 -0.852 -6.925 1.00 0.00 H new ATOM 0 HA HIS B 37 -3.479 -3.609 -7.057 1.00 0.00 H new ATOM 0 HB2 HIS B 37 -1.926 -2.001 -5.960 1.00 0.00 H new ATOM 0 HB3 HIS B 37 -3.112 -1.688 -4.709 1.00 0.00 H new ATOM 0 HD2 HIS B 37 -3.936 -4.421 -3.466 1.00 0.00 H new ATOM 0 HE1 HIS B 37 0.023 -5.806 -3.874 1.00 0.00 H new ATOM 0 HE2 HIS B 37 -2.215 -6.266 -2.722 1.00 0.00 H new ATOM 783 N LEU B 38 -5.810 -2.604 -4.930 1.00 0.00 N ATOM 784 CA LEU B 38 -6.934 -3.076 -4.123 1.00 0.00 C ATOM 785 C LEU B 38 -7.932 -3.850 -4.976 1.00 0.00 C ATOM 786 O LEU B 38 -8.500 -4.840 -4.523 1.00 0.00 O ATOM 787 CB LEU B 38 -7.639 -1.894 -3.411 1.00 0.00 C ATOM 788 CG LEU B 38 -7.000 -1.632 -2.031 1.00 0.00 C ATOM 789 CD1 LEU B 38 -7.419 -0.250 -1.517 1.00 0.00 C ATOM 790 CD2 LEU B 38 -7.460 -2.708 -1.022 1.00 0.00 C ATOM 0 H LEU B 38 -5.709 -1.590 -4.973 1.00 0.00 H new ATOM 0 HA LEU B 38 -6.537 -3.749 -3.363 1.00 0.00 H new ATOM 0 HB2 LEU B 38 -7.568 -0.997 -4.027 1.00 0.00 H new ATOM 0 HB3 LEU B 38 -8.699 -2.115 -3.291 1.00 0.00 H new ATOM 0 HG LEU B 38 -5.916 -1.671 -2.135 1.00 0.00 H new ATOM 0 HD11 LEU B 38 -6.965 -0.071 -0.542 1.00 0.00 H new ATOM 0 HD12 LEU B 38 -7.086 0.515 -2.218 1.00 0.00 H new ATOM 0 HD13 LEU B 38 -8.504 -0.210 -1.424 1.00 0.00 H new ATOM 0 HD21 LEU B 38 -7.004 -2.515 -0.051 1.00 0.00 H new ATOM 0 HD22 LEU B 38 -8.545 -2.676 -0.926 1.00 0.00 H new ATOM 0 HD23 LEU B 38 -7.156 -3.693 -1.376 1.00 0.00 H new ATOM 802 N ILE B 39 -8.159 -3.402 -6.196 1.00 0.00 N ATOM 803 CA ILE B 39 -9.112 -4.088 -7.055 1.00 0.00 C ATOM 804 C ILE B 39 -8.713 -5.553 -7.233 1.00 0.00 C ATOM 805 O ILE B 39 -9.532 -6.451 -7.038 1.00 0.00 O ATOM 806 CB ILE B 39 -9.154 -3.400 -8.422 1.00 0.00 C ATOM 807 CG1 ILE B 39 -9.442 -1.900 -8.242 1.00 0.00 C ATOM 808 CG2 ILE B 39 -10.237 -4.038 -9.297 1.00 0.00 C ATOM 809 CD1 ILE B 39 -10.730 -1.682 -7.436 1.00 0.00 C ATOM 0 H ILE B 39 -7.710 -2.585 -6.610 1.00 0.00 H new ATOM 0 HA ILE B 39 -10.097 -4.047 -6.591 1.00 0.00 H new ATOM 0 HB ILE B 39 -8.187 -3.522 -8.911 1.00 0.00 H new ATOM 0 HG12 ILE B 39 -8.604 -1.423 -7.733 1.00 0.00 H new ATOM 0 HG13 ILE B 39 -9.534 -1.424 -9.218 1.00 0.00 H new ATOM 0 HG21 ILE B 39 -10.260 -3.542 -10.267 1.00 0.00 H new ATOM 0 HG22 ILE B 39 -10.016 -5.096 -9.435 1.00 0.00 H new ATOM 0 HG23 ILE B 39 -11.207 -3.930 -8.812 1.00 0.00 H new ATOM 0 HD11 ILE B 39 -10.912 -0.613 -7.322 1.00 0.00 H new ATOM 0 HD12 ILE B 39 -11.569 -2.139 -7.960 1.00 0.00 H new ATOM 0 HD13 ILE B 39 -10.625 -2.139 -6.452 1.00 0.00 H new ATOM 821 N LEU B 40 -7.456 -5.795 -7.599 1.00 0.00 N ATOM 822 CA LEU B 40 -6.977 -7.165 -7.794 1.00 0.00 C ATOM 823 C LEU B 40 -6.879 -7.922 -6.464 1.00 0.00 C ATOM 824 O LEU B 40 -7.262 -9.088 -6.377 1.00 0.00 O ATOM 825 CB LEU B 40 -5.607 -7.140 -8.486 1.00 0.00 C ATOM 826 CG LEU B 40 -5.793 -6.913 -9.990 1.00 0.00 C ATOM 827 CD1 LEU B 40 -6.530 -5.589 -10.219 1.00 0.00 C ATOM 828 CD2 LEU B 40 -4.425 -6.861 -10.672 1.00 0.00 C ATOM 0 H LEU B 40 -6.757 -5.071 -7.765 1.00 0.00 H new ATOM 0 HA LEU B 40 -7.697 -7.689 -8.423 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -4.989 -6.348 -8.062 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -5.084 -8.080 -8.312 1.00 0.00 H new ATOM 0 HG LEU B 40 -6.377 -7.731 -10.411 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -6.663 -5.427 -11.289 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -7.505 -5.627 -9.734 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -5.947 -4.770 -9.797 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -4.558 -6.700 -11.742 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -3.840 -6.043 -10.251 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -3.901 -7.803 -10.509 1.00 0.00 H new ATOM 840 N TRP B 41 -6.351 -7.259 -5.437 1.00 0.00 N ATOM 841 CA TRP B 41 -6.196 -7.889 -4.126 1.00 0.00 C ATOM 842 C TRP B 41 -7.558 -8.242 -3.525 1.00 0.00 C ATOM 843 O TRP B 41 -7.724 -9.305 -2.921 1.00 0.00 O ATOM 844 CB TRP B 41 -5.401 -6.963 -3.196 1.00 0.00 C ATOM 845 CG TRP B 41 -5.273 -7.575 -1.834 1.00 0.00 C ATOM 846 CD1 TRP B 41 -4.338 -8.485 -1.464 1.00 0.00 C ATOM 847 CD2 TRP B 41 -6.045 -7.280 -0.637 1.00 0.00 C ATOM 848 NE1 TRP B 41 -4.521 -8.797 -0.130 1.00 0.00 N ATOM 849 CE2 TRP B 41 -5.555 -8.071 0.425 1.00 0.00 C ATOM 850 CE3 TRP B 41 -7.120 -6.417 -0.376 1.00 0.00 C ATOM 851 CZ2 TRP B 41 -6.112 -8.007 1.699 1.00 0.00 C ATOM 852 CZ3 TRP B 41 -7.680 -6.346 0.906 1.00 0.00 C ATOM 853 CH2 TRP B 41 -7.175 -7.139 1.940 1.00 0.00 C ATOM 0 H TRP B 41 -6.025 -6.294 -5.485 1.00 0.00 H new ATOM 0 HA TRP B 41 -5.642 -8.820 -4.245 1.00 0.00 H new ATOM 0 HB2 TRP B 41 -4.411 -6.780 -3.614 1.00 0.00 H new ATOM 0 HB3 TRP B 41 -5.899 -5.996 -3.122 1.00 0.00 H new ATOM 0 HD1 TRP B 41 -3.575 -8.898 -2.107 1.00 0.00 H new ATOM 0 HE1 TRP B 41 -3.961 -9.479 0.381 1.00 0.00 H new ATOM 0 HE3 TRP B 41 -7.519 -5.803 -1.170 1.00 0.00 H new ATOM 0 HZ2 TRP B 41 -5.723 -8.625 2.495 1.00 0.00 H new ATOM 0 HZ3 TRP B 41 -8.505 -5.676 1.096 1.00 0.00 H new ATOM 0 HH2 TRP B 41 -7.609 -7.079 2.927 1.00 0.00 H new ATOM 864 N ILE B 42 -8.530 -7.357 -3.711 1.00 0.00 N ATOM 865 CA ILE B 42 -9.876 -7.593 -3.197 1.00 0.00 C ATOM 866 C ILE B 42 -10.462 -8.845 -3.850 1.00 0.00 C ATOM 867 O ILE B 42 -11.045 -9.695 -3.176 1.00 0.00 O ATOM 868 CB ILE B 42 -10.763 -6.369 -3.497 1.00 0.00 C ATOM 869 CG1 ILE B 42 -10.447 -5.252 -2.496 1.00 0.00 C ATOM 870 CG2 ILE B 42 -12.252 -6.741 -3.388 1.00 0.00 C ATOM 871 CD1 ILE B 42 -11.033 -3.932 -3.004 1.00 0.00 C ATOM 0 H ILE B 42 -8.414 -6.475 -4.210 1.00 0.00 H new ATOM 0 HA ILE B 42 -9.835 -7.745 -2.118 1.00 0.00 H new ATOM 0 HB ILE B 42 -10.557 -6.029 -4.512 1.00 0.00 H new ATOM 0 HG12 ILE B 42 -10.864 -5.496 -1.519 1.00 0.00 H new ATOM 0 HG13 ILE B 42 -9.369 -5.158 -2.368 1.00 0.00 H new ATOM 0 HG21 ILE B 42 -12.863 -5.864 -3.603 1.00 0.00 H new ATOM 0 HG22 ILE B 42 -12.484 -7.529 -4.104 1.00 0.00 H new ATOM 0 HG23 ILE B 42 -12.466 -7.094 -2.379 1.00 0.00 H new ATOM 0 HD11 ILE B 42 -10.809 -3.137 -2.293 1.00 0.00 H new ATOM 0 HD12 ILE B 42 -10.595 -3.688 -3.972 1.00 0.00 H new ATOM 0 HD13 ILE B 42 -12.113 -4.030 -3.110 1.00 0.00 H new ATOM 883 N LEU B 43 -10.294 -8.952 -5.162 1.00 0.00 N ATOM 884 CA LEU B 43 -10.803 -10.103 -5.897 1.00 0.00 C ATOM 885 C LEU B 43 -10.119 -11.379 -5.418 1.00 0.00 C ATOM 886 O LEU B 43 -10.754 -12.422 -5.296 1.00 0.00 O ATOM 887 CB LEU B 43 -10.561 -9.918 -7.397 1.00 0.00 C ATOM 888 CG LEU B 43 -11.447 -8.785 -7.939 1.00 0.00 C ATOM 889 CD1 LEU B 43 -10.972 -8.406 -9.344 1.00 0.00 C ATOM 890 CD2 LEU B 43 -12.925 -9.226 -7.998 1.00 0.00 C ATOM 0 H LEU B 43 -9.812 -8.260 -5.736 1.00 0.00 H new ATOM 0 HA LEU B 43 -11.875 -10.186 -5.716 1.00 0.00 H new ATOM 0 HB2 LEU B 43 -9.511 -9.688 -7.578 1.00 0.00 H new ATOM 0 HB3 LEU B 43 -10.780 -10.846 -7.926 1.00 0.00 H new ATOM 0 HG LEU B 43 -11.369 -7.927 -7.271 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -11.596 -7.603 -9.735 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -9.936 -8.071 -9.300 1.00 0.00 H new ATOM 0 HD13 LEU B 43 -11.045 -9.274 -9.999 1.00 0.00 H new ATOM 0 HD21 LEU B 43 -13.533 -8.408 -8.385 1.00 0.00 H new ATOM 0 HD22 LEU B 43 -13.021 -10.091 -8.654 1.00 0.00 H new ATOM 0 HD23 LEU B 43 -13.266 -9.490 -6.997 1.00 0.00 H new ATOM 902 N ASP B 44 -8.820 -11.288 -5.145 1.00 0.00 N ATOM 903 CA ASP B 44 -8.072 -12.449 -4.681 1.00 0.00 C ATOM 904 C ASP B 44 -8.769 -13.068 -3.473 1.00 0.00 C ATOM 905 O ASP B 44 -8.884 -14.289 -3.369 1.00 0.00 O ATOM 906 CB ASP B 44 -6.647 -12.042 -4.298 1.00 0.00 C ATOM 907 CG ASP B 44 -5.818 -13.280 -3.974 1.00 0.00 C ATOM 908 OD1 ASP B 44 -6.390 -14.356 -3.921 1.00 0.00 O ATOM 909 OD2 ASP B 44 -4.620 -13.136 -3.785 1.00 0.00 O ATOM 0 H ASP B 44 -8.271 -10.433 -5.236 1.00 0.00 H new ATOM 0 HA ASP B 44 -8.028 -13.181 -5.487 1.00 0.00 H new ATOM 0 HB2 ASP B 44 -6.186 -11.490 -5.117 1.00 0.00 H new ATOM 0 HB3 ASP B 44 -6.670 -11.375 -3.437 1.00 0.00 H new ATOM 914 N ARG B 45 -9.240 -12.217 -2.566 1.00 0.00 N ATOM 915 CA ARG B 45 -9.936 -12.695 -1.373 1.00 0.00 C ATOM 916 C ARG B 45 -11.186 -13.482 -1.753 1.00 0.00 C ATOM 917 O ARG B 45 -11.569 -14.425 -1.061 1.00 0.00 O ATOM 918 CB ARG B 45 -10.331 -11.516 -0.481 1.00 0.00 C ATOM 919 CG ARG B 45 -9.085 -10.924 0.181 1.00 0.00 C ATOM 920 CD ARG B 45 -9.482 -9.691 0.991 1.00 0.00 C ATOM 921 NE ARG B 45 -10.443 -10.057 2.030 1.00 0.00 N ATOM 922 CZ ARG B 45 -10.044 -10.497 3.221 1.00 0.00 C ATOM 923 NH1 ARG B 45 -8.774 -10.619 3.481 1.00 0.00 N ATOM 924 NH2 ARG B 45 -10.930 -10.809 4.128 1.00 0.00 N ATOM 0 H ARG B 45 -9.154 -11.203 -2.632 1.00 0.00 H new ATOM 0 HA ARG B 45 -9.257 -13.351 -0.828 1.00 0.00 H new ATOM 0 HB2 ARG B 45 -10.836 -10.753 -1.074 1.00 0.00 H new ATOM 0 HB3 ARG B 45 -11.037 -11.846 0.281 1.00 0.00 H new ATOM 0 HG2 ARG B 45 -8.617 -11.664 0.830 1.00 0.00 H new ATOM 0 HG3 ARG B 45 -8.350 -10.654 -0.577 1.00 0.00 H new ATOM 0 HD2 ARG B 45 -8.597 -9.245 1.445 1.00 0.00 H new ATOM 0 HD3 ARG B 45 -9.916 -8.939 0.333 1.00 0.00 H new ATOM 0 HE ARG B 45 -11.441 -9.973 1.838 1.00 0.00 H new ATOM 0 HH11 ARG B 45 -8.083 -10.377 2.771 1.00 0.00 H new ATOM 0 HH12 ARG B 45 -8.471 -10.956 4.395 1.00 0.00 H new ATOM 0 HH21 ARG B 45 -11.925 -10.715 3.923 1.00 0.00 H new ATOM 0 HH22 ARG B 45 -10.627 -11.147 5.042 1.00 0.00 H new ATOM 938 N LEU B 46 -11.835 -13.083 -2.841 1.00 0.00 N ATOM 939 CA LEU B 46 -13.053 -13.759 -3.277 1.00 0.00 C ATOM 940 C LEU B 46 -12.768 -15.230 -3.593 1.00 0.00 C ATOM 941 O LEU B 46 -13.500 -16.118 -3.157 1.00 0.00 O ATOM 942 CB LEU B 46 -13.600 -13.070 -4.533 1.00 0.00 C ATOM 943 CG LEU B 46 -15.017 -13.594 -4.862 1.00 0.00 C ATOM 944 CD1 LEU B 46 -16.060 -12.754 -4.122 1.00 0.00 C ATOM 945 CD2 LEU B 46 -15.279 -13.491 -6.369 1.00 0.00 C ATOM 0 H LEU B 46 -11.543 -12.304 -3.432 1.00 0.00 H new ATOM 0 HA LEU B 46 -13.787 -13.706 -2.473 1.00 0.00 H new ATOM 0 HB2 LEU B 46 -13.631 -11.991 -4.379 1.00 0.00 H new ATOM 0 HB3 LEU B 46 -12.933 -13.253 -5.375 1.00 0.00 H new ATOM 0 HG LEU B 46 -15.087 -14.636 -4.549 1.00 0.00 H new ATOM 0 HD11 LEU B 46 -17.058 -13.125 -4.355 1.00 0.00 H new ATOM 0 HD12 LEU B 46 -15.889 -12.825 -3.048 1.00 0.00 H new ATOM 0 HD13 LEU B 46 -15.978 -11.713 -4.435 1.00 0.00 H new ATOM 0 HD21 LEU B 46 -16.279 -13.862 -6.591 1.00 0.00 H new ATOM 0 HD22 LEU B 46 -15.201 -12.450 -6.682 1.00 0.00 H new ATOM 0 HD23 LEU B 46 -14.543 -14.088 -6.908 1.00 0.00 H new ATOM 957 N PHE B 47 -11.703 -15.476 -4.352 1.00 0.00 N ATOM 958 CA PHE B 47 -11.331 -16.841 -4.718 1.00 0.00 C ATOM 959 C PHE B 47 -10.841 -17.621 -3.501 1.00 0.00 C ATOM 960 O PHE B 47 -11.193 -18.786 -3.316 1.00 0.00 O ATOM 961 CB PHE B 47 -10.234 -16.815 -5.790 1.00 0.00 C ATOM 962 CG PHE B 47 -10.838 -16.399 -7.113 1.00 0.00 C ATOM 963 CD1 PHE B 47 -11.306 -15.092 -7.278 1.00 0.00 C ATOM 964 CD2 PHE B 47 -10.936 -17.316 -8.165 1.00 0.00 C ATOM 965 CE1 PHE B 47 -11.874 -14.698 -8.494 1.00 0.00 C ATOM 966 CE2 PHE B 47 -11.503 -16.924 -9.385 1.00 0.00 C ATOM 967 CZ PHE B 47 -11.971 -15.613 -9.548 1.00 0.00 C ATOM 0 H PHE B 47 -11.086 -14.754 -4.724 1.00 0.00 H new ATOM 0 HA PHE B 47 -12.216 -17.339 -5.113 1.00 0.00 H new ATOM 0 HB2 PHE B 47 -9.445 -16.120 -5.503 1.00 0.00 H new ATOM 0 HB3 PHE B 47 -9.774 -17.799 -5.880 1.00 0.00 H new ATOM 0 HD1 PHE B 47 -11.229 -14.385 -6.465 1.00 0.00 H new ATOM 0 HD2 PHE B 47 -10.575 -18.326 -8.037 1.00 0.00 H new ATOM 0 HE1 PHE B 47 -12.237 -13.689 -8.619 1.00 0.00 H new ATOM 0 HE2 PHE B 47 -11.579 -17.631 -10.198 1.00 0.00 H new ATOM 0 HZ PHE B 47 -12.407 -15.309 -10.488 1.00 0.00 H new ATOM 977 N PHE B 48 -10.019 -16.971 -2.676 1.00 0.00 N ATOM 978 CA PHE B 48 -9.471 -17.607 -1.474 1.00 0.00 C ATOM 979 C PHE B 48 -9.826 -16.798 -0.231 1.00 0.00 C ATOM 980 O PHE B 48 -9.694 -15.576 -0.219 1.00 0.00 O ATOM 981 CB PHE B 48 -7.950 -17.705 -1.598 1.00 0.00 C ATOM 982 CG PHE B 48 -7.596 -18.776 -2.604 1.00 0.00 C ATOM 983 CD1 PHE B 48 -7.549 -18.467 -3.968 1.00 0.00 C ATOM 984 CD2 PHE B 48 -7.322 -20.078 -2.170 1.00 0.00 C ATOM 985 CE1 PHE B 48 -7.226 -19.461 -4.900 1.00 0.00 C ATOM 986 CE2 PHE B 48 -7.000 -21.072 -3.102 1.00 0.00 C ATOM 987 CZ PHE B 48 -6.952 -20.764 -4.466 1.00 0.00 C ATOM 0 H PHE B 48 -9.718 -16.007 -2.816 1.00 0.00 H new ATOM 0 HA PHE B 48 -9.901 -18.604 -1.379 1.00 0.00 H new ATOM 0 HB2 PHE B 48 -7.537 -16.746 -1.911 1.00 0.00 H new ATOM 0 HB3 PHE B 48 -7.510 -17.941 -0.629 1.00 0.00 H new ATOM 0 HD1 PHE B 48 -7.762 -17.462 -4.302 1.00 0.00 H new ATOM 0 HD2 PHE B 48 -7.359 -20.316 -1.117 1.00 0.00 H new ATOM 0 HE1 PHE B 48 -7.188 -19.223 -5.953 1.00 0.00 H new ATOM 0 HE2 PHE B 48 -6.789 -22.077 -2.768 1.00 0.00 H new ATOM 0 HZ PHE B 48 -6.704 -21.531 -5.184 1.00 0.00 H new ATOM 997 N LYS B 49 -10.273 -17.488 0.810 1.00 0.00 N ATOM 998 CA LYS B 49 -10.644 -16.821 2.051 1.00 0.00 C ATOM 999 C LYS B 49 -9.401 -16.332 2.787 1.00 0.00 C ATOM 1000 O LYS B 49 -8.974 -17.013 3.704 1.00 0.00 O ATOM 1001 CB LYS B 49 -11.430 -17.782 2.945 1.00 0.00 C ATOM 1002 CG LYS B 49 -12.767 -18.116 2.278 1.00 0.00 C ATOM 1003 CD LYS B 49 -13.546 -19.095 3.160 1.00 0.00 C ATOM 1004 CE LYS B 49 -14.841 -19.500 2.453 1.00 0.00 C ATOM 1005 NZ LYS B 49 -15.735 -18.314 2.334 1.00 0.00 N ATOM 1006 OXT LYS B 49 -8.895 -15.284 2.422 1.00 0.00 O ATOM 0 H LYS B 49 -10.387 -18.502 0.821 1.00 0.00 H new ATOM 0 HA LYS B 49 -11.269 -15.961 1.809 1.00 0.00 H new ATOM 0 HB2 LYS B 49 -10.856 -18.694 3.111 1.00 0.00 H new ATOM 0 HB3 LYS B 49 -11.601 -17.330 3.922 1.00 0.00 H new ATOM 0 HG2 LYS B 49 -13.347 -17.206 2.126 1.00 0.00 H new ATOM 0 HG3 LYS B 49 -12.596 -18.553 1.294 1.00 0.00 H new ATOM 0 HD2 LYS B 49 -12.940 -19.977 3.365 1.00 0.00 H new ATOM 0 HD3 LYS B 49 -13.773 -18.634 4.121 1.00 0.00 H new ATOM 0 HE2 LYS B 49 -14.618 -19.901 1.464 1.00 0.00 H new ATOM 0 HE3 LYS B 49 -15.341 -20.291 3.012 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 -16.704 -18.629 2.126 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 -15.728 -17.783 3.228 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 -15.398 -17.701 1.564 1.00 0.00 H new TER 1020 LYS B 49 ATOM 1021 N SER C 19 12.651 23.463 -2.840 1.00 0.00 N ATOM 1022 CA SER C 19 13.127 22.169 -3.407 1.00 0.00 C ATOM 1023 C SER C 19 12.792 21.039 -2.439 1.00 0.00 C ATOM 1024 O SER C 19 11.731 20.422 -2.530 1.00 0.00 O ATOM 1025 CB SER C 19 14.638 22.235 -3.627 1.00 0.00 C ATOM 1026 OG SER C 19 14.925 23.209 -4.622 1.00 0.00 O ATOM 0 HA SER C 19 12.634 21.982 -4.361 1.00 0.00 H new ATOM 0 HB2 SER C 19 15.142 22.491 -2.695 1.00 0.00 H new ATOM 0 HB3 SER C 19 15.015 21.260 -3.936 1.00 0.00 H new ATOM 0 HG SER C 19 14.244 23.913 -4.596 1.00 0.00 H new ATOM 1034 N ASN C 20 13.709 20.771 -1.514 1.00 0.00 N ATOM 1035 CA ASN C 20 13.505 19.712 -0.532 1.00 0.00 C ATOM 1036 C ASN C 20 12.308 20.033 0.357 1.00 0.00 C ATOM 1037 O ASN C 20 11.517 19.150 0.692 1.00 0.00 O ATOM 1038 CB ASN C 20 14.759 19.554 0.331 1.00 0.00 C ATOM 1039 CG ASN C 20 15.901 18.974 -0.499 1.00 0.00 C ATOM 1040 OD1 ASN C 20 15.643 18.110 -1.443 1.00 0.00 O flip ATOM 1041 ND2 ASN C 20 17.063 19.313 -0.276 1.00 0.00 N flip ATOM 0 H ASN C 20 14.595 21.269 -1.424 1.00 0.00 H new ATOM 0 HA ASN C 20 13.310 18.780 -1.062 1.00 0.00 H new ATOM 0 HB2 ASN C 20 15.052 20.521 0.740 1.00 0.00 H new ATOM 0 HB3 ASN C 20 14.547 18.901 1.177 1.00 0.00 H new ATOM 0 HD21 ASN C 20 17.265 19.988 0.462 1.00 0.00 H new ATOM 0 HD22 ASN C 20 17.824 18.919 -0.829 1.00 0.00 H new ATOM 1048 N ASP C 21 12.183 21.301 0.738 1.00 0.00 N ATOM 1049 CA ASP C 21 11.078 21.728 1.589 1.00 0.00 C ATOM 1050 C ASP C 21 9.743 21.506 0.884 1.00 0.00 C ATOM 1051 O ASP C 21 8.766 21.083 1.500 1.00 0.00 O ATOM 1052 CB ASP C 21 11.231 23.208 1.940 1.00 0.00 C ATOM 1053 CG ASP C 21 10.097 23.647 2.859 1.00 0.00 C ATOM 1054 OD1 ASP C 21 9.200 22.852 3.081 1.00 0.00 O ATOM 1055 OD2 ASP C 21 10.142 24.773 3.328 1.00 0.00 O ATOM 0 H ASP C 21 12.828 22.045 0.473 1.00 0.00 H new ATOM 0 HA ASP C 21 11.097 21.134 2.503 1.00 0.00 H new ATOM 0 HB2 ASP C 21 12.191 23.377 2.428 1.00 0.00 H new ATOM 0 HB3 ASP C 21 11.226 23.808 1.030 1.00 0.00 H new ATOM 1060 N SER C 22 9.712 21.796 -0.414 1.00 0.00 N ATOM 1061 CA SER C 22 8.493 21.624 -1.197 1.00 0.00 C ATOM 1062 C SER C 22 8.060 20.162 -1.198 1.00 0.00 C ATOM 1063 O SER C 22 6.874 19.857 -1.063 1.00 0.00 O ATOM 1064 CB SER C 22 8.726 22.093 -2.633 1.00 0.00 C ATOM 1065 OG SER C 22 7.519 21.956 -3.372 1.00 0.00 O ATOM 0 H SER C 22 10.510 22.148 -0.942 1.00 0.00 H new ATOM 0 HA SER C 22 7.703 22.223 -0.744 1.00 0.00 H new ATOM 0 HB2 SER C 22 9.055 23.132 -2.640 1.00 0.00 H new ATOM 0 HB3 SER C 22 9.519 21.505 -3.096 1.00 0.00 H new ATOM 0 HG SER C 22 7.664 22.257 -4.293 1.00 0.00 H new ATOM 1071 N SER C 23 9.028 19.259 -1.351 1.00 0.00 N ATOM 1072 CA SER C 23 8.748 17.824 -1.367 1.00 0.00 C ATOM 1073 C SER C 23 9.795 17.075 -0.553 1.00 0.00 C ATOM 1074 O SER C 23 10.979 17.075 -0.893 1.00 0.00 O ATOM 1075 CB SER C 23 8.758 17.311 -2.808 1.00 0.00 C ATOM 1076 OG SER C 23 10.044 17.526 -3.372 1.00 0.00 O ATOM 0 H SER C 23 10.013 19.496 -1.466 1.00 0.00 H new ATOM 0 HA SER C 23 7.766 17.653 -0.927 1.00 0.00 H new ATOM 0 HB2 SER C 23 8.511 16.250 -2.830 1.00 0.00 H new ATOM 0 HB3 SER C 23 7.999 17.827 -3.396 1.00 0.00 H new ATOM 0 HG SER C 23 10.715 17.543 -2.658 1.00 0.00 H new ATOM 1082 N ASP C 24 9.351 16.442 0.526 1.00 0.00 N ATOM 1083 CA ASP C 24 10.258 15.693 1.394 1.00 0.00 C ATOM 1084 C ASP C 24 10.605 14.338 0.759 1.00 0.00 C ATOM 1085 O ASP C 24 9.827 13.801 -0.028 1.00 0.00 O ATOM 1086 CB ASP C 24 9.602 15.486 2.776 1.00 0.00 C ATOM 1087 CG ASP C 24 8.087 15.410 2.629 1.00 0.00 C ATOM 1088 OD1 ASP C 24 7.498 16.403 2.234 1.00 0.00 O ATOM 1089 OD2 ASP C 24 7.534 14.360 2.917 1.00 0.00 O ATOM 0 H ASP C 24 8.375 16.431 0.822 1.00 0.00 H new ATOM 0 HA ASP C 24 11.180 16.260 1.520 1.00 0.00 H new ATOM 0 HB2 ASP C 24 9.978 14.570 3.232 1.00 0.00 H new ATOM 0 HB3 ASP C 24 9.870 16.307 3.441 1.00 0.00 H new ATOM 1094 N PRO C 25 11.750 13.780 1.088 1.00 0.00 N ATOM 1095 CA PRO C 25 12.191 12.462 0.534 1.00 0.00 C ATOM 1096 C PRO C 25 11.296 11.314 1.007 1.00 0.00 C ATOM 1097 O PRO C 25 11.297 10.231 0.420 1.00 0.00 O ATOM 1098 CB PRO C 25 13.631 12.306 1.060 1.00 0.00 C ATOM 1099 CG PRO C 25 13.689 13.164 2.285 1.00 0.00 C ATOM 1100 CD PRO C 25 12.748 14.338 2.019 1.00 0.00 C ATOM 0 HA PRO C 25 12.132 12.430 -0.554 1.00 0.00 H new ATOM 0 HB2 PRO C 25 13.855 11.266 1.296 1.00 0.00 H new ATOM 0 HB3 PRO C 25 14.360 12.629 0.317 1.00 0.00 H new ATOM 0 HG2 PRO C 25 13.377 12.606 3.168 1.00 0.00 H new ATOM 0 HG3 PRO C 25 14.705 13.512 2.470 1.00 0.00 H new ATOM 0 HD2 PRO C 25 12.283 14.695 2.938 1.00 0.00 H new ATOM 0 HD3 PRO C 25 13.277 15.184 1.580 1.00 0.00 H new ATOM 1108 N LEU C 26 10.538 11.558 2.069 1.00 0.00 N ATOM 1109 CA LEU C 26 9.650 10.537 2.612 1.00 0.00 C ATOM 1110 C LEU C 26 8.597 10.138 1.584 1.00 0.00 C ATOM 1111 O LEU C 26 8.294 8.954 1.421 1.00 0.00 O ATOM 1112 CB LEU C 26 8.956 11.068 3.871 1.00 0.00 C ATOM 1113 CG LEU C 26 9.972 11.220 5.016 1.00 0.00 C ATOM 1114 CD1 LEU C 26 9.336 12.036 6.145 1.00 0.00 C ATOM 1115 CD2 LEU C 26 10.395 9.836 5.558 1.00 0.00 C ATOM 0 H LEU C 26 10.520 12.447 2.568 1.00 0.00 H new ATOM 0 HA LEU C 26 10.247 9.660 2.863 1.00 0.00 H new ATOM 0 HB2 LEU C 26 8.490 12.030 3.659 1.00 0.00 H new ATOM 0 HB3 LEU C 26 8.159 10.387 4.170 1.00 0.00 H new ATOM 0 HG LEU C 26 10.858 11.730 4.637 1.00 0.00 H new ATOM 0 HD11 LEU C 26 10.051 12.148 6.960 1.00 0.00 H new ATOM 0 HD12 LEU C 26 9.057 13.021 5.770 1.00 0.00 H new ATOM 0 HD13 LEU C 26 8.447 11.521 6.510 1.00 0.00 H new ATOM 0 HD21 LEU C 26 11.114 9.966 6.367 1.00 0.00 H new ATOM 0 HD22 LEU C 26 9.518 9.309 5.933 1.00 0.00 H new ATOM 0 HD23 LEU C 26 10.852 9.256 4.757 1.00 0.00 H new ATOM 1127 N VAL C 27 8.041 11.126 0.889 1.00 0.00 N ATOM 1128 CA VAL C 27 7.023 10.856 -0.121 1.00 0.00 C ATOM 1129 C VAL C 27 7.615 10.042 -1.270 1.00 0.00 C ATOM 1130 O VAL C 27 7.013 9.073 -1.732 1.00 0.00 O ATOM 1131 CB VAL C 27 6.457 12.173 -0.660 1.00 0.00 C ATOM 1132 CG1 VAL C 27 5.483 11.888 -1.808 1.00 0.00 C ATOM 1133 CG2 VAL C 27 5.720 12.903 0.465 1.00 0.00 C ATOM 0 H VAL C 27 8.275 12.112 1.005 1.00 0.00 H new ATOM 0 HA VAL C 27 6.220 10.282 0.341 1.00 0.00 H new ATOM 0 HB VAL C 27 7.273 12.794 -1.029 1.00 0.00 H new ATOM 0 HG11 VAL C 27 5.083 12.828 -2.188 1.00 0.00 H new ATOM 0 HG12 VAL C 27 6.007 11.367 -2.609 1.00 0.00 H new ATOM 0 HG13 VAL C 27 4.665 11.266 -1.445 1.00 0.00 H new ATOM 0 HG21 VAL C 27 5.315 13.841 0.086 1.00 0.00 H new ATOM 0 HG22 VAL C 27 4.905 12.278 0.832 1.00 0.00 H new ATOM 0 HG23 VAL C 27 6.414 13.110 1.280 1.00 0.00 H new ATOM 1143 N VAL C 28 8.798 10.444 -1.723 1.00 0.00 N ATOM 1144 CA VAL C 28 9.468 9.747 -2.816 1.00 0.00 C ATOM 1145 C VAL C 28 9.817 8.319 -2.408 1.00 0.00 C ATOM 1146 O VAL C 28 9.611 7.378 -3.173 1.00 0.00 O ATOM 1147 CB VAL C 28 10.746 10.496 -3.205 1.00 0.00 C ATOM 1148 CG1 VAL C 28 11.497 9.706 -4.278 1.00 0.00 C ATOM 1149 CG2 VAL C 28 10.380 11.877 -3.749 1.00 0.00 C ATOM 0 H VAL C 28 9.311 11.244 -1.353 1.00 0.00 H new ATOM 0 HA VAL C 28 8.791 9.713 -3.670 1.00 0.00 H new ATOM 0 HB VAL C 28 11.383 10.608 -2.327 1.00 0.00 H new ATOM 0 HG11 VAL C 28 12.406 10.240 -4.554 1.00 0.00 H new ATOM 0 HG12 VAL C 28 11.758 8.722 -3.889 1.00 0.00 H new ATOM 0 HG13 VAL C 28 10.862 9.592 -5.157 1.00 0.00 H new ATOM 0 HG21 VAL C 28 11.289 12.411 -4.026 1.00 0.00 H new ATOM 0 HG22 VAL C 28 9.743 11.765 -4.626 1.00 0.00 H new ATOM 0 HG23 VAL C 28 9.847 12.440 -2.983 1.00 0.00 H new ATOM 1159 N ALA C 29 10.349 8.165 -1.197 1.00 0.00 N ATOM 1160 CA ALA C 29 10.725 6.846 -0.702 1.00 0.00 C ATOM 1161 C ALA C 29 9.503 5.941 -0.601 1.00 0.00 C ATOM 1162 O ALA C 29 9.564 4.760 -0.940 1.00 0.00 O ATOM 1163 CB ALA C 29 11.379 6.971 0.675 1.00 0.00 C ATOM 0 H ALA C 29 10.527 8.931 -0.547 1.00 0.00 H new ATOM 0 HA ALA C 29 11.433 6.406 -1.404 1.00 0.00 H new ATOM 0 HB1 ALA C 29 11.657 5.981 1.037 1.00 0.00 H new ATOM 0 HB2 ALA C 29 12.271 7.593 0.599 1.00 0.00 H new ATOM 0 HB3 ALA C 29 10.676 7.428 1.371 1.00 0.00 H new ATOM 1169 N ALA C 30 8.392 6.500 -0.136 1.00 0.00 N ATOM 1170 CA ALA C 30 7.167 5.726 0.000 1.00 0.00 C ATOM 1171 C ALA C 30 6.679 5.257 -1.366 1.00 0.00 C ATOM 1172 O ALA C 30 6.232 4.121 -1.520 1.00 0.00 O ATOM 1173 CB ALA C 30 6.082 6.572 0.668 1.00 0.00 C ATOM 0 H ALA C 30 8.315 7.476 0.150 1.00 0.00 H new ATOM 0 HA ALA C 30 7.378 4.854 0.620 1.00 0.00 H new ATOM 0 HB1 ALA C 30 5.170 5.983 0.765 1.00 0.00 H new ATOM 0 HB2 ALA C 30 6.420 6.883 1.657 1.00 0.00 H new ATOM 0 HB3 ALA C 30 5.882 7.454 0.059 1.00 0.00 H new ATOM 1179 N ASN C 31 6.770 6.139 -2.356 1.00 0.00 N ATOM 1180 CA ASN C 31 6.335 5.798 -3.703 1.00 0.00 C ATOM 1181 C ASN C 31 7.206 4.688 -4.289 1.00 0.00 C ATOM 1182 O ASN C 31 6.697 3.740 -4.880 1.00 0.00 O ATOM 1183 CB ASN C 31 6.411 7.034 -4.603 1.00 0.00 C ATOM 1184 CG ASN C 31 5.994 6.673 -6.025 1.00 0.00 C ATOM 1185 OD1 ASN C 31 5.729 5.506 -6.318 1.00 0.00 O ATOM 1186 ND2 ASN C 31 5.921 7.609 -6.930 1.00 0.00 N ATOM 0 H ASN C 31 7.137 7.085 -2.252 1.00 0.00 H new ATOM 0 HA ASN C 31 5.305 5.445 -3.651 1.00 0.00 H new ATOM 0 HB2 ASN C 31 5.762 7.818 -4.213 1.00 0.00 H new ATOM 0 HB3 ASN C 31 7.426 7.432 -4.603 1.00 0.00 H new ATOM 0 HD21 ASN C 31 5.644 7.376 -7.884 1.00 0.00 H new ATOM 0 HD22 ASN C 31 6.141 8.574 -6.684 1.00 0.00 H new ATOM 1193 N ILE C 32 8.519 4.813 -4.125 1.00 0.00 N ATOM 1194 CA ILE C 32 9.441 3.811 -4.652 1.00 0.00 C ATOM 1195 C ILE C 32 9.232 2.469 -3.951 1.00 0.00 C ATOM 1196 O ILE C 32 9.183 1.421 -4.595 1.00 0.00 O ATOM 1197 CB ILE C 32 10.885 4.283 -4.454 1.00 0.00 C ATOM 1198 CG1 ILE C 32 11.139 5.508 -5.338 1.00 0.00 C ATOM 1199 CG2 ILE C 32 11.854 3.164 -4.851 1.00 0.00 C ATOM 1200 CD1 ILE C 32 12.462 6.163 -4.938 1.00 0.00 C ATOM 0 H ILE C 32 8.966 5.589 -3.637 1.00 0.00 H new ATOM 0 HA ILE C 32 9.245 3.681 -5.716 1.00 0.00 H new ATOM 0 HB ILE C 32 11.042 4.542 -3.407 1.00 0.00 H new ATOM 0 HG12 ILE C 32 11.170 5.212 -6.387 1.00 0.00 H new ATOM 0 HG13 ILE C 32 10.322 6.221 -5.232 1.00 0.00 H new ATOM 0 HG21 ILE C 32 12.880 3.504 -4.709 1.00 0.00 H new ATOM 0 HG22 ILE C 32 11.672 2.288 -4.229 1.00 0.00 H new ATOM 0 HG23 ILE C 32 11.700 2.904 -5.898 1.00 0.00 H new ATOM 0 HD11 ILE C 32 12.642 7.034 -5.568 1.00 0.00 H new ATOM 0 HD12 ILE C 32 12.413 6.473 -3.894 1.00 0.00 H new ATOM 0 HD13 ILE C 32 13.275 5.449 -5.067 1.00 0.00 H new ATOM 1212 N ILE C 33 9.099 2.516 -2.631 1.00 0.00 N ATOM 1213 CA ILE C 33 8.886 1.306 -1.844 1.00 0.00 C ATOM 1214 C ILE C 33 7.548 0.658 -2.197 1.00 0.00 C ATOM 1215 O ILE C 33 7.459 -0.559 -2.353 1.00 0.00 O ATOM 1216 CB ILE C 33 8.938 1.648 -0.352 1.00 0.00 C ATOM 1217 CG1 ILE C 33 10.373 2.029 0.026 1.00 0.00 C ATOM 1218 CG2 ILE C 33 8.485 0.447 0.480 1.00 0.00 C ATOM 1219 CD1 ILE C 33 10.390 2.640 1.426 1.00 0.00 C ATOM 0 H ILE C 33 9.135 3.376 -2.084 1.00 0.00 H new ATOM 0 HA ILE C 33 9.676 0.592 -2.075 1.00 0.00 H new ATOM 0 HB ILE C 33 8.270 2.485 -0.150 1.00 0.00 H new ATOM 0 HG12 ILE C 33 11.014 1.148 -0.005 1.00 0.00 H new ATOM 0 HG13 ILE C 33 10.773 2.740 -0.697 1.00 0.00 H new ATOM 0 HG21 ILE C 33 8.526 0.702 1.539 1.00 0.00 H new ATOM 0 HG22 ILE C 33 7.463 0.182 0.210 1.00 0.00 H new ATOM 0 HG23 ILE C 33 9.143 -0.400 0.285 1.00 0.00 H new ATOM 0 HD11 ILE C 33 11.412 2.910 1.693 1.00 0.00 H new ATOM 0 HD12 ILE C 33 9.763 3.532 1.442 1.00 0.00 H new ATOM 0 HD13 ILE C 33 10.007 1.915 2.144 1.00 0.00 H new ATOM 1231 N GLY C 34 6.508 1.479 -2.319 1.00 0.00 N ATOM 1232 CA GLY C 34 5.181 0.968 -2.649 1.00 0.00 C ATOM 1233 C GLY C 34 5.172 0.316 -4.029 1.00 0.00 C ATOM 1234 O GLY C 34 4.578 -0.747 -4.222 1.00 0.00 O ATOM 0 H GLY C 34 6.557 2.490 -2.196 1.00 0.00 H new ATOM 0 HA2 GLY C 34 4.870 0.242 -1.898 1.00 0.00 H new ATOM 0 HA3 GLY C 34 4.457 1.783 -2.623 1.00 0.00 H new ATOM 1238 N ILE C 35 5.835 0.954 -4.984 1.00 0.00 N ATOM 1239 CA ILE C 35 5.894 0.420 -6.340 1.00 0.00 C ATOM 1240 C ILE C 35 6.632 -0.919 -6.341 1.00 0.00 C ATOM 1241 O ILE C 35 6.199 -1.877 -6.983 1.00 0.00 O ATOM 1242 CB ILE C 35 6.621 1.419 -7.258 1.00 0.00 C ATOM 1243 CG1 ILE C 35 5.769 2.700 -7.432 1.00 0.00 C ATOM 1244 CG2 ILE C 35 6.896 0.768 -8.622 1.00 0.00 C ATOM 1245 CD1 ILE C 35 4.725 2.539 -8.547 1.00 0.00 C ATOM 0 H ILE C 35 6.335 1.833 -4.849 1.00 0.00 H new ATOM 0 HA ILE C 35 4.880 0.265 -6.709 1.00 0.00 H new ATOM 0 HB ILE C 35 7.572 1.696 -6.803 1.00 0.00 H new ATOM 0 HG12 ILE C 35 5.266 2.933 -6.493 1.00 0.00 H new ATOM 0 HG13 ILE C 35 6.421 3.543 -7.662 1.00 0.00 H new ATOM 0 HG21 ILE C 35 7.411 1.480 -9.268 1.00 0.00 H new ATOM 0 HG22 ILE C 35 7.520 -0.115 -8.485 1.00 0.00 H new ATOM 0 HG23 ILE C 35 5.952 0.477 -9.083 1.00 0.00 H new ATOM 0 HD11 ILE C 35 4.147 3.458 -8.639 1.00 0.00 H new ATOM 0 HD12 ILE C 35 5.230 2.331 -9.491 1.00 0.00 H new ATOM 0 HD13 ILE C 35 4.057 1.713 -8.303 1.00 0.00 H new ATOM 1257 N LEU C 36 7.744 -0.978 -5.612 1.00 0.00 N ATOM 1258 CA LEU C 36 8.534 -2.204 -5.531 1.00 0.00 C ATOM 1259 C LEU C 36 7.698 -3.322 -4.930 1.00 0.00 C ATOM 1260 O LEU C 36 7.798 -4.478 -5.342 1.00 0.00 O ATOM 1261 CB LEU C 36 9.789 -1.978 -4.678 1.00 0.00 C ATOM 1262 CG LEU C 36 10.635 -3.263 -4.611 1.00 0.00 C ATOM 1263 CD1 LEU C 36 11.068 -3.698 -6.022 1.00 0.00 C ATOM 1264 CD2 LEU C 36 11.878 -2.995 -3.753 1.00 0.00 C ATOM 0 H LEU C 36 8.117 -0.197 -5.072 1.00 0.00 H new ATOM 0 HA LEU C 36 8.841 -2.486 -6.538 1.00 0.00 H new ATOM 0 HB2 LEU C 36 10.382 -1.167 -5.101 1.00 0.00 H new ATOM 0 HB3 LEU C 36 9.502 -1.672 -3.672 1.00 0.00 H new ATOM 0 HG LEU C 36 10.039 -4.062 -4.170 1.00 0.00 H new ATOM 0 HD11 LEU C 36 11.665 -4.608 -5.955 1.00 0.00 H new ATOM 0 HD12 LEU C 36 10.184 -3.888 -6.631 1.00 0.00 H new ATOM 0 HD13 LEU C 36 11.662 -2.907 -6.480 1.00 0.00 H new ATOM 0 HD21 LEU C 36 12.485 -3.899 -3.699 1.00 0.00 H new ATOM 0 HD22 LEU C 36 12.463 -2.192 -4.201 1.00 0.00 H new ATOM 0 HD23 LEU C 36 11.571 -2.703 -2.749 1.00 0.00 H new ATOM 1276 N HIS C 37 6.866 -2.972 -3.955 1.00 0.00 N ATOM 1277 CA HIS C 37 6.019 -3.961 -3.314 1.00 0.00 C ATOM 1278 C HIS C 37 5.153 -4.647 -4.359 1.00 0.00 C ATOM 1279 O HIS C 37 4.977 -5.864 -4.326 1.00 0.00 O ATOM 1280 CB HIS C 37 5.116 -3.296 -2.278 1.00 0.00 C ATOM 1281 CG HIS C 37 4.260 -4.350 -1.631 1.00 0.00 C ATOM 1282 ND1 HIS C 37 4.342 -4.640 -0.281 1.00 0.00 N ATOM 1283 CD2 HIS C 37 3.317 -5.206 -2.139 1.00 0.00 C ATOM 1284 CE1 HIS C 37 3.473 -5.634 -0.028 1.00 0.00 C ATOM 1285 NE2 HIS C 37 2.821 -6.015 -1.125 1.00 0.00 N ATOM 0 H HIS C 37 6.763 -2.022 -3.597 1.00 0.00 H new ATOM 0 HA HIS C 37 6.655 -4.694 -2.818 1.00 0.00 H new ATOM 0 HB2 HIS C 37 5.717 -2.785 -1.526 1.00 0.00 H new ATOM 0 HB3 HIS C 37 4.490 -2.541 -2.753 1.00 0.00 H new ATOM 0 HD2 HIS C 37 3.007 -5.245 -3.173 1.00 0.00 H new ATOM 0 HE1 HIS C 37 3.322 -6.071 0.948 1.00 0.00 H new ATOM 0 HE2 HIS C 37 2.111 -6.743 -1.203 1.00 0.00 H new ATOM 1293 N LEU C 38 4.613 -3.864 -5.288 1.00 0.00 N ATOM 1294 CA LEU C 38 3.764 -4.424 -6.336 1.00 0.00 C ATOM 1295 C LEU C 38 4.541 -5.409 -7.201 1.00 0.00 C ATOM 1296 O LEU C 38 4.001 -6.429 -7.621 1.00 0.00 O ATOM 1297 CB LEU C 38 3.161 -3.303 -7.217 1.00 0.00 C ATOM 1298 CG LEU C 38 1.810 -2.834 -6.643 1.00 0.00 C ATOM 1299 CD1 LEU C 38 1.427 -1.481 -7.254 1.00 0.00 C ATOM 1300 CD2 LEU C 38 0.709 -3.865 -6.970 1.00 0.00 C ATOM 0 H LEU C 38 4.745 -2.854 -5.338 1.00 0.00 H new ATOM 0 HA LEU C 38 2.949 -4.960 -5.849 1.00 0.00 H new ATOM 0 HB2 LEU C 38 3.852 -2.462 -7.269 1.00 0.00 H new ATOM 0 HB3 LEU C 38 3.024 -3.667 -8.235 1.00 0.00 H new ATOM 0 HG LEU C 38 1.905 -2.735 -5.562 1.00 0.00 H new ATOM 0 HD11 LEU C 38 0.471 -1.154 -6.845 1.00 0.00 H new ATOM 0 HD12 LEU C 38 2.194 -0.744 -7.016 1.00 0.00 H new ATOM 0 HD13 LEU C 38 1.343 -1.581 -8.336 1.00 0.00 H new ATOM 0 HD21 LEU C 38 -0.242 -3.524 -6.560 1.00 0.00 H new ATOM 0 HD22 LEU C 38 0.620 -3.972 -8.051 1.00 0.00 H new ATOM 0 HD23 LEU C 38 0.970 -4.828 -6.530 1.00 0.00 H new ATOM 1312 N ILE C 39 5.794 -5.106 -7.484 1.00 0.00 N ATOM 1313 CA ILE C 39 6.586 -5.996 -8.318 1.00 0.00 C ATOM 1314 C ILE C 39 6.636 -7.398 -7.706 1.00 0.00 C ATOM 1315 O ILE C 39 6.359 -8.385 -8.385 1.00 0.00 O ATOM 1316 CB ILE C 39 8.007 -5.443 -8.452 1.00 0.00 C ATOM 1317 CG1 ILE C 39 7.956 -3.993 -8.960 1.00 0.00 C ATOM 1318 CG2 ILE C 39 8.817 -6.309 -9.421 1.00 0.00 C ATOM 1319 CD1 ILE C 39 7.164 -3.900 -10.270 1.00 0.00 C ATOM 0 H ILE C 39 6.279 -4.270 -7.158 1.00 0.00 H new ATOM 0 HA ILE C 39 6.123 -6.060 -9.303 1.00 0.00 H new ATOM 0 HB ILE C 39 8.490 -5.461 -7.475 1.00 0.00 H new ATOM 0 HG12 ILE C 39 7.495 -3.355 -8.206 1.00 0.00 H new ATOM 0 HG13 ILE C 39 8.969 -3.622 -9.116 1.00 0.00 H new ATOM 0 HG21 ILE C 39 9.827 -5.908 -9.510 1.00 0.00 H new ATOM 0 HG22 ILE C 39 8.864 -7.331 -9.044 1.00 0.00 H new ATOM 0 HG23 ILE C 39 8.337 -6.306 -10.400 1.00 0.00 H new ATOM 0 HD11 ILE C 39 7.142 -2.864 -10.609 1.00 0.00 H new ATOM 0 HD12 ILE C 39 7.641 -4.520 -11.029 1.00 0.00 H new ATOM 0 HD13 ILE C 39 6.145 -4.249 -10.105 1.00 0.00 H new ATOM 1331 N LEU C 40 6.988 -7.480 -6.425 1.00 0.00 N ATOM 1332 CA LEU C 40 7.063 -8.774 -5.748 1.00 0.00 C ATOM 1333 C LEU C 40 5.672 -9.392 -5.549 1.00 0.00 C ATOM 1334 O LEU C 40 5.483 -10.591 -5.757 1.00 0.00 O ATOM 1335 CB LEU C 40 7.762 -8.608 -4.389 1.00 0.00 C ATOM 1336 CG LEU C 40 9.278 -8.543 -4.594 1.00 0.00 C ATOM 1337 CD1 LEU C 40 9.620 -7.368 -5.516 1.00 0.00 C ATOM 1338 CD2 LEU C 40 9.969 -8.349 -3.240 1.00 0.00 C ATOM 0 H LEU C 40 7.223 -6.678 -5.841 1.00 0.00 H new ATOM 0 HA LEU C 40 7.639 -9.451 -6.379 1.00 0.00 H new ATOM 0 HB2 LEU C 40 7.412 -7.700 -3.898 1.00 0.00 H new ATOM 0 HB3 LEU C 40 7.509 -9.442 -3.735 1.00 0.00 H new ATOM 0 HG LEU C 40 9.623 -9.472 -5.048 1.00 0.00 H new ATOM 0 HD11 LEU C 40 10.699 -7.322 -5.662 1.00 0.00 H new ATOM 0 HD12 LEU C 40 9.129 -7.507 -6.479 1.00 0.00 H new ATOM 0 HD13 LEU C 40 9.275 -6.438 -5.064 1.00 0.00 H new ATOM 0 HD21 LEU C 40 11.048 -8.303 -3.386 1.00 0.00 H new ATOM 0 HD22 LEU C 40 9.624 -7.420 -2.785 1.00 0.00 H new ATOM 0 HD23 LEU C 40 9.727 -9.186 -2.585 1.00 0.00 H new ATOM 1350 N TRP C 41 4.711 -8.573 -5.134 1.00 0.00 N ATOM 1351 CA TRP C 41 3.348 -9.058 -4.897 1.00 0.00 C ATOM 1352 C TRP C 41 2.714 -9.555 -6.196 1.00 0.00 C ATOM 1353 O TRP C 41 2.021 -10.576 -6.213 1.00 0.00 O ATOM 1354 CB TRP C 41 2.505 -7.950 -4.257 1.00 0.00 C ATOM 1355 CG TRP C 41 1.097 -8.417 -4.050 1.00 0.00 C ATOM 1356 CD1 TRP C 41 0.653 -9.143 -2.994 1.00 0.00 C ATOM 1357 CD2 TRP C 41 -0.074 -8.137 -4.867 1.00 0.00 C ATOM 1358 NE1 TRP C 41 -0.706 -9.359 -3.140 1.00 0.00 N ATOM 1359 CE2 TRP C 41 -1.200 -8.750 -4.274 1.00 0.00 C ATOM 1360 CE3 TRP C 41 -0.263 -7.423 -6.061 1.00 0.00 C ATOM 1361 CZ2 TRP C 41 -2.466 -8.657 -4.847 1.00 0.00 C ATOM 1362 CZ3 TRP C 41 -1.537 -7.323 -6.635 1.00 0.00 C ATOM 1363 CH2 TRP C 41 -2.633 -7.938 -6.029 1.00 0.00 C ATOM 0 H TRP C 41 4.845 -7.578 -4.955 1.00 0.00 H new ATOM 0 HA TRP C 41 3.389 -9.902 -4.209 1.00 0.00 H new ATOM 0 HB2 TRP C 41 2.942 -7.658 -3.302 1.00 0.00 H new ATOM 0 HB3 TRP C 41 2.511 -7.066 -4.894 1.00 0.00 H new ATOM 0 HD1 TRP C 41 1.261 -9.495 -2.173 1.00 0.00 H new ATOM 0 HE1 TRP C 41 -1.273 -9.902 -2.489 1.00 0.00 H new ATOM 0 HE3 TRP C 41 0.580 -6.947 -6.540 1.00 0.00 H new ATOM 0 HZ2 TRP C 41 -3.312 -9.138 -4.379 1.00 0.00 H new ATOM 0 HZ3 TRP C 41 -1.671 -6.767 -7.551 1.00 0.00 H new ATOM 0 HH2 TRP C 41 -3.612 -7.857 -6.477 1.00 0.00 H new ATOM 1374 N ILE C 42 2.971 -8.841 -7.288 1.00 0.00 N ATOM 1375 CA ILE C 42 2.432 -9.230 -8.589 1.00 0.00 C ATOM 1376 C ILE C 42 2.971 -10.606 -8.978 1.00 0.00 C ATOM 1377 O ILE C 42 2.225 -11.471 -9.433 1.00 0.00 O ATOM 1378 CB ILE C 42 2.833 -8.180 -9.645 1.00 0.00 C ATOM 1379 CG1 ILE C 42 1.934 -6.946 -9.506 1.00 0.00 C ATOM 1380 CG2 ILE C 42 2.686 -8.756 -11.062 1.00 0.00 C ATOM 1381 CD1 ILE C 42 2.550 -5.777 -10.275 1.00 0.00 C ATOM 0 H ILE C 42 3.544 -7.997 -7.300 1.00 0.00 H new ATOM 0 HA ILE C 42 1.345 -9.282 -8.535 1.00 0.00 H new ATOM 0 HB ILE C 42 3.875 -7.903 -9.483 1.00 0.00 H new ATOM 0 HG12 ILE C 42 0.938 -7.164 -9.891 1.00 0.00 H new ATOM 0 HG13 ILE C 42 1.819 -6.683 -8.454 1.00 0.00 H new ATOM 0 HG21 ILE C 42 2.973 -8.001 -11.793 1.00 0.00 H new ATOM 0 HG22 ILE C 42 3.331 -9.628 -11.169 1.00 0.00 H new ATOM 0 HG23 ILE C 42 1.649 -9.048 -11.230 1.00 0.00 H new ATOM 0 HD11 ILE C 42 1.911 -4.900 -10.176 1.00 0.00 H new ATOM 0 HD12 ILE C 42 3.537 -5.555 -9.870 1.00 0.00 H new ATOM 0 HD13 ILE C 42 2.642 -6.042 -11.328 1.00 0.00 H new ATOM 1393 N LEU C 43 4.270 -10.799 -8.785 1.00 0.00 N ATOM 1394 CA LEU C 43 4.901 -12.071 -9.112 1.00 0.00 C ATOM 1395 C LEU C 43 4.316 -13.185 -8.253 1.00 0.00 C ATOM 1396 O LEU C 43 4.101 -14.298 -8.729 1.00 0.00 O ATOM 1397 CB LEU C 43 6.412 -11.983 -8.888 1.00 0.00 C ATOM 1398 CG LEU C 43 7.046 -11.043 -9.928 1.00 0.00 C ATOM 1399 CD1 LEU C 43 8.481 -10.723 -9.501 1.00 0.00 C ATOM 1400 CD2 LEU C 43 7.060 -11.704 -11.325 1.00 0.00 C ATOM 0 H LEU C 43 4.904 -10.095 -8.406 1.00 0.00 H new ATOM 0 HA LEU C 43 4.710 -12.295 -10.161 1.00 0.00 H new ATOM 0 HB2 LEU C 43 6.618 -11.617 -7.882 1.00 0.00 H new ATOM 0 HB3 LEU C 43 6.857 -12.975 -8.964 1.00 0.00 H new ATOM 0 HG LEU C 43 6.457 -10.128 -9.984 1.00 0.00 H new ATOM 0 HD11 LEU C 43 8.938 -10.057 -10.233 1.00 0.00 H new ATOM 0 HD12 LEU C 43 8.471 -10.238 -8.525 1.00 0.00 H new ATOM 0 HD13 LEU C 43 9.057 -11.646 -9.441 1.00 0.00 H new ATOM 0 HD21 LEU C 43 7.512 -11.023 -12.045 1.00 0.00 H new ATOM 0 HD22 LEU C 43 7.639 -12.627 -11.285 1.00 0.00 H new ATOM 0 HD23 LEU C 43 6.038 -11.930 -11.631 1.00 0.00 H new ATOM 1412 N ASP C 44 4.057 -12.881 -6.985 1.00 0.00 N ATOM 1413 CA ASP C 44 3.496 -13.875 -6.077 1.00 0.00 C ATOM 1414 C ASP C 44 2.238 -14.485 -6.686 1.00 0.00 C ATOM 1415 O ASP C 44 2.031 -15.695 -6.622 1.00 0.00 O ATOM 1416 CB ASP C 44 3.152 -13.227 -4.732 1.00 0.00 C ATOM 1417 CG ASP C 44 2.733 -14.298 -3.728 1.00 0.00 C ATOM 1418 OD1 ASP C 44 2.587 -15.440 -4.134 1.00 0.00 O ATOM 1419 OD2 ASP C 44 2.566 -13.960 -2.567 1.00 0.00 O ATOM 0 H ASP C 44 4.224 -11.966 -6.567 1.00 0.00 H new ATOM 0 HA ASP C 44 4.236 -14.659 -5.917 1.00 0.00 H new ATOM 0 HB2 ASP C 44 4.014 -12.678 -4.352 1.00 0.00 H new ATOM 0 HB3 ASP C 44 2.347 -12.504 -4.863 1.00 0.00 H new ATOM 1424 N ARG C 45 1.405 -13.638 -7.282 1.00 0.00 N ATOM 1425 CA ARG C 45 0.174 -14.107 -7.909 1.00 0.00 C ATOM 1426 C ARG C 45 0.477 -15.101 -9.029 1.00 0.00 C ATOM 1427 O ARG C 45 -0.295 -16.027 -9.273 1.00 0.00 O ATOM 1428 CB ARG C 45 -0.616 -12.926 -8.482 1.00 0.00 C ATOM 1429 CG ARG C 45 -1.217 -12.104 -7.343 1.00 0.00 C ATOM 1430 CD ARG C 45 -1.919 -10.877 -7.924 1.00 0.00 C ATOM 1431 NE ARG C 45 -2.992 -11.290 -8.825 1.00 0.00 N ATOM 1432 CZ ARG C 45 -4.215 -11.562 -8.373 1.00 0.00 C ATOM 1433 NH1 ARG C 45 -4.476 -11.471 -7.100 1.00 0.00 N ATOM 1434 NH2 ARG C 45 -5.150 -11.921 -9.210 1.00 0.00 N ATOM 0 H ARG C 45 1.558 -12.631 -7.344 1.00 0.00 H new ATOM 0 HA ARG C 45 -0.421 -14.606 -7.144 1.00 0.00 H new ATOM 0 HB2 ARG C 45 0.038 -12.300 -9.089 1.00 0.00 H new ATOM 0 HB3 ARG C 45 -1.408 -13.290 -9.137 1.00 0.00 H new ATOM 0 HG2 ARG C 45 -1.925 -12.709 -6.777 1.00 0.00 H new ATOM 0 HG3 ARG C 45 -0.435 -11.796 -6.649 1.00 0.00 H new ATOM 0 HD2 ARG C 45 -2.326 -10.266 -7.118 1.00 0.00 H new ATOM 0 HD3 ARG C 45 -1.200 -10.258 -8.462 1.00 0.00 H new ATOM 0 HE ARG C 45 -2.800 -11.372 -9.823 1.00 0.00 H new ATOM 0 HH11 ARG C 45 -3.743 -11.191 -6.448 1.00 0.00 H new ATOM 0 HH12 ARG C 45 -5.413 -11.680 -6.755 1.00 0.00 H new ATOM 0 HH21 ARG C 45 -4.943 -11.992 -10.206 1.00 0.00 H new ATOM 0 HH22 ARG C 45 -6.088 -12.130 -8.868 1.00 0.00 H new ATOM 1448 N LEU C 46 1.594 -14.898 -9.718 1.00 0.00 N ATOM 1449 CA LEU C 46 1.964 -15.781 -10.821 1.00 0.00 C ATOM 1450 C LEU C 46 2.153 -17.215 -10.319 1.00 0.00 C ATOM 1451 O LEU C 46 1.637 -18.162 -10.913 1.00 0.00 O ATOM 1452 CB LEU C 46 3.273 -15.293 -11.452 1.00 0.00 C ATOM 1453 CG LEU C 46 3.549 -16.046 -12.773 1.00 0.00 C ATOM 1454 CD1 LEU C 46 2.880 -15.308 -13.935 1.00 0.00 C ATOM 1455 CD2 LEU C 46 5.058 -16.113 -13.034 1.00 0.00 C ATOM 0 H LEU C 46 2.253 -14.140 -9.537 1.00 0.00 H new ATOM 0 HA LEU C 46 1.165 -15.766 -11.562 1.00 0.00 H new ATOM 0 HB2 LEU C 46 3.215 -14.221 -11.642 1.00 0.00 H new ATOM 0 HB3 LEU C 46 4.099 -15.449 -10.758 1.00 0.00 H new ATOM 0 HG LEU C 46 3.147 -17.056 -12.692 1.00 0.00 H new ATOM 0 HD11 LEU C 46 3.076 -15.841 -14.865 1.00 0.00 H new ATOM 0 HD12 LEU C 46 1.805 -15.259 -13.764 1.00 0.00 H new ATOM 0 HD13 LEU C 46 3.282 -14.297 -14.004 1.00 0.00 H new ATOM 0 HD21 LEU C 46 5.243 -16.645 -13.967 1.00 0.00 H new ATOM 0 HD22 LEU C 46 5.460 -15.102 -13.107 1.00 0.00 H new ATOM 0 HD23 LEU C 46 5.546 -16.639 -12.213 1.00 0.00 H new ATOM 1467 N PHE C 47 2.894 -17.366 -9.222 1.00 0.00 N ATOM 1468 CA PHE C 47 3.141 -18.690 -8.649 1.00 0.00 C ATOM 1469 C PHE C 47 1.863 -19.279 -8.059 1.00 0.00 C ATOM 1470 O PHE C 47 1.576 -20.462 -8.237 1.00 0.00 O ATOM 1471 CB PHE C 47 4.216 -18.591 -7.560 1.00 0.00 C ATOM 1472 CG PHE C 47 5.566 -18.385 -8.208 1.00 0.00 C ATOM 1473 CD1 PHE C 47 5.843 -17.182 -8.862 1.00 0.00 C ATOM 1474 CD2 PHE C 47 6.536 -19.396 -8.164 1.00 0.00 C ATOM 1475 CE1 PHE C 47 7.085 -16.983 -9.472 1.00 0.00 C ATOM 1476 CE2 PHE C 47 7.781 -19.199 -8.772 1.00 0.00 C ATOM 1477 CZ PHE C 47 8.056 -17.991 -9.427 1.00 0.00 C ATOM 0 H PHE C 47 3.331 -16.596 -8.715 1.00 0.00 H new ATOM 0 HA PHE C 47 3.486 -19.349 -9.446 1.00 0.00 H new ATOM 0 HB2 PHE C 47 3.993 -17.763 -6.887 1.00 0.00 H new ATOM 0 HB3 PHE C 47 4.224 -19.499 -6.957 1.00 0.00 H new ATOM 0 HD1 PHE C 47 5.095 -16.403 -8.896 1.00 0.00 H new ATOM 0 HD2 PHE C 47 6.322 -20.327 -7.661 1.00 0.00 H new ATOM 0 HE1 PHE C 47 7.296 -16.052 -9.978 1.00 0.00 H new ATOM 0 HE2 PHE C 47 8.529 -19.977 -8.736 1.00 0.00 H new ATOM 0 HZ PHE C 47 9.016 -17.838 -9.897 1.00 0.00 H new ATOM 1487 N PHE C 48 1.101 -18.446 -7.350 1.00 0.00 N ATOM 1488 CA PHE C 48 -0.149 -18.887 -6.722 1.00 0.00 C ATOM 1489 C PHE C 48 -1.318 -18.034 -7.204 1.00 0.00 C ATOM 1490 O PHE C 48 -1.224 -16.811 -7.255 1.00 0.00 O ATOM 1491 CB PHE C 48 -0.026 -18.770 -5.202 1.00 0.00 C ATOM 1492 CG PHE C 48 0.885 -19.860 -4.687 1.00 0.00 C ATOM 1493 CD1 PHE C 48 2.272 -19.665 -4.675 1.00 0.00 C ATOM 1494 CD2 PHE C 48 0.341 -21.064 -4.227 1.00 0.00 C ATOM 1495 CE1 PHE C 48 3.115 -20.677 -4.202 1.00 0.00 C ATOM 1496 CE2 PHE C 48 1.184 -22.076 -3.754 1.00 0.00 C ATOM 1497 CZ PHE C 48 2.571 -21.884 -3.741 1.00 0.00 C ATOM 0 H PHE C 48 1.325 -17.463 -7.195 1.00 0.00 H new ATOM 0 HA PHE C 48 -0.333 -19.925 -6.999 1.00 0.00 H new ATOM 0 HB2 PHE C 48 0.371 -17.791 -4.932 1.00 0.00 H new ATOM 0 HB3 PHE C 48 -1.009 -18.854 -4.739 1.00 0.00 H new ATOM 0 HD1 PHE C 48 2.690 -18.735 -5.030 1.00 0.00 H new ATOM 0 HD2 PHE C 48 -0.729 -21.212 -4.237 1.00 0.00 H new ATOM 0 HE1 PHE C 48 4.185 -20.528 -4.192 1.00 0.00 H new ATOM 0 HE2 PHE C 48 0.765 -23.006 -3.399 1.00 0.00 H new ATOM 0 HZ PHE C 48 3.221 -22.665 -3.376 1.00 0.00 H new ATOM 1507 N LYS C 49 -2.418 -18.691 -7.551 1.00 0.00 N ATOM 1508 CA LYS C 49 -3.598 -17.982 -8.026 1.00 0.00 C ATOM 1509 C LYS C 49 -4.287 -17.257 -6.873 1.00 0.00 C ATOM 1510 O LYS C 49 -5.257 -17.788 -6.360 1.00 0.00 O ATOM 1511 CB LYS C 49 -4.575 -18.965 -8.670 1.00 0.00 C ATOM 1512 CG LYS C 49 -3.947 -19.551 -9.937 1.00 0.00 C ATOM 1513 CD LYS C 49 -4.914 -20.553 -10.571 1.00 0.00 C ATOM 1514 CE LYS C 49 -4.252 -21.205 -11.787 1.00 0.00 C ATOM 1515 NZ LYS C 49 -4.032 -20.178 -12.843 1.00 0.00 N ATOM 1516 OXT LYS C 49 -3.832 -16.180 -6.522 1.00 0.00 O ATOM 0 H LYS C 49 -2.517 -19.705 -7.513 1.00 0.00 H new ATOM 0 HA LYS C 49 -3.283 -17.247 -8.767 1.00 0.00 H new ATOM 0 HB2 LYS C 49 -4.819 -19.763 -7.969 1.00 0.00 H new ATOM 0 HB3 LYS C 49 -5.509 -18.459 -8.915 1.00 0.00 H new ATOM 0 HG2 LYS C 49 -3.718 -18.754 -10.644 1.00 0.00 H new ATOM 0 HG3 LYS C 49 -3.005 -20.043 -9.695 1.00 0.00 H new ATOM 0 HD2 LYS C 49 -5.193 -21.315 -9.843 1.00 0.00 H new ATOM 0 HD3 LYS C 49 -5.832 -20.048 -10.871 1.00 0.00 H new ATOM 0 HE2 LYS C 49 -3.302 -21.655 -11.499 1.00 0.00 H new ATOM 0 HE3 LYS C 49 -4.882 -22.007 -12.171 1.00 0.00 H new ATOM 0 HZ1 LYS C 49 -3.858 -20.649 -13.754 1.00 0.00 H new ATOM 0 HZ2 LYS C 49 -4.875 -19.574 -12.921 1.00 0.00 H new ATOM 0 HZ3 LYS C 49 -3.209 -19.593 -12.593 1.00 0.00 H new TER 1530 LYS C 49 ATOM 1531 N SER D 19 5.072 24.612 9.517 1.00 0.00 N ATOM 1532 CA SER D 19 5.539 23.348 10.156 1.00 0.00 C ATOM 1533 C SER D 19 4.472 22.271 9.993 1.00 0.00 C ATOM 1534 O SER D 19 4.485 21.513 9.023 1.00 0.00 O ATOM 1535 CB SER D 19 5.800 23.599 11.641 1.00 0.00 C ATOM 1536 OG SER D 19 6.881 24.513 11.781 1.00 0.00 O ATOM 0 HA SER D 19 6.460 23.014 9.679 1.00 0.00 H new ATOM 0 HB2 SER D 19 4.905 24.001 12.116 1.00 0.00 H new ATOM 0 HB3 SER D 19 6.034 22.661 12.144 1.00 0.00 H new ATOM 0 HG SER D 19 6.938 25.077 10.982 1.00 0.00 H new ATOM 1544 N ASN D 20 3.550 22.211 10.947 1.00 0.00 N ATOM 1545 CA ASN D 20 2.479 21.223 10.902 1.00 0.00 C ATOM 1546 C ASN D 20 1.590 21.455 9.683 1.00 0.00 C ATOM 1547 O ASN D 20 1.165 20.507 9.025 1.00 0.00 O ATOM 1548 CB ASN D 20 1.636 21.312 12.176 1.00 0.00 C ATOM 1549 CG ASN D 20 2.440 20.821 13.378 1.00 0.00 C ATOM 1550 OD1 ASN D 20 3.301 19.851 13.228 1.00 0.00 O flip ATOM 1551 ND2 ASN D 20 2.276 21.333 14.484 1.00 0.00 N flip ATOM 0 H ASN D 20 3.522 22.831 11.757 1.00 0.00 H new ATOM 0 HA ASN D 20 2.924 20.231 10.830 1.00 0.00 H new ATOM 0 HB2 ASN D 20 1.318 22.342 12.339 1.00 0.00 H new ATOM 0 HB3 ASN D 20 0.732 20.713 12.065 1.00 0.00 H new ATOM 0 HD21 ASN D 20 1.603 22.091 14.601 1.00 0.00 H new ATOM 0 HD22 ASN D 20 2.813 21.000 15.285 1.00 0.00 H new ATOM 1558 N ASP D 21 1.316 22.724 9.390 1.00 0.00 N ATOM 1559 CA ASP D 21 0.477 23.069 8.248 1.00 0.00 C ATOM 1560 C ASP D 21 1.129 22.609 6.948 1.00 0.00 C ATOM 1561 O ASP D 21 0.456 22.112 6.045 1.00 0.00 O ATOM 1562 CB ASP D 21 0.255 24.583 8.203 1.00 0.00 C ATOM 1563 CG ASP D 21 -0.650 24.942 7.030 1.00 0.00 C ATOM 1564 OD1 ASP D 21 -0.959 24.054 6.250 1.00 0.00 O ATOM 1565 OD2 ASP D 21 -1.023 26.099 6.927 1.00 0.00 O ATOM 0 H ASP D 21 1.660 23.523 9.923 1.00 0.00 H new ATOM 0 HA ASP D 21 -0.483 22.564 8.358 1.00 0.00 H new ATOM 0 HB2 ASP D 21 -0.195 24.921 9.137 1.00 0.00 H new ATOM 0 HB3 ASP D 21 1.212 25.096 8.106 1.00 0.00 H new ATOM 1570 N SER D 22 2.444 22.779 6.861 1.00 0.00 N ATOM 1571 CA SER D 22 3.183 22.378 5.668 1.00 0.00 C ATOM 1572 C SER D 22 3.051 20.876 5.437 1.00 0.00 C ATOM 1573 O SER D 22 2.863 20.426 4.306 1.00 0.00 O ATOM 1574 CB SER D 22 4.658 22.748 5.817 1.00 0.00 C ATOM 1575 OG SER D 22 5.354 22.387 4.631 1.00 0.00 O ATOM 0 H SER D 22 3.018 23.189 7.598 1.00 0.00 H new ATOM 0 HA SER D 22 2.764 22.904 4.810 1.00 0.00 H new ATOM 0 HB2 SER D 22 4.760 23.817 6.001 1.00 0.00 H new ATOM 0 HB3 SER D 22 5.089 22.234 6.676 1.00 0.00 H new ATOM 0 HG SER D 22 6.300 22.624 4.722 1.00 0.00 H new ATOM 1581 N SER D 23 3.151 20.103 6.518 1.00 0.00 N ATOM 1582 CA SER D 23 3.041 18.646 6.437 1.00 0.00 C ATOM 1583 C SER D 23 2.191 18.117 7.587 1.00 0.00 C ATOM 1584 O SER D 23 2.558 18.248 8.754 1.00 0.00 O ATOM 1585 CB SER D 23 4.432 18.018 6.501 1.00 0.00 C ATOM 1586 OG SER D 23 5.044 18.359 7.738 1.00 0.00 O ATOM 0 H SER D 23 3.308 20.461 7.460 1.00 0.00 H new ATOM 0 HA SER D 23 2.566 18.382 5.492 1.00 0.00 H new ATOM 0 HB2 SER D 23 4.359 16.935 6.404 1.00 0.00 H new ATOM 0 HB3 SER D 23 5.042 18.372 5.670 1.00 0.00 H new ATOM 0 HG SER D 23 4.369 18.356 8.449 1.00 0.00 H new ATOM 1592 N ASP D 24 1.053 17.528 7.246 1.00 0.00 N ATOM 1593 CA ASP D 24 0.147 16.985 8.256 1.00 0.00 C ATOM 1594 C ASP D 24 0.674 15.640 8.778 1.00 0.00 C ATOM 1595 O ASP D 24 1.397 14.938 8.070 1.00 0.00 O ATOM 1596 CB ASP D 24 -1.262 16.810 7.652 1.00 0.00 C ATOM 1597 CG ASP D 24 -1.157 16.518 6.158 1.00 0.00 C ATOM 1598 OD1 ASP D 24 -0.697 17.388 5.436 1.00 0.00 O ATOM 1599 OD2 ASP D 24 -1.542 15.432 5.759 1.00 0.00 O ATOM 0 H ASP D 24 0.734 17.413 6.284 1.00 0.00 H new ATOM 0 HA ASP D 24 0.091 17.681 9.093 1.00 0.00 H new ATOM 0 HB2 ASP D 24 -1.783 15.995 8.154 1.00 0.00 H new ATOM 0 HB3 ASP D 24 -1.851 17.713 7.814 1.00 0.00 H new ATOM 1604 N PRO D 25 0.326 15.273 9.991 1.00 0.00 N ATOM 1605 CA PRO D 25 0.779 13.983 10.601 1.00 0.00 C ATOM 1606 C PRO D 25 0.191 12.769 9.876 1.00 0.00 C ATOM 1607 O PRO D 25 0.686 11.651 10.018 1.00 0.00 O ATOM 1608 CB PRO D 25 0.273 14.069 12.055 1.00 0.00 C ATOM 1609 CG PRO D 25 -0.873 15.029 12.010 1.00 0.00 C ATOM 1610 CD PRO D 25 -0.532 16.038 10.913 1.00 0.00 C ATOM 0 HA PRO D 25 1.859 13.850 10.535 1.00 0.00 H new ATOM 0 HB2 PRO D 25 -0.044 13.092 12.421 1.00 0.00 H new ATOM 0 HB3 PRO D 25 1.057 14.421 12.725 1.00 0.00 H new ATOM 0 HG2 PRO D 25 -1.807 14.512 11.789 1.00 0.00 H new ATOM 0 HG3 PRO D 25 -1.004 15.526 12.971 1.00 0.00 H new ATOM 0 HD2 PRO D 25 -1.429 16.406 10.414 1.00 0.00 H new ATOM 0 HD3 PRO D 25 -0.012 16.907 11.316 1.00 0.00 H new ATOM 1618 N LEU D 26 -0.866 13.000 9.104 1.00 0.00 N ATOM 1619 CA LEU D 26 -1.514 11.918 8.371 1.00 0.00 C ATOM 1620 C LEU D 26 -0.546 11.293 7.369 1.00 0.00 C ATOM 1621 O LEU D 26 -0.491 10.070 7.230 1.00 0.00 O ATOM 1622 CB LEU D 26 -2.739 12.457 7.627 1.00 0.00 C ATOM 1623 CG LEU D 26 -3.843 12.843 8.626 1.00 0.00 C ATOM 1624 CD1 LEU D 26 -4.912 13.661 7.897 1.00 0.00 C ATOM 1625 CD2 LEU D 26 -4.489 11.580 9.239 1.00 0.00 C ATOM 0 H LEU D 26 -1.289 13.918 8.970 1.00 0.00 H new ATOM 0 HA LEU D 26 -1.824 11.155 9.084 1.00 0.00 H new ATOM 0 HB2 LEU D 26 -2.458 13.326 7.031 1.00 0.00 H new ATOM 0 HB3 LEU D 26 -3.113 11.703 6.934 1.00 0.00 H new ATOM 0 HG LEU D 26 -3.403 13.432 9.431 1.00 0.00 H new ATOM 0 HD11 LEU D 26 -5.699 13.939 8.598 1.00 0.00 H new ATOM 0 HD12 LEU D 26 -4.461 14.562 7.482 1.00 0.00 H new ATOM 0 HD13 LEU D 26 -5.339 13.065 7.090 1.00 0.00 H new ATOM 0 HD21 LEU D 26 -5.267 11.875 9.943 1.00 0.00 H new ATOM 0 HD22 LEU D 26 -4.927 10.974 8.446 1.00 0.00 H new ATOM 0 HD23 LEU D 26 -3.729 10.999 9.761 1.00 0.00 H new ATOM 1637 N VAL D 27 0.214 12.134 6.677 1.00 0.00 N ATOM 1638 CA VAL D 27 1.175 11.644 5.694 1.00 0.00 C ATOM 1639 C VAL D 27 2.263 10.821 6.378 1.00 0.00 C ATOM 1640 O VAL D 27 2.629 9.744 5.909 1.00 0.00 O ATOM 1641 CB VAL D 27 1.810 12.820 4.947 1.00 0.00 C ATOM 1642 CG1 VAL D 27 2.906 12.308 4.008 1.00 0.00 C ATOM 1643 CG2 VAL D 27 0.733 13.539 4.130 1.00 0.00 C ATOM 0 H VAL D 27 0.185 13.149 6.776 1.00 0.00 H new ATOM 0 HA VAL D 27 0.648 11.010 4.982 1.00 0.00 H new ATOM 0 HB VAL D 27 2.249 13.511 5.666 1.00 0.00 H new ATOM 0 HG11 VAL D 27 3.354 13.149 3.479 1.00 0.00 H new ATOM 0 HG12 VAL D 27 3.672 11.795 4.589 1.00 0.00 H new ATOM 0 HG13 VAL D 27 2.473 11.615 3.287 1.00 0.00 H new ATOM 0 HG21 VAL D 27 1.180 14.377 3.596 1.00 0.00 H new ATOM 0 HG22 VAL D 27 0.296 12.844 3.413 1.00 0.00 H new ATOM 0 HG23 VAL D 27 -0.045 13.908 4.798 1.00 0.00 H new ATOM 1653 N VAL D 28 2.775 11.340 7.490 1.00 0.00 N ATOM 1654 CA VAL D 28 3.820 10.648 8.236 1.00 0.00 C ATOM 1655 C VAL D 28 3.302 9.321 8.779 1.00 0.00 C ATOM 1656 O VAL D 28 3.981 8.297 8.695 1.00 0.00 O ATOM 1657 CB VAL D 28 4.302 11.526 9.396 1.00 0.00 C ATOM 1658 CG1 VAL D 28 5.322 10.755 10.233 1.00 0.00 C ATOM 1659 CG2 VAL D 28 4.951 12.795 8.838 1.00 0.00 C ATOM 0 H VAL D 28 2.485 12.232 7.892 1.00 0.00 H new ATOM 0 HA VAL D 28 4.652 10.450 7.561 1.00 0.00 H new ATOM 0 HB VAL D 28 3.453 11.797 10.023 1.00 0.00 H new ATOM 0 HG11 VAL D 28 5.664 11.381 11.057 1.00 0.00 H new ATOM 0 HG12 VAL D 28 4.858 9.852 10.631 1.00 0.00 H new ATOM 0 HG13 VAL D 28 6.172 10.481 9.609 1.00 0.00 H new ATOM 0 HG21 VAL D 28 5.294 13.421 9.662 1.00 0.00 H new ATOM 0 HG22 VAL D 28 5.800 12.524 8.210 1.00 0.00 H new ATOM 0 HG23 VAL D 28 4.222 13.346 8.244 1.00 0.00 H new ATOM 1669 N ALA D 29 2.097 9.346 9.343 1.00 0.00 N ATOM 1670 CA ALA D 29 1.503 8.135 9.901 1.00 0.00 C ATOM 1671 C ALA D 29 1.299 7.086 8.815 1.00 0.00 C ATOM 1672 O ALA D 29 1.541 5.899 9.033 1.00 0.00 O ATOM 1673 CB ALA D 29 0.155 8.464 10.547 1.00 0.00 C ATOM 0 H ALA D 29 1.518 10.182 9.425 1.00 0.00 H new ATOM 0 HA ALA D 29 2.183 7.737 10.654 1.00 0.00 H new ATOM 0 HB1 ALA D 29 -0.282 7.555 10.961 1.00 0.00 H new ATOM 0 HB2 ALA D 29 0.302 9.192 11.345 1.00 0.00 H new ATOM 0 HB3 ALA D 29 -0.517 8.880 9.796 1.00 0.00 H new ATOM 1679 N ALA D 30 0.855 7.527 7.644 1.00 0.00 N ATOM 1680 CA ALA D 30 0.628 6.609 6.536 1.00 0.00 C ATOM 1681 C ALA D 30 1.939 5.963 6.103 1.00 0.00 C ATOM 1682 O ALA D 30 1.987 4.769 5.814 1.00 0.00 O ATOM 1683 CB ALA D 30 0.008 7.355 5.354 1.00 0.00 C ATOM 0 H ALA D 30 0.647 8.504 7.439 1.00 0.00 H new ATOM 0 HA ALA D 30 -0.057 5.829 6.869 1.00 0.00 H new ATOM 0 HB1 ALA D 30 -0.158 6.660 4.531 1.00 0.00 H new ATOM 0 HB2 ALA D 30 -0.944 7.791 5.658 1.00 0.00 H new ATOM 0 HB3 ALA D 30 0.683 8.147 5.029 1.00 0.00 H new ATOM 1689 N ASN D 31 3.000 6.761 6.060 1.00 0.00 N ATOM 1690 CA ASN D 31 4.305 6.250 5.661 1.00 0.00 C ATOM 1691 C ASN D 31 4.815 5.221 6.667 1.00 0.00 C ATOM 1692 O ASN D 31 5.313 4.165 6.287 1.00 0.00 O ATOM 1693 CB ASN D 31 5.306 7.402 5.555 1.00 0.00 C ATOM 1694 CG ASN D 31 6.682 6.867 5.173 1.00 0.00 C ATOM 1695 OD1 ASN D 31 6.869 5.655 5.067 1.00 0.00 O ATOM 1696 ND2 ASN D 31 7.661 7.701 4.962 1.00 0.00 N ATOM 0 H ASN D 31 2.983 7.754 6.294 1.00 0.00 H new ATOM 0 HA ASN D 31 4.201 5.767 4.690 1.00 0.00 H new ATOM 0 HB2 ASN D 31 4.967 8.121 4.809 1.00 0.00 H new ATOM 0 HB3 ASN D 31 5.364 7.932 6.506 1.00 0.00 H new ATOM 0 HD21 ASN D 31 8.584 7.350 4.708 1.00 0.00 H new ATOM 0 HD22 ASN D 31 7.504 8.705 5.050 1.00 0.00 H new ATOM 1703 N ILE D 32 4.693 5.536 7.953 1.00 0.00 N ATOM 1704 CA ILE D 32 5.153 4.624 8.997 1.00 0.00 C ATOM 1705 C ILE D 32 4.339 3.332 8.979 1.00 0.00 C ATOM 1706 O ILE D 32 4.893 2.235 9.066 1.00 0.00 O ATOM 1707 CB ILE D 32 5.030 5.302 10.364 1.00 0.00 C ATOM 1708 CG1 ILE D 32 6.021 6.468 10.439 1.00 0.00 C ATOM 1709 CG2 ILE D 32 5.354 4.295 11.472 1.00 0.00 C ATOM 1710 CD1 ILE D 32 5.708 7.329 11.665 1.00 0.00 C ATOM 0 H ILE D 32 4.284 6.406 8.296 1.00 0.00 H new ATOM 0 HA ILE D 32 6.198 4.375 8.810 1.00 0.00 H new ATOM 0 HB ILE D 32 4.012 5.670 10.495 1.00 0.00 H new ATOM 0 HG12 ILE D 32 7.041 6.088 10.499 1.00 0.00 H new ATOM 0 HG13 ILE D 32 5.958 7.071 9.533 1.00 0.00 H new ATOM 0 HG21 ILE D 32 5.265 4.782 12.443 1.00 0.00 H new ATOM 0 HG22 ILE D 32 4.656 3.459 11.420 1.00 0.00 H new ATOM 0 HG23 ILE D 32 6.372 3.926 11.342 1.00 0.00 H new ATOM 0 HD11 ILE D 32 6.414 8.158 11.717 1.00 0.00 H new ATOM 0 HD12 ILE D 32 4.694 7.720 11.585 1.00 0.00 H new ATOM 0 HD13 ILE D 32 5.793 6.723 12.567 1.00 0.00 H new ATOM 1722 N ILE D 33 3.025 3.472 8.858 1.00 0.00 N ATOM 1723 CA ILE D 33 2.136 2.317 8.820 1.00 0.00 C ATOM 1724 C ILE D 33 2.401 1.470 7.577 1.00 0.00 C ATOM 1725 O ILE D 33 2.453 0.242 7.654 1.00 0.00 O ATOM 1726 CB ILE D 33 0.679 2.793 8.842 1.00 0.00 C ATOM 1727 CG1 ILE D 33 0.366 3.395 10.216 1.00 0.00 C ATOM 1728 CG2 ILE D 33 -0.260 1.615 8.567 1.00 0.00 C ATOM 1729 CD1 ILE D 33 -0.976 4.121 10.162 1.00 0.00 C ATOM 0 H ILE D 33 2.551 4.372 8.785 1.00 0.00 H new ATOM 0 HA ILE D 33 2.325 1.696 9.696 1.00 0.00 H new ATOM 0 HB ILE D 33 0.533 3.548 8.070 1.00 0.00 H new ATOM 0 HG12 ILE D 33 0.336 2.609 10.971 1.00 0.00 H new ATOM 0 HG13 ILE D 33 1.155 4.088 10.509 1.00 0.00 H new ATOM 0 HG21 ILE D 33 -1.293 1.962 8.584 1.00 0.00 H new ATOM 0 HG22 ILE D 33 -0.036 1.192 7.588 1.00 0.00 H new ATOM 0 HG23 ILE D 33 -0.120 0.852 9.333 1.00 0.00 H new ATOM 0 HD11 ILE D 33 -1.198 4.549 11.140 1.00 0.00 H new ATOM 0 HD12 ILE D 33 -0.929 4.918 9.419 1.00 0.00 H new ATOM 0 HD13 ILE D 33 -1.761 3.416 9.888 1.00 0.00 H new ATOM 1741 N GLY D 34 2.566 2.128 6.434 1.00 0.00 N ATOM 1742 CA GLY D 34 2.822 1.417 5.186 1.00 0.00 C ATOM 1743 C GLY D 34 4.141 0.651 5.251 1.00 0.00 C ATOM 1744 O GLY D 34 4.232 -0.494 4.806 1.00 0.00 O ATOM 0 H GLY D 34 2.528 3.143 6.346 1.00 0.00 H new ATOM 0 HA2 GLY D 34 2.005 0.724 4.984 1.00 0.00 H new ATOM 0 HA3 GLY D 34 2.850 2.126 4.359 1.00 0.00 H new ATOM 1748 N ILE D 35 5.163 1.290 5.809 1.00 0.00 N ATOM 1749 CA ILE D 35 6.471 0.655 5.925 1.00 0.00 C ATOM 1750 C ILE D 35 6.377 -0.570 6.839 1.00 0.00 C ATOM 1751 O ILE D 35 6.925 -1.628 6.530 1.00 0.00 O ATOM 1752 CB ILE D 35 7.484 1.659 6.497 1.00 0.00 C ATOM 1753 CG1 ILE D 35 7.744 2.795 5.477 1.00 0.00 C ATOM 1754 CG2 ILE D 35 8.796 0.937 6.840 1.00 0.00 C ATOM 1755 CD1 ILE D 35 8.816 2.404 4.450 1.00 0.00 C ATOM 0 H ILE D 35 5.113 2.237 6.185 1.00 0.00 H new ATOM 0 HA ILE D 35 6.803 0.334 4.937 1.00 0.00 H new ATOM 0 HB ILE D 35 7.075 2.098 7.407 1.00 0.00 H new ATOM 0 HG12 ILE D 35 6.816 3.038 4.959 1.00 0.00 H new ATOM 0 HG13 ILE D 35 8.059 3.694 6.007 1.00 0.00 H new ATOM 0 HG21 ILE D 35 9.510 1.654 7.245 1.00 0.00 H new ATOM 0 HG22 ILE D 35 8.601 0.161 7.580 1.00 0.00 H new ATOM 0 HG23 ILE D 35 9.208 0.484 5.939 1.00 0.00 H new ATOM 0 HD11 ILE D 35 8.969 3.227 3.752 1.00 0.00 H new ATOM 0 HD12 ILE D 35 9.751 2.186 4.965 1.00 0.00 H new ATOM 0 HD13 ILE D 35 8.490 1.520 3.902 1.00 0.00 H new ATOM 1767 N LEU D 36 5.671 -0.414 7.957 1.00 0.00 N ATOM 1768 CA LEU D 36 5.508 -1.509 8.907 1.00 0.00 C ATOM 1769 C LEU D 36 4.795 -2.675 8.238 1.00 0.00 C ATOM 1770 O LEU D 36 5.111 -3.838 8.492 1.00 0.00 O ATOM 1771 CB LEU D 36 4.706 -1.045 10.130 1.00 0.00 C ATOM 1772 CG LEU D 36 4.550 -2.194 11.143 1.00 0.00 C ATOM 1773 CD1 LEU D 36 5.930 -2.687 11.616 1.00 0.00 C ATOM 1774 CD2 LEU D 36 3.747 -1.689 12.346 1.00 0.00 C ATOM 0 H LEU D 36 5.206 0.454 8.225 1.00 0.00 H new ATOM 0 HA LEU D 36 6.496 -1.831 9.237 1.00 0.00 H new ATOM 0 HB2 LEU D 36 5.209 -0.202 10.603 1.00 0.00 H new ATOM 0 HB3 LEU D 36 3.723 -0.694 9.815 1.00 0.00 H new ATOM 0 HG LEU D 36 4.030 -3.024 10.666 1.00 0.00 H new ATOM 0 HD11 LEU D 36 5.801 -3.499 12.331 1.00 0.00 H new ATOM 0 HD12 LEU D 36 6.501 -3.045 10.760 1.00 0.00 H new ATOM 0 HD13 LEU D 36 6.466 -1.866 12.092 1.00 0.00 H new ATOM 0 HD21 LEU D 36 3.631 -2.495 13.070 1.00 0.00 H new ATOM 0 HD22 LEU D 36 4.274 -0.856 12.812 1.00 0.00 H new ATOM 0 HD23 LEU D 36 2.764 -1.355 12.013 1.00 0.00 H new ATOM 1786 N HIS D 37 3.833 -2.357 7.380 1.00 0.00 N ATOM 1787 CA HIS D 37 3.093 -3.392 6.683 1.00 0.00 C ATOM 1788 C HIS D 37 4.056 -4.277 5.906 1.00 0.00 C ATOM 1789 O HIS D 37 3.916 -5.500 5.898 1.00 0.00 O ATOM 1790 CB HIS D 37 2.093 -2.769 5.711 1.00 0.00 C ATOM 1791 CG HIS D 37 1.339 -3.869 5.016 1.00 0.00 C ATOM 1792 ND1 HIS D 37 -0.028 -4.021 5.149 1.00 0.00 N ATOM 1793 CD2 HIS D 37 1.750 -4.887 4.194 1.00 0.00 C ATOM 1794 CE1 HIS D 37 -0.386 -5.097 4.427 1.00 0.00 C ATOM 1795 NE2 HIS D 37 0.660 -5.660 3.822 1.00 0.00 N ATOM 0 H HIS D 37 3.552 -1.403 7.155 1.00 0.00 H new ATOM 0 HA HIS D 37 2.554 -3.988 7.419 1.00 0.00 H new ATOM 0 HB2 HIS D 37 1.402 -2.118 6.247 1.00 0.00 H new ATOM 0 HB3 HIS D 37 2.613 -2.149 4.981 1.00 0.00 H new ATOM 0 HD2 HIS D 37 2.770 -5.061 3.883 1.00 0.00 H new ATOM 0 HE1 HIS D 37 -1.399 -5.462 4.347 1.00 0.00 H new ATOM 0 HE2 HIS D 37 0.659 -6.481 3.217 1.00 0.00 H new ATOM 1803 N LEU D 38 5.034 -3.656 5.253 1.00 0.00 N ATOM 1804 CA LEU D 38 6.011 -4.414 4.474 1.00 0.00 C ATOM 1805 C LEU D 38 6.809 -5.355 5.368 1.00 0.00 C ATOM 1806 O LEU D 38 7.128 -6.472 4.967 1.00 0.00 O ATOM 1807 CB LEU D 38 6.965 -3.466 3.710 1.00 0.00 C ATOM 1808 CG LEU D 38 6.398 -3.134 2.314 1.00 0.00 C ATOM 1809 CD1 LEU D 38 7.117 -1.907 1.738 1.00 0.00 C ATOM 1810 CD2 LEU D 38 6.600 -4.332 1.361 1.00 0.00 C ATOM 0 H LEU D 38 5.172 -2.645 5.246 1.00 0.00 H new ATOM 0 HA LEU D 38 5.462 -5.012 3.746 1.00 0.00 H new ATOM 0 HB2 LEU D 38 7.106 -2.547 4.279 1.00 0.00 H new ATOM 0 HB3 LEU D 38 7.945 -3.932 3.609 1.00 0.00 H new ATOM 0 HG LEU D 38 5.333 -2.923 2.411 1.00 0.00 H new ATOM 0 HD11 LEU D 38 6.712 -1.678 0.752 1.00 0.00 H new ATOM 0 HD12 LEU D 38 6.967 -1.054 2.399 1.00 0.00 H new ATOM 0 HD13 LEU D 38 8.183 -2.117 1.653 1.00 0.00 H new ATOM 0 HD21 LEU D 38 6.196 -4.087 0.378 1.00 0.00 H new ATOM 0 HD22 LEU D 38 7.664 -4.551 1.272 1.00 0.00 H new ATOM 0 HD23 LEU D 38 6.082 -5.205 1.759 1.00 0.00 H new ATOM 1822 N ILE D 39 7.145 -4.912 6.565 1.00 0.00 N ATOM 1823 CA ILE D 39 7.920 -5.757 7.459 1.00 0.00 C ATOM 1824 C ILE D 39 7.195 -7.080 7.708 1.00 0.00 C ATOM 1825 O ILE D 39 7.782 -8.150 7.560 1.00 0.00 O ATOM 1826 CB ILE D 39 8.133 -5.032 8.791 1.00 0.00 C ATOM 1827 CG1 ILE D 39 8.759 -3.650 8.538 1.00 0.00 C ATOM 1828 CG2 ILE D 39 9.044 -5.859 9.700 1.00 0.00 C ATOM 1829 CD1 ILE D 39 10.054 -3.777 7.724 1.00 0.00 C ATOM 0 H ILE D 39 6.901 -3.994 6.936 1.00 0.00 H new ATOM 0 HA ILE D 39 8.884 -5.967 6.995 1.00 0.00 H new ATOM 0 HB ILE D 39 7.169 -4.903 9.282 1.00 0.00 H new ATOM 0 HG12 ILE D 39 8.050 -3.017 8.005 1.00 0.00 H new ATOM 0 HG13 ILE D 39 8.969 -3.162 9.490 1.00 0.00 H new ATOM 0 HG21 ILE D 39 9.189 -5.334 10.644 1.00 0.00 H new ATOM 0 HG22 ILE D 39 8.584 -6.829 9.890 1.00 0.00 H new ATOM 0 HG23 ILE D 39 10.009 -6.004 9.214 1.00 0.00 H new ATOM 0 HD11 ILE D 39 10.478 -2.787 7.558 1.00 0.00 H new ATOM 0 HD12 ILE D 39 10.769 -4.391 8.272 1.00 0.00 H new ATOM 0 HD13 ILE D 39 9.836 -4.244 6.764 1.00 0.00 H new ATOM 1841 N LEU D 40 5.920 -7.003 8.084 1.00 0.00 N ATOM 1842 CA LEU D 40 5.137 -8.213 8.344 1.00 0.00 C ATOM 1843 C LEU D 40 4.856 -8.992 7.052 1.00 0.00 C ATOM 1844 O LEU D 40 4.959 -10.218 7.027 1.00 0.00 O ATOM 1845 CB LEU D 40 3.814 -7.838 9.028 1.00 0.00 C ATOM 1846 CG LEU D 40 4.059 -7.587 10.519 1.00 0.00 C ATOM 1847 CD1 LEU D 40 5.086 -6.460 10.686 1.00 0.00 C ATOM 1848 CD2 LEU D 40 2.745 -7.185 11.193 1.00 0.00 C ATOM 0 H LEU D 40 5.411 -6.129 8.215 1.00 0.00 H new ATOM 0 HA LEU D 40 5.721 -8.857 9.001 1.00 0.00 H new ATOM 0 HB2 LEU D 40 3.393 -6.947 8.563 1.00 0.00 H new ATOM 0 HB3 LEU D 40 3.086 -8.639 8.899 1.00 0.00 H new ATOM 0 HG LEU D 40 4.440 -8.497 10.982 1.00 0.00 H new ATOM 0 HD11 LEU D 40 5.261 -6.281 11.747 1.00 0.00 H new ATOM 0 HD12 LEU D 40 6.022 -6.747 10.208 1.00 0.00 H new ATOM 0 HD13 LEU D 40 4.706 -5.550 10.222 1.00 0.00 H new ATOM 0 HD21 LEU D 40 2.920 -7.007 12.254 1.00 0.00 H new ATOM 0 HD22 LEU D 40 2.362 -6.275 10.730 1.00 0.00 H new ATOM 0 HD23 LEU D 40 2.016 -7.986 11.075 1.00 0.00 H new ATOM 1860 N TRP D 41 4.487 -8.279 5.992 1.00 0.00 N ATOM 1861 CA TRP D 41 4.180 -8.921 4.713 1.00 0.00 C ATOM 1862 C TRP D 41 5.418 -9.609 4.137 1.00 0.00 C ATOM 1863 O TRP D 41 5.331 -10.713 3.592 1.00 0.00 O ATOM 1864 CB TRP D 41 3.616 -7.885 3.733 1.00 0.00 C ATOM 1865 CG TRP D 41 3.339 -8.516 2.405 1.00 0.00 C ATOM 1866 CD1 TRP D 41 2.216 -9.203 2.076 1.00 0.00 C ATOM 1867 CD2 TRP D 41 4.149 -8.470 1.196 1.00 0.00 C ATOM 1868 NE1 TRP D 41 2.310 -9.613 0.759 1.00 0.00 N ATOM 1869 CE2 TRP D 41 3.481 -9.178 0.173 1.00 0.00 C ATOM 1870 CE3 TRP D 41 5.393 -7.895 0.897 1.00 0.00 C ATOM 1871 CZ2 TRP D 41 4.030 -9.305 -1.101 1.00 0.00 C ATOM 1872 CZ3 TRP D 41 5.944 -8.017 -0.385 1.00 0.00 C ATOM 1873 CH2 TRP D 41 5.262 -8.720 -1.380 1.00 0.00 C ATOM 0 H TRP D 41 4.393 -7.263 5.990 1.00 0.00 H new ATOM 0 HA TRP D 41 3.425 -9.690 4.877 1.00 0.00 H new ATOM 0 HB2 TRP D 41 2.699 -7.456 4.137 1.00 0.00 H new ATOM 0 HB3 TRP D 41 4.325 -7.066 3.612 1.00 0.00 H new ATOM 0 HD1 TRP D 41 1.384 -9.398 2.736 1.00 0.00 H new ATOM 0 HE1 TRP D 41 1.601 -10.168 0.280 1.00 0.00 H new ATOM 0 HE3 TRP D 41 5.930 -7.354 1.662 1.00 0.00 H new ATOM 0 HZ2 TRP D 41 3.503 -9.854 -1.867 1.00 0.00 H new ATOM 0 HZ3 TRP D 41 6.900 -7.565 -0.605 1.00 0.00 H new ATOM 0 HH2 TRP D 41 5.691 -8.810 -2.367 1.00 0.00 H new ATOM 1884 N ILE D 42 6.570 -8.966 4.281 1.00 0.00 N ATOM 1885 CA ILE D 42 7.821 -9.533 3.786 1.00 0.00 C ATOM 1886 C ILE D 42 8.104 -10.851 4.504 1.00 0.00 C ATOM 1887 O ILE D 42 8.469 -11.846 3.876 1.00 0.00 O ATOM 1888 CB ILE D 42 8.970 -8.534 4.026 1.00 0.00 C ATOM 1889 CG1 ILE D 42 8.913 -7.424 2.969 1.00 0.00 C ATOM 1890 CG2 ILE D 42 10.330 -9.245 3.943 1.00 0.00 C ATOM 1891 CD1 ILE D 42 9.793 -6.252 3.412 1.00 0.00 C ATOM 0 H ILE D 42 6.666 -8.057 4.734 1.00 0.00 H new ATOM 0 HA ILE D 42 7.739 -9.725 2.716 1.00 0.00 H new ATOM 0 HB ILE D 42 8.857 -8.105 5.022 1.00 0.00 H new ATOM 0 HG12 ILE D 42 9.254 -7.806 2.007 1.00 0.00 H new ATOM 0 HG13 ILE D 42 7.885 -7.089 2.833 1.00 0.00 H new ATOM 0 HG21 ILE D 42 11.129 -8.524 4.115 1.00 0.00 H new ATOM 0 HG22 ILE D 42 10.378 -10.027 4.700 1.00 0.00 H new ATOM 0 HG23 ILE D 42 10.449 -9.689 2.955 1.00 0.00 H new ATOM 0 HD11 ILE D 42 9.753 -5.463 2.661 1.00 0.00 H new ATOM 0 HD12 ILE D 42 9.431 -5.865 4.365 1.00 0.00 H new ATOM 0 HD13 ILE D 42 10.822 -6.592 3.526 1.00 0.00 H new ATOM 1903 N LEU D 43 7.928 -10.851 5.819 1.00 0.00 N ATOM 1904 CA LEU D 43 8.163 -12.050 6.612 1.00 0.00 C ATOM 1905 C LEU D 43 7.199 -13.155 6.194 1.00 0.00 C ATOM 1906 O LEU D 43 7.575 -14.323 6.125 1.00 0.00 O ATOM 1907 CB LEU D 43 7.982 -11.740 8.101 1.00 0.00 C ATOM 1908 CG LEU D 43 9.112 -10.817 8.587 1.00 0.00 C ATOM 1909 CD1 LEU D 43 8.749 -10.270 9.971 1.00 0.00 C ATOM 1910 CD2 LEU D 43 10.448 -11.586 8.674 1.00 0.00 C ATOM 0 H LEU D 43 7.625 -10.039 6.356 1.00 0.00 H new ATOM 0 HA LEU D 43 9.185 -12.387 6.440 1.00 0.00 H new ATOM 0 HB2 LEU D 43 7.016 -11.264 8.267 1.00 0.00 H new ATOM 0 HB3 LEU D 43 7.984 -12.666 8.677 1.00 0.00 H new ATOM 0 HG LEU D 43 9.230 -9.999 7.876 1.00 0.00 H new ATOM 0 HD11 LEU D 43 9.545 -9.614 10.323 1.00 0.00 H new ATOM 0 HD12 LEU D 43 7.817 -9.708 9.907 1.00 0.00 H new ATOM 0 HD13 LEU D 43 8.626 -11.098 10.669 1.00 0.00 H new ATOM 0 HD21 LEU D 43 11.233 -10.914 9.020 1.00 0.00 H new ATOM 0 HD22 LEU D 43 10.346 -12.415 9.374 1.00 0.00 H new ATOM 0 HD23 LEU D 43 10.710 -11.973 7.689 1.00 0.00 H new ATOM 1922 N ASP D 44 5.955 -12.781 5.912 1.00 0.00 N ATOM 1923 CA ASP D 44 4.952 -13.758 5.502 1.00 0.00 C ATOM 1924 C ASP D 44 5.478 -14.580 4.330 1.00 0.00 C ATOM 1925 O ASP D 44 5.307 -15.799 4.289 1.00 0.00 O ATOM 1926 CB ASP D 44 3.658 -13.050 5.093 1.00 0.00 C ATOM 1927 CG ASP D 44 2.557 -14.076 4.845 1.00 0.00 C ATOM 1928 OD1 ASP D 44 2.861 -15.258 4.854 1.00 0.00 O ATOM 1929 OD2 ASP D 44 1.425 -13.665 4.650 1.00 0.00 O ATOM 0 H ASP D 44 5.619 -11.819 5.959 1.00 0.00 H new ATOM 0 HA ASP D 44 4.744 -14.419 6.343 1.00 0.00 H new ATOM 0 HB2 ASP D 44 3.350 -12.356 5.876 1.00 0.00 H new ATOM 0 HB3 ASP D 44 3.826 -12.460 4.192 1.00 0.00 H new ATOM 1934 N ARG D 45 6.128 -13.908 3.384 1.00 0.00 N ATOM 1935 CA ARG D 45 6.683 -14.592 2.220 1.00 0.00 C ATOM 1936 C ARG D 45 7.722 -15.630 2.642 1.00 0.00 C ATOM 1937 O ARG D 45 7.869 -16.668 2.000 1.00 0.00 O ATOM 1938 CB ARG D 45 7.335 -13.582 1.271 1.00 0.00 C ATOM 1939 CG ARG D 45 6.255 -12.753 0.577 1.00 0.00 C ATOM 1940 CD ARG D 45 6.918 -11.686 -0.293 1.00 0.00 C ATOM 1941 NE ARG D 45 7.759 -12.316 -1.308 1.00 0.00 N ATOM 1942 CZ ARG D 45 7.261 -12.711 -2.476 1.00 0.00 C ATOM 1943 NH1 ARG D 45 5.995 -12.551 -2.734 1.00 0.00 N ATOM 1944 NH2 ARG D 45 8.042 -13.263 -3.363 1.00 0.00 N ATOM 0 H ARG D 45 6.283 -12.900 3.399 1.00 0.00 H new ATOM 0 HA ARG D 45 5.865 -15.098 1.708 1.00 0.00 H new ATOM 0 HB2 ARG D 45 8.007 -12.928 1.827 1.00 0.00 H new ATOM 0 HB3 ARG D 45 7.939 -14.104 0.529 1.00 0.00 H new ATOM 0 HG2 ARG D 45 5.624 -13.397 -0.035 1.00 0.00 H new ATOM 0 HG3 ARG D 45 5.608 -12.284 1.318 1.00 0.00 H new ATOM 0 HD2 ARG D 45 6.156 -11.071 -0.772 1.00 0.00 H new ATOM 0 HD3 ARG D 45 7.520 -11.022 0.328 1.00 0.00 H new ATOM 0 HE ARG D 45 8.751 -12.456 -1.116 1.00 0.00 H new ATOM 0 HH11 ARG D 45 5.383 -12.122 -2.040 1.00 0.00 H new ATOM 0 HH12 ARG D 45 5.615 -12.855 -3.631 1.00 0.00 H new ATOM 0 HH21 ARG D 45 9.033 -13.391 -3.160 1.00 0.00 H new ATOM 0 HH22 ARG D 45 7.661 -13.566 -4.259 1.00 0.00 H new ATOM 1958 N LEU D 46 8.452 -15.337 3.714 1.00 0.00 N ATOM 1959 CA LEU D 46 9.484 -16.255 4.188 1.00 0.00 C ATOM 1960 C LEU D 46 8.869 -17.601 4.577 1.00 0.00 C ATOM 1961 O LEU D 46 9.370 -18.657 4.189 1.00 0.00 O ATOM 1962 CB LEU D 46 10.186 -15.651 5.411 1.00 0.00 C ATOM 1963 CG LEU D 46 11.445 -16.471 5.769 1.00 0.00 C ATOM 1964 CD1 LEU D 46 12.649 -15.934 4.993 1.00 0.00 C ATOM 1965 CD2 LEU D 46 11.735 -16.354 7.270 1.00 0.00 C ATOM 0 H LEU D 46 8.351 -14.484 4.264 1.00 0.00 H new ATOM 0 HA LEU D 46 10.204 -16.413 3.385 1.00 0.00 H new ATOM 0 HB2 LEU D 46 10.464 -14.617 5.205 1.00 0.00 H new ATOM 0 HB3 LEU D 46 9.502 -15.634 6.259 1.00 0.00 H new ATOM 0 HG LEU D 46 11.270 -17.515 5.508 1.00 0.00 H new ATOM 0 HD11 LEU D 46 13.535 -16.515 5.248 1.00 0.00 H new ATOM 0 HD12 LEU D 46 12.458 -16.015 3.923 1.00 0.00 H new ATOM 0 HD13 LEU D 46 12.813 -14.889 5.254 1.00 0.00 H new ATOM 0 HD21 LEU D 46 12.624 -16.935 7.515 1.00 0.00 H new ATOM 0 HD22 LEU D 46 11.902 -15.308 7.528 1.00 0.00 H new ATOM 0 HD23 LEU D 46 10.885 -16.736 7.836 1.00 0.00 H new ATOM 1977 N PHE D 47 7.781 -17.556 5.342 1.00 0.00 N ATOM 1978 CA PHE D 47 7.105 -18.779 5.775 1.00 0.00 C ATOM 1979 C PHE D 47 6.438 -19.484 4.596 1.00 0.00 C ATOM 1980 O PHE D 47 6.510 -20.705 4.472 1.00 0.00 O ATOM 1981 CB PHE D 47 6.053 -18.445 6.840 1.00 0.00 C ATOM 1982 CG PHE D 47 6.748 -18.114 8.141 1.00 0.00 C ATOM 1983 CD1 PHE D 47 7.506 -16.946 8.245 1.00 0.00 C ATOM 1984 CD2 PHE D 47 6.640 -18.977 9.242 1.00 0.00 C ATOM 1985 CE1 PHE D 47 8.160 -16.634 9.441 1.00 0.00 C ATOM 1986 CE2 PHE D 47 7.291 -18.666 10.440 1.00 0.00 C ATOM 1987 CZ PHE D 47 8.053 -17.494 10.541 1.00 0.00 C ATOM 0 H PHE D 47 7.350 -16.693 5.674 1.00 0.00 H new ATOM 0 HA PHE D 47 7.853 -19.449 6.198 1.00 0.00 H new ATOM 0 HB2 PHE D 47 5.444 -17.601 6.515 1.00 0.00 H new ATOM 0 HB3 PHE D 47 5.379 -19.290 6.979 1.00 0.00 H new ATOM 0 HD1 PHE D 47 7.588 -16.281 7.398 1.00 0.00 H new ATOM 0 HD2 PHE D 47 6.054 -19.881 9.164 1.00 0.00 H new ATOM 0 HE1 PHE D 47 8.747 -15.731 9.516 1.00 0.00 H new ATOM 0 HE2 PHE D 47 7.207 -19.329 11.288 1.00 0.00 H new ATOM 0 HZ PHE D 47 8.557 -17.255 11.466 1.00 0.00 H new ATOM 1997 N PHE D 48 5.783 -18.703 3.738 1.00 0.00 N ATOM 1998 CA PHE D 48 5.093 -19.252 2.567 1.00 0.00 C ATOM 1999 C PHE D 48 5.614 -18.609 1.288 1.00 0.00 C ATOM 2000 O PHE D 48 5.771 -17.392 1.212 1.00 0.00 O ATOM 2001 CB PHE D 48 3.591 -18.989 2.692 1.00 0.00 C ATOM 2002 CG PHE D 48 3.007 -19.897 3.747 1.00 0.00 C ATOM 2003 CD1 PHE D 48 3.044 -19.518 5.096 1.00 0.00 C ATOM 2004 CD2 PHE D 48 2.435 -21.121 3.380 1.00 0.00 C ATOM 2005 CE1 PHE D 48 2.507 -20.362 6.075 1.00 0.00 C ATOM 2006 CE2 PHE D 48 1.899 -21.965 4.359 1.00 0.00 C ATOM 2007 CZ PHE D 48 1.934 -21.586 5.706 1.00 0.00 C ATOM 0 H PHE D 48 5.714 -17.689 3.830 1.00 0.00 H new ATOM 0 HA PHE D 48 5.280 -20.325 2.522 1.00 0.00 H new ATOM 0 HB2 PHE D 48 3.414 -17.946 2.956 1.00 0.00 H new ATOM 0 HB3 PHE D 48 3.100 -19.163 1.735 1.00 0.00 H new ATOM 0 HD1 PHE D 48 3.487 -18.575 5.380 1.00 0.00 H new ATOM 0 HD2 PHE D 48 2.407 -21.414 2.341 1.00 0.00 H new ATOM 0 HE1 PHE D 48 2.534 -20.070 7.114 1.00 0.00 H new ATOM 0 HE2 PHE D 48 1.458 -22.909 4.075 1.00 0.00 H new ATOM 0 HZ PHE D 48 1.519 -22.237 6.461 1.00 0.00 H new ATOM 2017 N LYS D 49 5.880 -19.437 0.283 1.00 0.00 N ATOM 2018 CA LYS D 49 6.385 -18.937 -0.989 1.00 0.00 C ATOM 2019 C LYS D 49 5.282 -18.214 -1.755 1.00 0.00 C ATOM 2020 O LYS D 49 4.701 -18.826 -2.636 1.00 0.00 O ATOM 2021 CB LYS D 49 6.922 -20.096 -1.830 1.00 0.00 C ATOM 2022 CG LYS D 49 8.150 -20.697 -1.143 1.00 0.00 C ATOM 2023 CD LYS D 49 8.674 -21.871 -1.971 1.00 0.00 C ATOM 2024 CE LYS D 49 9.846 -22.530 -1.241 1.00 0.00 C ATOM 2025 NZ LYS D 49 10.991 -21.578 -1.177 1.00 0.00 N ATOM 2026 OXT LYS D 49 5.034 -17.060 -1.448 1.00 0.00 O ATOM 0 H LYS D 49 5.755 -20.449 0.324 1.00 0.00 H new ATOM 0 HA LYS D 49 7.192 -18.233 -0.788 1.00 0.00 H new ATOM 0 HB2 LYS D 49 6.152 -20.857 -1.954 1.00 0.00 H new ATOM 0 HB3 LYS D 49 7.185 -19.744 -2.827 1.00 0.00 H new ATOM 0 HG2 LYS D 49 8.926 -19.940 -1.034 1.00 0.00 H new ATOM 0 HG3 LYS D 49 7.890 -21.033 -0.139 1.00 0.00 H new ATOM 0 HD2 LYS D 49 7.879 -22.598 -2.134 1.00 0.00 H new ATOM 0 HD3 LYS D 49 8.994 -21.523 -2.953 1.00 0.00 H new ATOM 0 HE2 LYS D 49 9.544 -22.821 -0.235 1.00 0.00 H new ATOM 0 HE3 LYS D 49 10.145 -23.441 -1.760 1.00 0.00 H new ATOM 0 HZ1 LYS D 49 11.860 -22.096 -0.935 1.00 0.00 H new ATOM 0 HZ2 LYS D 49 11.110 -21.115 -2.101 1.00 0.00 H new ATOM 0 HZ3 LYS D 49 10.803 -20.858 -0.451 1.00 0.00 H new TER 2040 LYS D 49 HETATM 2041 S 3LW C 100 -0.639 9.217 -1.209 1.00 0.00 S HETATM 2042 BR 3LW C 100 -1.561 11.815 -2.309 1.00 0.00 BR HETATM 2043 C1 3LW C 100 -0.506 10.675 -1.212 1.00 0.00 C HETATM 2044 C2 3LW C 100 0.433 11.105 -0.362 1.00 0.00 C HETATM 2045 N2 3LW C 100 -0.335 6.615 -0.149 1.00 0.00 N HETATM 2046 C3 3LW C 100 0.973 10.043 0.241 1.00 0.00 C HETATM 2047 C5 3LW C 100 0.743 7.528 0.245 1.00 0.00 C HETATM 2048 C10 3LW C 100 -0.108 5.151 -0.040 1.00 0.00 C HETATM 2049 C12 3LW C 100 0.393 8.915 -0.205 1.00 0.00 C HETATM 2050 C61 3LW C 100 -1.371 4.367 -0.492 1.00 0.00 C HETATM 2051 C62 3LW C 100 0.204 4.705 1.421 1.00 0.00 C HETATM 2052 C63 3LW C 100 1.073 4.669 -0.936 1.00 0.00 C HETATM 2053 C71 3LW C 100 -1.162 2.838 -0.392 1.00 0.00 C HETATM 2054 C72 3LW C 100 0.408 3.173 1.514 1.00 0.00 C HETATM 2055 C73 3LW C 100 1.272 3.139 -0.828 1.00 0.00 C HETATM 2056 C81 3LW C 100 -0.860 2.445 1.058 1.00 0.00 C HETATM 2057 C82 3LW C 100 1.584 2.752 0.622 1.00 0.00 C HETATM 2058 C83 3LW C 100 0.006 2.407 -1.285 1.00 0.00 C