USER MOD reduce.3.24.130724 H: found=0, std=0, add=1378, rem=0, adj=56 USER MOD reduce.3.24.130724 removed 1380 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 68 HIS :FLIP no HE2:sc= -2.33 F(o=-5.1,f=-4.4) USER MOD Set 1.2: B 72 HIS :FLIP no HE2:sc= -2.11 F(o=-5.5!,f=-4.4) USER MOD Set 2.1: B 13 MET CE :methyl 149:sc= -0.749 (180deg=-1.63) USER MOD Set 2.2: B 21 SER OG : rot 54:sc= -6.77! USER MOD Set 3.1: A 88 SER OG : rot 51:sc= -0.163 USER MOD Set 3.2: B 55 HIS : no HE2:sc= -16.6! C(o=-16!,f=-23!) USER MOD Set 3.3: B 88 SER OG : rot -117:sc= 1.09 USER MOD Set 4.1: A 77 TYR OH : rot 180:sc= -2.59! USER MOD Set 4.2: A 80 GLN :FLIP amide:sc= -0.276 F(o=-4.2,f=-2.9) USER MOD Set 5.1: A 68 HIS : no HD1:sc= -3.62! C(o=-4!,f=-9.2!) USER MOD Set 5.2: A 72 HIS : no HD1:sc= -0.352 K(o=-4,f=-4.5) USER MOD Set 6.1: A 67 THR OG1 : rot 180:sc= 0.32 USER MOD Set 6.2: B 43 LYS NZ :NH3+ -168:sc= 1.37 (180deg=0.299) USER MOD Set 6.3: B 53 THR OG1 : rot 90:sc= 1.12 USER MOD Set 7.1: A 51 ASN : amide:sc= -1.78 K(o=-8.5,f=-15!) USER MOD Set 7.2: A 87 LYS NZ :NH3+ 180:sc= -6.72! (180deg=-6.91!) USER MOD Set 8.1: A 32 TYR OH : rot 180:sc= 0.823 USER MOD Set 8.2: A 41 HIS : no HE2:sc= -22.1! C(o=-21!,f=-29!) USER MOD Set 9.1: A 27 GLN :FLIP amide:sc= -0.532 F(o=-2.6,f=-0.57) USER MOD Set 9.2: A 31 LYS NZ :NH3+ -173:sc= -0.0349 (180deg=0) USER MOD Single : A 5 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0295) USER MOD Single : A 9 LYS NZ :NH3+ -172:sc= -0.852 (180deg=-1.02) USER MOD Single : A 10 ASN : amide:sc= -0.256 K(o=-0.26,f=-1.9!) USER MOD Single : A 13 MET CE :methyl 164:sc= -0.0466 (180deg=-0.52) USER MOD Single : A 14 SER OG : rot 180:sc= 0.0262 USER MOD Single : A 17 MET CE :methyl 158:sc= -5.52! (180deg=-8!) USER MOD Single : A 18 GLN :FLIP amide:sc= -5.43! C(o=-7.8!,f=-5.4!) USER MOD Single : A 19 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 21 SER OG : rot -71:sc= -3.87! USER MOD Single : A 24 CYS SG : rot 155:sc= -0.125 USER MOD Single : A 26 THR OG1 : rot 52:sc= -0.615 USER MOD Single : A 33 ASN : amide:sc= -0.543 K(o=-0.54,f=-1.7!) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 LYS NZ :NH3+ -103:sc= -2 (180deg=-4.21!) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 TYR OH : rot 180:sc= -1.72 USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 HIS :FLIP no HD1:sc= -14.8! C(o=-17!,f=-15!) USER MOD Single : A 56 CYS SG : rot -58:sc= -8.01! USER MOD Single : A 61 ASN : amide:sc= 0.0796 X(o=0.08,f=-0.1) USER MOD Single : A 64 SER OG : rot -116:sc= 0.875 USER MOD Single : A 65 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 TYR OH : rot 35:sc= 1.37 USER MOD Single : B 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 9 LYS NZ :NH3+ -157:sc= -0.0105 (180deg=-0.153) USER MOD Single : B 10 ASN : amide:sc= -0.297 X(o=-0.3,f=-0.017) USER MOD Single : B 14 SER OG : rot 180:sc= 0 USER MOD Single : B 17 MET CE :methyl -164:sc= -4.83! (180deg=-5.79!) USER MOD Single : B 18 GLN :FLIP amide:sc= -13.3! C(o=-20!,f=-13!) USER MOD Single : B 19 GLN :FLIP amide:sc= -0.186 F(o=-2.1!,f=-0.19) USER MOD Single : B 24 CYS SG : rot 130:sc= -6.14! USER MOD Single : B 26 THR OG1 : rot 67:sc= 0.511 USER MOD Single : B 27 GLN :FLIP amide:sc= -1.04 F(o=-1.9,f=-1) USER MOD Single : B 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 32 TYR OH : rot 180:sc= 0 USER MOD Single : B 33 ASN :FLIP amide:sc= -0.266 F(o=-4.3!,f=-0.27) USER MOD Single : B 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 41 HIS :FLIP no HD1:sc= -15.6! C(o=-18!,f=-16!) USER MOD Single : B 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 50 TYR OH : rot 29:sc= -3.63! USER MOD Single : B 51 ASN :FLIP amide:sc= -0.449 F(o=-5.4!,f=-0.45) USER MOD Single : B 56 CYS SG : rot 50:sc= -15.2! USER MOD Single : B 61 ASN : amide:sc= -0.129 X(o=-0.13,f=0) USER MOD Single : B 64 SER OG : rot 10:sc= -1.43! USER MOD Single : B 65 TYR OH : rot 180:sc= 0 USER MOD Single : B 67 THR OG1 : rot -130:sc=-0.00685 USER MOD Single : B 70 THR OG1 : rot 110:sc= -2.19! USER MOD Single : B 71 LYS NZ :NH3+ 174:sc= -7.4! (180deg=-7.86!) USER MOD Single : B 75 TYR OH : rot 80:sc= 0.254 USER MOD Single : B 77 TYR OH : rot 180:sc= -1.5! USER MOD Single : B 80 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 87 LYS NZ :NH3+ -114:sc= -0.062 (180deg=-0.831) USER MOD ----------------------------------------------------------------- ATOM 67 N LYS A 5 -17.838 6.883 8.055 1.00 0.00 N ATOM 68 CA LYS A 5 -17.162 6.275 9.196 1.00 0.00 C ATOM 69 C LYS A 5 -15.649 6.407 9.062 1.00 0.00 C ATOM 70 O LYS A 5 -14.899 5.511 9.453 1.00 0.00 O ATOM 71 CB LYS A 5 -17.547 4.801 9.322 1.00 0.00 C ATOM 72 CG LYS A 5 -17.237 4.209 10.687 1.00 0.00 C ATOM 73 CD LYS A 5 -18.471 4.173 11.573 1.00 0.00 C ATOM 74 CE LYS A 5 -18.098 4.040 13.041 1.00 0.00 C ATOM 75 NZ LYS A 5 -17.353 2.780 13.313 1.00 0.00 N ATOM 0 HA LYS A 5 -17.479 6.802 10.096 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -18.613 4.694 9.122 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -17.020 4.229 8.558 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -16.845 3.199 10.566 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -16.457 4.797 11.171 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -19.053 5.083 11.425 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -19.106 3.337 11.281 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -17.489 4.893 13.340 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -19.002 4.065 13.649 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -17.236 2.661 14.339 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -17.884 1.973 12.929 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -16.418 2.825 12.861 1.00 0.00 H new ATOM 89 N ALA A 6 -15.208 7.529 8.509 1.00 0.00 N ATOM 90 CA ALA A 6 -13.785 7.783 8.323 1.00 0.00 C ATOM 91 C ALA A 6 -13.425 9.210 8.711 1.00 0.00 C ATOM 92 O ALA A 6 -14.295 10.017 9.038 1.00 0.00 O ATOM 93 CB ALA A 6 -13.382 7.513 6.882 1.00 0.00 C ATOM 0 H ALA A 6 -15.816 8.279 8.181 1.00 0.00 H new ATOM 0 HA ALA A 6 -13.236 7.105 8.977 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -12.316 7.707 6.760 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -13.592 6.472 6.634 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -13.948 8.165 6.217 1.00 0.00 H new ATOM 99 N VAL A 7 -12.134 9.514 8.670 1.00 0.00 N ATOM 100 CA VAL A 7 -11.649 10.842 9.013 1.00 0.00 C ATOM 101 C VAL A 7 -10.580 11.298 8.027 1.00 0.00 C ATOM 102 O VAL A 7 -9.387 11.255 8.326 1.00 0.00 O ATOM 103 CB VAL A 7 -11.067 10.877 10.438 1.00 0.00 C ATOM 104 CG1 VAL A 7 -10.477 12.246 10.742 1.00 0.00 C ATOM 105 CG2 VAL A 7 -12.133 10.510 11.459 1.00 0.00 C ATOM 0 H VAL A 7 -11.403 8.855 8.401 1.00 0.00 H new ATOM 0 HA VAL A 7 -12.503 11.518 8.964 1.00 0.00 H new ATOM 0 HB VAL A 7 -10.266 10.140 10.501 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -10.071 12.251 11.753 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -9.681 12.465 10.030 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -11.256 13.004 10.660 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -11.703 10.540 12.460 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -12.957 11.221 11.396 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -12.504 9.506 11.253 1.00 0.00 H new ATOM 115 N ILE A 8 -11.016 11.734 6.849 1.00 0.00 N ATOM 116 CA ILE A 8 -10.095 12.196 5.820 1.00 0.00 C ATOM 117 C ILE A 8 -8.872 12.857 6.459 1.00 0.00 C ATOM 118 O ILE A 8 -8.965 13.460 7.528 1.00 0.00 O ATOM 119 CB ILE A 8 -10.804 13.167 4.830 1.00 0.00 C ATOM 120 CG1 ILE A 8 -11.188 12.421 3.550 1.00 0.00 C ATOM 121 CG2 ILE A 8 -9.943 14.381 4.489 1.00 0.00 C ATOM 122 CD1 ILE A 8 -12.287 11.400 3.747 1.00 0.00 C ATOM 0 H ILE A 8 -12.000 11.776 6.585 1.00 0.00 H new ATOM 0 HA ILE A 8 -9.757 11.332 5.248 1.00 0.00 H new ATOM 0 HB ILE A 8 -11.702 13.536 5.326 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -11.507 13.145 2.800 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -10.305 11.919 3.154 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -10.482 15.027 3.796 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -9.718 14.935 5.400 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -9.013 14.049 4.027 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -12.505 10.912 2.797 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -11.964 10.653 4.473 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -13.185 11.898 4.114 1.00 0.00 H new ATOM 134 N LYS A 9 -7.729 12.736 5.794 1.00 0.00 N ATOM 135 CA LYS A 9 -6.489 13.317 6.296 1.00 0.00 C ATOM 136 C LYS A 9 -5.803 14.147 5.217 1.00 0.00 C ATOM 137 O LYS A 9 -4.894 14.927 5.500 1.00 0.00 O ATOM 138 CB LYS A 9 -5.547 12.214 6.784 1.00 0.00 C ATOM 139 CG LYS A 9 -6.186 11.274 7.793 1.00 0.00 C ATOM 140 CD LYS A 9 -6.005 11.781 9.214 1.00 0.00 C ATOM 141 CE LYS A 9 -7.098 11.263 10.133 1.00 0.00 C ATOM 142 NZ LYS A 9 -6.552 10.376 11.198 1.00 0.00 N ATOM 0 H LYS A 9 -7.635 12.241 4.907 1.00 0.00 H new ATOM 0 HA LYS A 9 -6.735 13.972 7.132 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -5.203 11.635 5.927 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -4.666 12.672 7.233 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -7.249 11.171 7.574 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -5.744 10.282 7.700 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -5.032 11.468 9.592 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -6.012 12.871 9.216 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -7.616 12.105 10.592 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -7.836 10.715 9.547 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -7.337 9.936 11.719 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -5.965 9.635 10.765 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -5.972 10.937 11.854 1.00 0.00 H new ATOM 156 N ASN A 10 -6.249 13.973 3.979 1.00 0.00 N ATOM 157 CA ASN A 10 -5.688 14.702 2.849 1.00 0.00 C ATOM 158 C ASN A 10 -6.617 14.615 1.644 1.00 0.00 C ATOM 159 O ASN A 10 -7.521 15.435 1.483 1.00 0.00 O ATOM 160 CB ASN A 10 -4.310 14.144 2.488 1.00 0.00 C ATOM 161 CG ASN A 10 -3.247 15.223 2.419 1.00 0.00 C ATOM 162 OD1 ASN A 10 -3.382 16.284 3.029 1.00 0.00 O ATOM 163 ND2 ASN A 10 -2.180 14.957 1.674 1.00 0.00 N ATOM 0 H ASN A 10 -7.001 13.330 3.732 1.00 0.00 H new ATOM 0 HA ASN A 10 -5.581 15.749 3.134 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -4.019 13.398 3.227 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -4.369 13.634 1.526 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -1.432 15.645 1.591 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -2.109 14.065 1.185 1.00 0.00 H new ATOM 170 N ALA A 11 -6.391 13.611 0.807 1.00 0.00 N ATOM 171 CA ALA A 11 -7.209 13.405 -0.381 1.00 0.00 C ATOM 172 C ALA A 11 -6.961 14.485 -1.426 1.00 0.00 C ATOM 173 O ALA A 11 -6.078 15.329 -1.269 1.00 0.00 O ATOM 174 CB ALA A 11 -8.683 13.363 -0.006 1.00 0.00 C ATOM 0 H ALA A 11 -5.646 12.925 0.929 1.00 0.00 H new ATOM 0 HA ALA A 11 -6.925 12.448 -0.818 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -9.282 13.209 -0.903 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -8.858 12.545 0.692 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -8.966 14.306 0.462 1.00 0.00 H new ATOM 180 N ASP A 12 -7.753 14.449 -2.490 1.00 0.00 N ATOM 181 CA ASP A 12 -7.637 15.417 -3.572 1.00 0.00 C ATOM 182 C ASP A 12 -8.426 14.952 -4.790 1.00 0.00 C ATOM 183 O ASP A 12 -8.089 15.278 -5.928 1.00 0.00 O ATOM 184 CB ASP A 12 -6.169 15.630 -3.946 1.00 0.00 C ATOM 185 CG ASP A 12 -5.846 17.087 -4.207 1.00 0.00 C ATOM 186 OD1 ASP A 12 -6.760 17.930 -4.082 1.00 0.00 O ATOM 187 OD2 ASP A 12 -4.679 17.387 -4.538 1.00 0.00 O ATOM 0 H ASP A 12 -8.487 13.754 -2.627 1.00 0.00 H new ATOM 0 HA ASP A 12 -8.051 16.365 -3.229 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -5.534 15.258 -3.142 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -5.934 15.044 -4.834 1.00 0.00 H new ATOM 192 N MET A 13 -9.480 14.183 -4.536 1.00 0.00 N ATOM 193 CA MET A 13 -10.327 13.662 -5.602 1.00 0.00 C ATOM 194 C MET A 13 -11.727 14.269 -5.524 1.00 0.00 C ATOM 195 O MET A 13 -12.059 14.962 -4.562 1.00 0.00 O ATOM 196 CB MET A 13 -10.408 12.137 -5.511 1.00 0.00 C ATOM 197 CG MET A 13 -11.571 11.535 -6.283 1.00 0.00 C ATOM 198 SD MET A 13 -11.367 9.770 -6.585 1.00 0.00 S ATOM 199 CE MET A 13 -10.931 9.196 -4.946 1.00 0.00 C ATOM 0 H MET A 13 -9.768 13.906 -3.598 1.00 0.00 H new ATOM 0 HA MET A 13 -9.885 13.938 -6.560 1.00 0.00 H new ATOM 0 HB2 MET A 13 -9.477 11.711 -5.885 1.00 0.00 H new ATOM 0 HB3 MET A 13 -10.492 11.849 -4.463 1.00 0.00 H new ATOM 0 HG2 MET A 13 -12.494 11.700 -5.728 1.00 0.00 H new ATOM 0 HG3 MET A 13 -11.676 12.053 -7.236 1.00 0.00 H new ATOM 0 HE1 MET A 13 -11.049 8.114 -4.896 1.00 0.00 H new ATOM 0 HE2 MET A 13 -9.895 9.459 -4.732 1.00 0.00 H new ATOM 0 HE3 MET A 13 -11.584 9.666 -4.210 1.00 0.00 H new ATOM 209 N SER A 14 -12.540 14.007 -6.541 1.00 0.00 N ATOM 210 CA SER A 14 -13.901 14.531 -6.584 1.00 0.00 C ATOM 211 C SER A 14 -14.621 14.284 -5.261 1.00 0.00 C ATOM 212 O SER A 14 -14.641 13.164 -4.752 1.00 0.00 O ATOM 213 CB SER A 14 -14.683 13.886 -7.731 1.00 0.00 C ATOM 214 OG SER A 14 -13.872 13.741 -8.885 1.00 0.00 O ATOM 0 H SER A 14 -12.281 13.436 -7.346 1.00 0.00 H new ATOM 0 HA SER A 14 -13.844 15.607 -6.752 1.00 0.00 H new ATOM 0 HB2 SER A 14 -15.054 12.910 -7.418 1.00 0.00 H new ATOM 0 HB3 SER A 14 -15.554 14.496 -7.969 1.00 0.00 H new ATOM 0 HG SER A 14 -14.395 13.325 -9.602 1.00 0.00 H new ATOM 220 N GLU A 15 -15.210 15.339 -4.710 1.00 0.00 N ATOM 221 CA GLU A 15 -15.931 15.236 -3.446 1.00 0.00 C ATOM 222 C GLU A 15 -16.621 13.881 -3.325 1.00 0.00 C ATOM 223 O GLU A 15 -16.117 12.977 -2.660 1.00 0.00 O ATOM 224 CB GLU A 15 -16.961 16.361 -3.328 1.00 0.00 C ATOM 225 CG GLU A 15 -16.721 17.511 -4.293 1.00 0.00 C ATOM 226 CD GLU A 15 -16.018 18.685 -3.639 1.00 0.00 C ATOM 227 OE1 GLU A 15 -15.000 18.459 -2.950 1.00 0.00 O ATOM 228 OE2 GLU A 15 -16.483 19.831 -3.816 1.00 0.00 O ATOM 0 H GLU A 15 -15.203 16.274 -5.117 1.00 0.00 H new ATOM 0 HA GLU A 15 -15.209 15.330 -2.635 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -17.956 15.951 -3.505 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -16.951 16.746 -2.308 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -16.123 17.157 -5.133 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -17.676 17.845 -4.699 1.00 0.00 H new ATOM 235 N GLU A 16 -17.772 13.745 -3.974 1.00 0.00 N ATOM 236 CA GLU A 16 -18.523 12.496 -3.937 1.00 0.00 C ATOM 237 C GLU A 16 -17.598 11.306 -4.172 1.00 0.00 C ATOM 238 O GLU A 16 -17.905 10.180 -3.778 1.00 0.00 O ATOM 239 CB GLU A 16 -19.636 12.509 -4.987 1.00 0.00 C ATOM 240 CG GLU A 16 -21.004 12.852 -4.418 1.00 0.00 C ATOM 241 CD GLU A 16 -21.740 11.635 -3.892 1.00 0.00 C ATOM 242 OE1 GLU A 16 -22.450 10.981 -4.684 1.00 0.00 O ATOM 243 OE2 GLU A 16 -21.606 11.336 -2.686 1.00 0.00 O ATOM 0 H GLU A 16 -18.204 14.482 -4.531 1.00 0.00 H new ATOM 0 HA GLU A 16 -18.973 12.399 -2.949 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -19.383 13.231 -5.764 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -19.685 11.531 -5.465 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -20.887 13.577 -3.613 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -21.606 13.329 -5.192 1.00 0.00 H new ATOM 250 N MET A 17 -16.461 11.563 -4.813 1.00 0.00 N ATOM 251 CA MET A 17 -15.489 10.513 -5.096 1.00 0.00 C ATOM 252 C MET A 17 -14.709 10.151 -3.835 1.00 0.00 C ATOM 253 O MET A 17 -14.435 8.979 -3.578 1.00 0.00 O ATOM 254 CB MET A 17 -14.524 10.956 -6.199 1.00 0.00 C ATOM 255 CG MET A 17 -15.057 10.724 -7.604 1.00 0.00 C ATOM 256 SD MET A 17 -14.034 9.586 -8.558 1.00 0.00 S ATOM 257 CE MET A 17 -14.011 8.158 -7.474 1.00 0.00 C ATOM 0 H MET A 17 -16.191 12.489 -5.146 1.00 0.00 H new ATOM 0 HA MET A 17 -16.031 9.632 -5.438 1.00 0.00 H new ATOM 0 HB2 MET A 17 -14.304 12.016 -6.073 1.00 0.00 H new ATOM 0 HB3 MET A 17 -13.582 10.419 -6.083 1.00 0.00 H new ATOM 0 HG2 MET A 17 -16.071 10.330 -7.543 1.00 0.00 H new ATOM 0 HG3 MET A 17 -15.117 11.678 -8.128 1.00 0.00 H new ATOM 0 HE1 MET A 17 -13.773 7.266 -8.053 1.00 0.00 H new ATOM 0 HE2 MET A 17 -13.257 8.301 -6.700 1.00 0.00 H new ATOM 0 HE3 MET A 17 -14.990 8.038 -7.009 1.00 0.00 H new ATOM 267 N GLN A 18 -14.362 11.166 -3.049 1.00 0.00 N ATOM 268 CA GLN A 18 -13.621 10.952 -1.810 1.00 0.00 C ATOM 269 C GLN A 18 -14.492 10.235 -0.784 1.00 0.00 C ATOM 270 O GLN A 18 -14.021 9.365 -0.050 1.00 0.00 O ATOM 271 CB GLN A 18 -13.129 12.285 -1.236 1.00 0.00 C ATOM 272 CG GLN A 18 -13.595 13.500 -2.020 1.00 0.00 C ATOM 273 CD GLN A 18 -12.527 14.572 -2.120 1.00 0.00 C ATOM 274 OE1 GLN A 18 -11.273 14.148 -2.222 1.00 0.00 O flip ATOM 275 NE2 GLN A 18 -12.826 15.765 -2.105 1.00 0.00 N flip ATOM 0 H GLN A 18 -14.581 12.142 -3.247 1.00 0.00 H new ATOM 0 HA GLN A 18 -12.756 10.329 -2.036 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -13.473 12.375 -0.206 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -12.039 12.278 -1.209 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -13.889 13.190 -3.023 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -14.481 13.918 -1.543 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -13.804 16.045 -2.025 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -12.096 16.475 -2.173 1.00 0.00 H new ATOM 284 N GLN A 19 -15.770 10.595 -0.754 1.00 0.00 N ATOM 285 CA GLN A 19 -16.714 9.978 0.166 1.00 0.00 C ATOM 286 C GLN A 19 -17.028 8.568 -0.298 1.00 0.00 C ATOM 287 O GLN A 19 -17.183 7.651 0.510 1.00 0.00 O ATOM 288 CB GLN A 19 -17.997 10.805 0.249 1.00 0.00 C ATOM 289 CG GLN A 19 -17.752 12.302 0.353 1.00 0.00 C ATOM 290 CD GLN A 19 -18.292 12.891 1.641 1.00 0.00 C ATOM 291 OE1 GLN A 19 -19.503 13.023 1.818 1.00 0.00 O ATOM 292 NE2 GLN A 19 -17.393 13.250 2.550 1.00 0.00 N ATOM 0 H GLN A 19 -16.175 11.311 -1.357 1.00 0.00 H new ATOM 0 HA GLN A 19 -16.267 9.938 1.159 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -18.605 10.606 -0.633 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -18.574 10.479 1.114 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -16.681 12.497 0.289 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -18.218 12.803 -0.495 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -16.399 13.123 2.362 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -17.697 13.653 3.436 1.00 0.00 H new ATOM 301 N ASP A 20 -17.102 8.399 -1.613 1.00 0.00 N ATOM 302 CA ASP A 20 -17.379 7.099 -2.195 1.00 0.00 C ATOM 303 C ASP A 20 -16.217 6.154 -1.925 1.00 0.00 C ATOM 304 O ASP A 20 -16.416 4.978 -1.618 1.00 0.00 O ATOM 305 CB ASP A 20 -17.621 7.224 -3.700 1.00 0.00 C ATOM 306 CG ASP A 20 -18.798 6.390 -4.165 1.00 0.00 C ATOM 307 OD1 ASP A 20 -18.990 5.281 -3.625 1.00 0.00 O ATOM 308 OD2 ASP A 20 -19.530 6.847 -5.069 1.00 0.00 O ATOM 0 H ASP A 20 -16.973 9.148 -2.293 1.00 0.00 H new ATOM 0 HA ASP A 20 -18.281 6.695 -1.736 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -17.798 8.270 -3.952 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -16.724 6.914 -4.237 1.00 0.00 H new ATOM 313 N SER A 21 -15.002 6.685 -2.020 1.00 0.00 N ATOM 314 CA SER A 21 -13.804 5.897 -1.765 1.00 0.00 C ATOM 315 C SER A 21 -13.829 5.371 -0.337 1.00 0.00 C ATOM 316 O SER A 21 -13.595 4.187 -0.095 1.00 0.00 O ATOM 317 CB SER A 21 -12.547 6.738 -1.997 1.00 0.00 C ATOM 318 OG SER A 21 -12.045 7.254 -0.777 1.00 0.00 O ATOM 0 H SER A 21 -14.822 7.657 -2.272 1.00 0.00 H new ATOM 0 HA SER A 21 -13.784 5.055 -2.456 1.00 0.00 H new ATOM 0 HB2 SER A 21 -11.783 6.129 -2.480 1.00 0.00 H new ATOM 0 HB3 SER A 21 -12.776 7.559 -2.676 1.00 0.00 H new ATOM 0 HG SER A 21 -12.645 7.955 -0.447 1.00 0.00 H new ATOM 324 N VAL A 22 -14.131 6.260 0.606 1.00 0.00 N ATOM 325 CA VAL A 22 -14.206 5.882 2.010 1.00 0.00 C ATOM 326 C VAL A 22 -15.135 4.686 2.187 1.00 0.00 C ATOM 327 O VAL A 22 -14.773 3.692 2.816 1.00 0.00 O ATOM 328 CB VAL A 22 -14.711 7.046 2.882 1.00 0.00 C ATOM 329 CG1 VAL A 22 -14.667 6.669 4.355 1.00 0.00 C ATOM 330 CG2 VAL A 22 -13.895 8.302 2.621 1.00 0.00 C ATOM 0 H VAL A 22 -14.327 7.244 0.422 1.00 0.00 H new ATOM 0 HA VAL A 22 -13.198 5.619 2.331 1.00 0.00 H new ATOM 0 HB VAL A 22 -15.747 7.252 2.615 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -15.028 7.504 4.955 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -15.300 5.799 4.527 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -13.642 6.434 4.640 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -14.267 9.114 3.246 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -12.848 8.112 2.858 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -13.984 8.582 1.571 1.00 0.00 H new ATOM 340 N GLU A 23 -16.333 4.789 1.616 1.00 0.00 N ATOM 341 CA GLU A 23 -17.313 3.712 1.697 1.00 0.00 C ATOM 342 C GLU A 23 -16.704 2.407 1.198 1.00 0.00 C ATOM 343 O GLU A 23 -16.830 1.365 1.841 1.00 0.00 O ATOM 344 CB GLU A 23 -18.556 4.059 0.873 1.00 0.00 C ATOM 345 CG GLU A 23 -19.234 5.349 1.306 1.00 0.00 C ATOM 346 CD GLU A 23 -20.668 5.447 0.822 1.00 0.00 C ATOM 347 OE1 GLU A 23 -21.035 4.698 -0.107 1.00 0.00 O ATOM 348 OE2 GLU A 23 -21.425 6.275 1.373 1.00 0.00 O ATOM 0 H GLU A 23 -16.647 5.607 1.093 1.00 0.00 H new ATOM 0 HA GLU A 23 -17.607 3.589 2.739 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -18.274 4.141 -0.177 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -19.271 3.240 0.948 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -19.216 5.417 2.394 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -18.667 6.198 0.925 1.00 0.00 H new ATOM 355 N CYS A 24 -16.034 2.479 0.053 1.00 0.00 N ATOM 356 CA CYS A 24 -15.392 1.307 -0.529 1.00 0.00 C ATOM 357 C CYS A 24 -14.366 0.738 0.442 1.00 0.00 C ATOM 358 O CYS A 24 -14.225 -0.481 0.577 1.00 0.00 O ATOM 359 CB CYS A 24 -14.720 1.670 -1.855 1.00 0.00 C ATOM 360 SG CYS A 24 -15.852 1.741 -3.262 1.00 0.00 S ATOM 0 H CYS A 24 -15.922 3.335 -0.489 1.00 0.00 H new ATOM 0 HA CYS A 24 -16.153 0.551 -0.722 1.00 0.00 H new ATOM 0 HB2 CYS A 24 -14.229 2.637 -1.748 1.00 0.00 H new ATOM 0 HB3 CYS A 24 -13.940 0.939 -2.067 1.00 0.00 H new ATOM 0 HG CYS A 24 -15.365 2.533 -4.171 1.00 0.00 H new ATOM 366 N ALA A 25 -13.677 1.629 1.146 1.00 0.00 N ATOM 367 CA ALA A 25 -12.695 1.216 2.130 1.00 0.00 C ATOM 368 C ALA A 25 -13.427 0.578 3.289 1.00 0.00 C ATOM 369 O ALA A 25 -12.910 -0.306 3.973 1.00 0.00 O ATOM 370 CB ALA A 25 -11.867 2.404 2.597 1.00 0.00 C ATOM 0 H ALA A 25 -13.783 2.639 1.051 1.00 0.00 H new ATOM 0 HA ALA A 25 -12.005 0.497 1.689 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -11.137 2.071 3.335 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -11.348 2.843 1.745 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -12.522 3.150 3.046 1.00 0.00 H new ATOM 376 N THR A 26 -14.660 1.029 3.473 1.00 0.00 N ATOM 377 CA THR A 26 -15.522 0.514 4.515 1.00 0.00 C ATOM 378 C THR A 26 -15.997 -0.881 4.139 1.00 0.00 C ATOM 379 O THR A 26 -16.070 -1.773 4.981 1.00 0.00 O ATOM 380 CB THR A 26 -16.715 1.443 4.712 1.00 0.00 C ATOM 381 OG1 THR A 26 -16.329 2.797 4.551 1.00 0.00 O ATOM 382 CG2 THR A 26 -17.349 1.310 6.073 1.00 0.00 C ATOM 0 H THR A 26 -15.085 1.760 2.903 1.00 0.00 H new ATOM 0 HA THR A 26 -14.965 0.461 5.450 1.00 0.00 H new ATOM 0 HB THR A 26 -17.442 1.147 3.955 1.00 0.00 H new ATOM 0 HG1 THR A 26 -15.855 2.903 3.700 1.00 0.00 H new ATOM 0 HG21 THR A 26 -18.192 1.997 6.151 1.00 0.00 H new ATOM 0 HG22 THR A 26 -17.700 0.288 6.212 1.00 0.00 H new ATOM 0 HG23 THR A 26 -16.614 1.549 6.842 1.00 0.00 H new ATOM 390 N GLN A 27 -16.300 -1.064 2.856 1.00 0.00 N ATOM 391 CA GLN A 27 -16.744 -2.356 2.355 1.00 0.00 C ATOM 392 C GLN A 27 -15.697 -3.410 2.678 1.00 0.00 C ATOM 393 O GLN A 27 -16.018 -4.512 3.124 1.00 0.00 O ATOM 394 CB GLN A 27 -16.978 -2.294 0.843 1.00 0.00 C ATOM 395 CG GLN A 27 -18.202 -1.485 0.447 1.00 0.00 C ATOM 396 CD GLN A 27 -19.500 -2.208 0.751 1.00 0.00 C ATOM 397 OE1 GLN A 27 -19.856 -2.270 2.027 1.00 0.00 O flip ATOM 398 NE2 GLN A 27 -20.174 -2.705 -0.153 1.00 0.00 N flip ATOM 0 H GLN A 27 -16.245 -0.333 2.147 1.00 0.00 H new ATOM 0 HA GLN A 27 -17.685 -2.619 2.837 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -16.098 -1.863 0.366 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -17.084 -3.309 0.459 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -18.189 -0.531 0.974 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -18.156 -1.261 -0.619 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -19.861 -2.633 -1.121 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -21.045 -3.188 0.067 1.00 0.00 H new ATOM 407 N ALA A 28 -14.436 -3.049 2.468 1.00 0.00 N ATOM 408 CA ALA A 28 -13.326 -3.947 2.752 1.00 0.00 C ATOM 409 C ALA A 28 -13.076 -4.015 4.253 1.00 0.00 C ATOM 410 O ALA A 28 -12.622 -5.032 4.777 1.00 0.00 O ATOM 411 CB ALA A 28 -12.070 -3.483 2.030 1.00 0.00 C ATOM 0 H ALA A 28 -14.158 -2.139 2.101 1.00 0.00 H new ATOM 0 HA ALA A 28 -13.584 -4.943 2.393 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -11.249 -4.165 2.253 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -12.251 -3.472 0.955 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -11.808 -2.479 2.364 1.00 0.00 H new ATOM 417 N LEU A 29 -13.381 -2.916 4.938 1.00 0.00 N ATOM 418 CA LEU A 29 -13.197 -2.829 6.379 1.00 0.00 C ATOM 419 C LEU A 29 -14.239 -3.659 7.119 1.00 0.00 C ATOM 420 O LEU A 29 -13.982 -4.173 8.208 1.00 0.00 O ATOM 421 CB LEU A 29 -13.286 -1.375 6.832 1.00 0.00 C ATOM 422 CG LEU A 29 -12.000 -0.577 6.653 1.00 0.00 C ATOM 423 CD1 LEU A 29 -12.316 0.852 6.260 1.00 0.00 C ATOM 424 CD2 LEU A 29 -11.171 -0.611 7.926 1.00 0.00 C ATOM 0 H LEU A 29 -13.759 -2.070 4.512 1.00 0.00 H new ATOM 0 HA LEU A 29 -12.209 -3.225 6.615 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -14.084 -0.883 6.276 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -13.569 -1.352 7.884 1.00 0.00 H new ATOM 0 HG LEU A 29 -11.417 -1.033 5.853 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -11.387 1.409 6.136 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -12.870 0.857 5.322 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -12.918 1.319 7.040 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -10.256 -0.036 7.780 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -11.745 -0.178 8.746 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -10.916 -1.643 8.167 1.00 0.00 H new ATOM 436 N GLU A 30 -15.419 -3.779 6.521 1.00 0.00 N ATOM 437 CA GLU A 30 -16.507 -4.539 7.121 1.00 0.00 C ATOM 438 C GLU A 30 -16.545 -5.959 6.569 1.00 0.00 C ATOM 439 O GLU A 30 -17.180 -6.842 7.145 1.00 0.00 O ATOM 440 CB GLU A 30 -17.842 -3.835 6.867 1.00 0.00 C ATOM 441 CG GLU A 30 -18.125 -2.704 7.843 1.00 0.00 C ATOM 442 CD GLU A 30 -19.468 -2.852 8.530 1.00 0.00 C ATOM 443 OE1 GLU A 30 -19.824 -3.992 8.896 1.00 0.00 O ATOM 444 OE2 GLU A 30 -20.164 -1.829 8.702 1.00 0.00 O ATOM 0 H GLU A 30 -15.646 -3.359 5.620 1.00 0.00 H new ATOM 0 HA GLU A 30 -16.335 -4.596 8.196 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -17.847 -3.438 5.852 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -18.647 -4.567 6.928 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -17.337 -2.672 8.596 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -18.096 -1.753 7.311 1.00 0.00 H new ATOM 451 N LYS A 31 -15.857 -6.170 5.452 1.00 0.00 N ATOM 452 CA LYS A 31 -15.807 -7.484 4.824 1.00 0.00 C ATOM 453 C LYS A 31 -14.600 -8.273 5.317 1.00 0.00 C ATOM 454 O LYS A 31 -14.592 -9.504 5.279 1.00 0.00 O ATOM 455 CB LYS A 31 -15.751 -7.338 3.302 1.00 0.00 C ATOM 456 CG LYS A 31 -17.098 -7.523 2.624 1.00 0.00 C ATOM 457 CD LYS A 31 -18.059 -6.402 2.985 1.00 0.00 C ATOM 458 CE LYS A 31 -19.360 -6.509 2.204 1.00 0.00 C ATOM 459 NZ LYS A 31 -19.685 -5.244 1.489 1.00 0.00 N ATOM 0 H LYS A 31 -15.327 -5.448 4.964 1.00 0.00 H new ATOM 0 HA LYS A 31 -16.710 -8.029 5.097 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -15.361 -6.351 3.054 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -15.048 -8.068 2.901 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -16.962 -7.554 1.543 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -17.527 -8.481 2.918 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -18.271 -6.434 4.054 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -17.590 -5.439 2.782 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -19.285 -7.324 1.484 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -20.173 -6.760 2.886 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -20.633 -5.317 1.068 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -19.665 -4.450 2.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -18.984 -5.080 0.738 1.00 0.00 H new ATOM 473 N TYR A 32 -13.581 -7.557 5.783 1.00 0.00 N ATOM 474 CA TYR A 32 -12.368 -8.189 6.289 1.00 0.00 C ATOM 475 C TYR A 32 -11.551 -7.204 7.118 1.00 0.00 C ATOM 476 O TYR A 32 -11.357 -6.055 6.720 1.00 0.00 O ATOM 477 CB TYR A 32 -11.518 -8.730 5.135 1.00 0.00 C ATOM 478 CG TYR A 32 -12.159 -8.572 3.773 1.00 0.00 C ATOM 479 CD1 TYR A 32 -12.332 -7.315 3.207 1.00 0.00 C ATOM 480 CD2 TYR A 32 -12.587 -9.680 3.053 1.00 0.00 C ATOM 481 CE1 TYR A 32 -12.915 -7.167 1.963 1.00 0.00 C ATOM 482 CE2 TYR A 32 -13.171 -9.540 1.808 1.00 0.00 C ATOM 483 CZ TYR A 32 -13.332 -8.283 1.268 1.00 0.00 C ATOM 484 OH TYR A 32 -13.913 -8.140 0.028 1.00 0.00 O ATOM 0 H TYR A 32 -13.572 -6.538 5.820 1.00 0.00 H new ATOM 0 HA TYR A 32 -12.665 -9.021 6.927 1.00 0.00 H new ATOM 0 HB2 TYR A 32 -10.556 -8.218 5.134 1.00 0.00 H new ATOM 0 HB3 TYR A 32 -11.316 -9.787 5.310 1.00 0.00 H new ATOM 0 HD1 TYR A 32 -12.005 -6.439 3.748 1.00 0.00 H new ATOM 0 HD2 TYR A 32 -12.461 -10.667 3.473 1.00 0.00 H new ATOM 0 HE1 TYR A 32 -13.043 -6.183 1.537 1.00 0.00 H new ATOM 0 HE2 TYR A 32 -13.499 -10.412 1.261 1.00 0.00 H new ATOM 0 HH TYR A 32 -14.149 -9.023 -0.327 1.00 0.00 H new ATOM 494 N ASN A 33 -11.075 -7.660 8.271 1.00 0.00 N ATOM 495 CA ASN A 33 -10.278 -6.818 9.154 1.00 0.00 C ATOM 496 C ASN A 33 -8.788 -7.047 8.925 1.00 0.00 C ATOM 497 O ASN A 33 -8.002 -7.083 9.870 1.00 0.00 O ATOM 498 CB ASN A 33 -10.631 -7.097 10.617 1.00 0.00 C ATOM 499 CG ASN A 33 -10.201 -5.974 11.539 1.00 0.00 C ATOM 500 OD1 ASN A 33 -9.237 -5.261 11.259 1.00 0.00 O ATOM 501 ND2 ASN A 33 -10.914 -5.811 12.647 1.00 0.00 N ATOM 0 H ASN A 33 -11.227 -8.608 8.616 1.00 0.00 H new ATOM 0 HA ASN A 33 -10.506 -5.777 8.926 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -11.707 -7.245 10.706 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -10.154 -8.025 10.932 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -10.670 -5.072 13.306 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -11.705 -6.425 12.839 1.00 0.00 H new ATOM 508 N ILE A 34 -8.408 -7.200 7.660 1.00 0.00 N ATOM 509 CA ILE A 34 -7.013 -7.423 7.301 1.00 0.00 C ATOM 510 C ILE A 34 -6.485 -6.289 6.432 1.00 0.00 C ATOM 511 O ILE A 34 -6.771 -6.234 5.238 1.00 0.00 O ATOM 512 CB ILE A 34 -6.833 -8.754 6.546 1.00 0.00 C ATOM 513 CG1 ILE A 34 -7.340 -9.922 7.388 1.00 0.00 C ATOM 514 CG2 ILE A 34 -5.372 -8.955 6.172 1.00 0.00 C ATOM 515 CD1 ILE A 34 -6.733 -9.971 8.768 1.00 0.00 C ATOM 0 H ILE A 34 -9.048 -7.173 6.866 1.00 0.00 H new ATOM 0 HA ILE A 34 -6.448 -7.462 8.233 1.00 0.00 H new ATOM 0 HB ILE A 34 -7.422 -8.716 5.630 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -8.424 -9.852 7.478 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -7.122 -10.856 6.870 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -5.259 -9.899 5.639 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -5.044 -8.136 5.532 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -4.764 -8.974 7.077 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -7.136 -10.825 9.313 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -5.651 -10.071 8.686 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -6.973 -9.052 9.304 1.00 0.00 H new ATOM 527 N GLU A 35 -5.717 -5.387 7.044 1.00 0.00 N ATOM 528 CA GLU A 35 -5.143 -4.243 6.336 1.00 0.00 C ATOM 529 C GLU A 35 -5.058 -4.502 4.836 1.00 0.00 C ATOM 530 O GLU A 35 -5.987 -4.191 4.091 1.00 0.00 O ATOM 531 CB GLU A 35 -3.751 -3.926 6.886 1.00 0.00 C ATOM 532 CG GLU A 35 -3.682 -2.612 7.646 1.00 0.00 C ATOM 533 CD GLU A 35 -3.692 -2.807 9.150 1.00 0.00 C ATOM 534 OE1 GLU A 35 -3.954 -3.943 9.599 1.00 0.00 O ATOM 535 OE2 GLU A 35 -3.439 -1.825 9.878 1.00 0.00 O ATOM 0 H GLU A 35 -5.477 -5.428 8.035 1.00 0.00 H new ATOM 0 HA GLU A 35 -5.800 -3.389 6.497 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -3.437 -4.735 7.546 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -3.041 -3.896 6.059 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -2.777 -2.077 7.359 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -4.527 -1.986 7.359 1.00 0.00 H new ATOM 542 N LYS A 36 -3.941 -5.072 4.398 1.00 0.00 N ATOM 543 CA LYS A 36 -3.743 -5.370 2.986 1.00 0.00 C ATOM 544 C LYS A 36 -5.049 -5.826 2.342 1.00 0.00 C ATOM 545 O LYS A 36 -5.385 -5.411 1.233 1.00 0.00 O ATOM 546 CB LYS A 36 -2.669 -6.446 2.811 1.00 0.00 C ATOM 547 CG LYS A 36 -1.717 -6.552 3.989 1.00 0.00 C ATOM 548 CD LYS A 36 -0.310 -6.905 3.537 1.00 0.00 C ATOM 549 CE LYS A 36 -0.285 -8.220 2.774 1.00 0.00 C ATOM 550 NZ LYS A 36 0.747 -8.222 1.702 1.00 0.00 N ATOM 0 H LYS A 36 -3.161 -5.336 5.000 1.00 0.00 H new ATOM 0 HA LYS A 36 -3.411 -4.458 2.491 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -3.154 -7.410 2.659 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -2.095 -6.232 1.909 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -1.700 -5.606 4.531 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -2.078 -7.311 4.683 1.00 0.00 H new ATOM 0 HD2 LYS A 36 0.081 -6.108 2.904 1.00 0.00 H new ATOM 0 HD3 LYS A 36 0.346 -6.974 4.405 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -0.089 -9.038 3.467 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -1.265 -8.403 2.334 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 0.731 -9.136 1.206 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 0.546 -7.458 1.026 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 1.686 -8.073 2.124 1.00 0.00 H new ATOM 564 N ASP A 37 -5.784 -6.679 3.049 1.00 0.00 N ATOM 565 CA ASP A 37 -7.057 -7.188 2.550 1.00 0.00 C ATOM 566 C ASP A 37 -8.015 -6.037 2.256 1.00 0.00 C ATOM 567 O ASP A 37 -8.505 -5.895 1.136 1.00 0.00 O ATOM 568 CB ASP A 37 -7.684 -8.144 3.568 1.00 0.00 C ATOM 569 CG ASP A 37 -8.998 -8.726 3.083 1.00 0.00 C ATOM 570 OD1 ASP A 37 -9.770 -7.990 2.432 1.00 0.00 O ATOM 571 OD2 ASP A 37 -9.256 -9.918 3.355 1.00 0.00 O ATOM 0 H ASP A 37 -5.520 -7.032 3.969 1.00 0.00 H new ATOM 0 HA ASP A 37 -6.870 -7.732 1.624 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -6.986 -8.955 3.778 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -7.849 -7.614 4.506 1.00 0.00 H new ATOM 576 N ILE A 38 -8.269 -5.215 3.269 1.00 0.00 N ATOM 577 CA ILE A 38 -9.158 -4.070 3.122 1.00 0.00 C ATOM 578 C ILE A 38 -8.743 -3.221 1.926 1.00 0.00 C ATOM 579 O ILE A 38 -9.579 -2.822 1.115 1.00 0.00 O ATOM 580 CB ILE A 38 -9.154 -3.193 4.389 1.00 0.00 C ATOM 581 CG1 ILE A 38 -9.223 -4.070 5.640 1.00 0.00 C ATOM 582 CG2 ILE A 38 -10.312 -2.209 4.359 1.00 0.00 C ATOM 583 CD1 ILE A 38 -8.810 -3.353 6.906 1.00 0.00 C ATOM 0 H ILE A 38 -7.871 -5.322 4.202 1.00 0.00 H new ATOM 0 HA ILE A 38 -10.165 -4.457 2.964 1.00 0.00 H new ATOM 0 HB ILE A 38 -8.224 -2.624 4.417 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -10.241 -4.440 5.758 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -8.582 -4.940 5.499 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -10.294 -1.598 5.261 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -10.221 -1.566 3.483 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -11.253 -2.756 4.311 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -8.884 -4.036 7.752 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -7.781 -3.006 6.809 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -9.467 -2.499 7.071 1.00 0.00 H new ATOM 595 N ALA A 39 -7.446 -2.960 1.819 1.00 0.00 N ATOM 596 CA ALA A 39 -6.917 -2.170 0.716 1.00 0.00 C ATOM 597 C ALA A 39 -7.191 -2.864 -0.611 1.00 0.00 C ATOM 598 O ALA A 39 -7.641 -2.238 -1.571 1.00 0.00 O ATOM 599 CB ALA A 39 -5.424 -1.938 0.900 1.00 0.00 C ATOM 0 H ALA A 39 -6.742 -3.284 2.482 1.00 0.00 H new ATOM 0 HA ALA A 39 -7.418 -1.202 0.708 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -5.042 -1.346 0.068 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -5.251 -1.404 1.834 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -4.908 -2.897 0.930 1.00 0.00 H new ATOM 605 N ALA A 40 -6.928 -4.167 -0.652 1.00 0.00 N ATOM 606 CA ALA A 40 -7.158 -4.956 -1.855 1.00 0.00 C ATOM 607 C ALA A 40 -8.609 -4.827 -2.302 1.00 0.00 C ATOM 608 O ALA A 40 -8.895 -4.289 -3.371 1.00 0.00 O ATOM 609 CB ALA A 40 -6.805 -6.415 -1.606 1.00 0.00 C ATOM 0 H ALA A 40 -6.555 -4.698 0.135 1.00 0.00 H new ATOM 0 HA ALA A 40 -6.516 -4.576 -2.650 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -6.982 -6.992 -2.514 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -5.755 -6.492 -1.326 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -7.425 -6.807 -0.800 1.00 0.00 H new ATOM 615 N HIS A 41 -9.521 -5.312 -1.467 1.00 0.00 N ATOM 616 CA HIS A 41 -10.945 -5.239 -1.765 1.00 0.00 C ATOM 617 C HIS A 41 -11.273 -3.902 -2.425 1.00 0.00 C ATOM 618 O HIS A 41 -11.880 -3.855 -3.494 1.00 0.00 O ATOM 619 CB HIS A 41 -11.756 -5.433 -0.471 1.00 0.00 C ATOM 620 CG HIS A 41 -13.082 -4.727 -0.440 1.00 0.00 C ATOM 621 ND1 HIS A 41 -14.261 -5.361 -0.103 1.00 0.00 N ATOM 622 CD2 HIS A 41 -13.411 -3.436 -0.683 1.00 0.00 C ATOM 623 CE1 HIS A 41 -15.255 -4.490 -0.142 1.00 0.00 C ATOM 624 NE2 HIS A 41 -14.765 -3.316 -0.491 1.00 0.00 N ATOM 0 H HIS A 41 -9.299 -5.760 -0.578 1.00 0.00 H new ATOM 0 HA HIS A 41 -11.213 -6.034 -2.461 1.00 0.00 H new ATOM 0 HB2 HIS A 41 -11.926 -6.499 -0.323 1.00 0.00 H new ATOM 0 HB3 HIS A 41 -11.157 -5.086 0.371 1.00 0.00 H new ATOM 0 HD1 HIS A 41 -14.351 -6.348 0.139 1.00 0.00 H new ATOM 0 HD2 HIS A 41 -12.734 -2.647 -0.974 1.00 0.00 H new ATOM 0 HE1 HIS A 41 -16.291 -4.703 0.075 1.00 0.00 H new ATOM 633 N ILE A 42 -10.859 -2.816 -1.776 1.00 0.00 N ATOM 634 CA ILE A 42 -11.099 -1.472 -2.291 1.00 0.00 C ATOM 635 C ILE A 42 -10.541 -1.314 -3.702 1.00 0.00 C ATOM 636 O ILE A 42 -11.291 -1.170 -4.667 1.00 0.00 O ATOM 637 CB ILE A 42 -10.466 -0.400 -1.381 1.00 0.00 C ATOM 638 CG1 ILE A 42 -11.049 -0.485 0.032 1.00 0.00 C ATOM 639 CG2 ILE A 42 -10.683 0.987 -1.966 1.00 0.00 C ATOM 640 CD1 ILE A 42 -10.078 -0.065 1.118 1.00 0.00 C ATOM 0 H ILE A 42 -10.354 -2.842 -0.890 1.00 0.00 H new ATOM 0 HA ILE A 42 -12.180 -1.331 -2.312 1.00 0.00 H new ATOM 0 HB ILE A 42 -9.393 -0.585 -1.322 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -11.937 0.145 0.088 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -11.372 -1.509 0.221 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -10.230 1.733 -1.312 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -10.222 1.042 -2.952 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -11.752 1.182 -2.053 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -10.561 -0.151 2.091 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -9.200 -0.710 1.090 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -9.774 0.969 0.954 1.00 0.00 H new ATOM 652 N LYS A 43 -9.216 -1.340 -3.813 1.00 0.00 N ATOM 653 CA LYS A 43 -8.551 -1.197 -5.102 1.00 0.00 C ATOM 654 C LYS A 43 -9.331 -1.904 -6.207 1.00 0.00 C ATOM 655 O LYS A 43 -9.805 -1.268 -7.146 1.00 0.00 O ATOM 656 CB LYS A 43 -7.128 -1.754 -5.031 1.00 0.00 C ATOM 657 CG LYS A 43 -6.132 -0.996 -5.894 1.00 0.00 C ATOM 658 CD LYS A 43 -5.834 -1.741 -7.185 1.00 0.00 C ATOM 659 CE LYS A 43 -6.975 -1.604 -8.180 1.00 0.00 C ATOM 660 NZ LYS A 43 -7.254 -2.883 -8.889 1.00 0.00 N ATOM 0 H LYS A 43 -8.581 -1.459 -3.023 1.00 0.00 H new ATOM 0 HA LYS A 43 -8.508 -0.134 -5.340 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -6.789 -1.731 -3.995 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -7.141 -2.799 -5.339 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -6.528 -0.008 -6.126 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -5.207 -0.846 -5.337 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -4.916 -1.354 -7.627 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -5.663 -2.795 -6.967 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -7.874 -1.276 -7.658 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -6.730 -0.832 -8.909 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -6.857 -2.841 -9.849 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -6.818 -3.671 -8.368 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -8.282 -3.032 -8.945 1.00 0.00 H new ATOM 674 N LYS A 44 -9.456 -3.221 -6.089 1.00 0.00 N ATOM 675 CA LYS A 44 -10.176 -4.013 -7.081 1.00 0.00 C ATOM 676 C LYS A 44 -11.481 -3.334 -7.481 1.00 0.00 C ATOM 677 O LYS A 44 -11.716 -3.055 -8.658 1.00 0.00 O ATOM 678 CB LYS A 44 -10.462 -5.415 -6.539 1.00 0.00 C ATOM 679 CG LYS A 44 -11.352 -6.249 -7.447 1.00 0.00 C ATOM 680 CD LYS A 44 -10.702 -7.580 -7.792 1.00 0.00 C ATOM 681 CE LYS A 44 -11.649 -8.476 -8.576 1.00 0.00 C ATOM 682 NZ LYS A 44 -10.919 -9.341 -9.544 1.00 0.00 N ATOM 0 H LYS A 44 -9.069 -3.763 -5.317 1.00 0.00 H new ATOM 0 HA LYS A 44 -9.545 -4.095 -7.966 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -9.517 -5.938 -6.391 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -10.935 -5.328 -5.561 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -12.310 -6.426 -6.957 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -11.560 -5.696 -8.363 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -9.799 -7.404 -8.376 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -10.396 -8.085 -6.876 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -12.214 -9.101 -7.884 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -12.371 -7.860 -9.112 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -11.599 -9.937 -10.059 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -10.400 -8.745 -10.220 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -10.248 -9.947 -9.030 1.00 0.00 H new ATOM 696 N GLU A 45 -12.327 -3.075 -6.493 1.00 0.00 N ATOM 697 CA GLU A 45 -13.614 -2.432 -6.734 1.00 0.00 C ATOM 698 C GLU A 45 -13.443 -1.127 -7.506 1.00 0.00 C ATOM 699 O GLU A 45 -14.019 -0.951 -8.578 1.00 0.00 O ATOM 700 CB GLU A 45 -14.331 -2.167 -5.408 1.00 0.00 C ATOM 701 CG GLU A 45 -15.650 -2.911 -5.273 1.00 0.00 C ATOM 702 CD GLU A 45 -15.478 -4.415 -5.344 1.00 0.00 C ATOM 703 OE1 GLU A 45 -14.338 -4.872 -5.577 1.00 0.00 O ATOM 704 OE2 GLU A 45 -16.481 -5.137 -5.166 1.00 0.00 O ATOM 0 H GLU A 45 -12.146 -3.300 -5.515 1.00 0.00 H new ATOM 0 HA GLU A 45 -14.219 -3.108 -7.339 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -13.675 -2.454 -4.586 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -14.515 -1.097 -5.311 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -16.117 -2.646 -4.324 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -16.328 -2.588 -6.063 1.00 0.00 H new ATOM 711 N PHE A 46 -12.648 -0.215 -6.956 1.00 0.00 N ATOM 712 CA PHE A 46 -12.405 1.073 -7.598 1.00 0.00 C ATOM 713 C PHE A 46 -11.890 0.885 -9.022 1.00 0.00 C ATOM 714 O PHE A 46 -12.202 1.670 -9.916 1.00 0.00 O ATOM 715 CB PHE A 46 -11.402 1.893 -6.786 1.00 0.00 C ATOM 716 CG PHE A 46 -12.031 3.007 -5.999 1.00 0.00 C ATOM 717 CD1 PHE A 46 -12.628 2.757 -4.774 1.00 0.00 C ATOM 718 CD2 PHE A 46 -12.023 4.306 -6.484 1.00 0.00 C ATOM 719 CE1 PHE A 46 -13.206 3.780 -4.048 1.00 0.00 C ATOM 720 CE2 PHE A 46 -12.600 5.334 -5.761 1.00 0.00 C ATOM 721 CZ PHE A 46 -13.192 5.070 -4.542 1.00 0.00 C ATOM 0 H PHE A 46 -12.162 -0.343 -6.069 1.00 0.00 H new ATOM 0 HA PHE A 46 -13.352 1.611 -7.641 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -10.873 1.230 -6.101 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -10.657 2.313 -7.462 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -12.642 1.751 -4.382 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -11.561 4.517 -7.437 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -13.669 3.572 -3.095 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -12.588 6.342 -6.149 1.00 0.00 H new ATOM 0 HZ PHE A 46 -13.644 5.871 -3.975 1.00 0.00 H new ATOM 731 N ASP A 47 -11.100 -0.164 -9.225 1.00 0.00 N ATOM 732 CA ASP A 47 -10.543 -0.459 -10.538 1.00 0.00 C ATOM 733 C ASP A 47 -11.620 -1.011 -11.465 1.00 0.00 C ATOM 734 O ASP A 47 -11.482 -0.971 -12.687 1.00 0.00 O ATOM 735 CB ASP A 47 -9.394 -1.461 -10.414 1.00 0.00 C ATOM 736 CG ASP A 47 -8.641 -1.641 -11.717 1.00 0.00 C ATOM 737 OD1 ASP A 47 -7.669 -0.892 -11.951 1.00 0.00 O ATOM 738 OD2 ASP A 47 -9.022 -2.533 -12.504 1.00 0.00 O ATOM 0 H ASP A 47 -10.831 -0.824 -8.495 1.00 0.00 H new ATOM 0 HA ASP A 47 -10.159 0.468 -10.964 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -8.703 -1.123 -9.642 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -9.789 -2.424 -10.090 1.00 0.00 H new ATOM 743 N LYS A 48 -12.690 -1.527 -10.872 1.00 0.00 N ATOM 744 CA LYS A 48 -13.794 -2.090 -11.637 1.00 0.00 C ATOM 745 C LYS A 48 -15.100 -1.373 -11.317 1.00 0.00 C ATOM 746 O LYS A 48 -16.179 -1.826 -11.703 1.00 0.00 O ATOM 747 CB LYS A 48 -13.937 -3.581 -11.333 1.00 0.00 C ATOM 748 CG LYS A 48 -12.883 -4.444 -12.006 1.00 0.00 C ATOM 749 CD LYS A 48 -13.261 -4.766 -13.442 1.00 0.00 C ATOM 750 CE LYS A 48 -13.324 -3.509 -14.296 1.00 0.00 C ATOM 751 NZ LYS A 48 -12.787 -3.739 -15.665 1.00 0.00 N ATOM 0 H LYS A 48 -12.816 -1.567 -9.861 1.00 0.00 H new ATOM 0 HA LYS A 48 -13.576 -1.956 -12.696 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -13.882 -3.730 -10.255 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -14.925 -3.915 -11.651 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -11.923 -3.928 -11.988 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -12.757 -5.370 -11.445 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -12.533 -5.458 -13.865 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -14.228 -5.269 -13.461 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -14.357 -3.168 -14.364 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -12.757 -2.713 -13.813 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -12.848 -2.858 -16.214 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -11.793 -4.040 -15.602 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -13.344 -4.480 -16.136 1.00 0.00 H new ATOM 765 N LYS A 49 -15.000 -0.260 -10.602 1.00 0.00 N ATOM 766 CA LYS A 49 -16.175 0.509 -10.221 1.00 0.00 C ATOM 767 C LYS A 49 -16.029 1.981 -10.600 1.00 0.00 C ATOM 768 O LYS A 49 -16.900 2.794 -10.292 1.00 0.00 O ATOM 769 CB LYS A 49 -16.418 0.382 -8.716 1.00 0.00 C ATOM 770 CG LYS A 49 -17.885 0.443 -8.326 1.00 0.00 C ATOM 771 CD LYS A 49 -18.055 0.565 -6.820 1.00 0.00 C ATOM 772 CE LYS A 49 -18.125 2.019 -6.381 1.00 0.00 C ATOM 773 NZ LYS A 49 -19.503 2.413 -5.981 1.00 0.00 N ATOM 0 H LYS A 49 -14.116 0.130 -10.275 1.00 0.00 H new ATOM 0 HA LYS A 49 -17.029 0.105 -10.765 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -15.998 -0.561 -8.368 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -15.881 1.179 -8.202 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -18.358 1.293 -8.817 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -18.394 -0.453 -8.680 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -18.964 0.047 -6.513 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -17.222 0.072 -6.318 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -17.445 2.179 -5.544 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -17.786 2.660 -7.194 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -19.508 3.411 -5.689 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -20.148 2.285 -6.787 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -19.818 1.818 -5.188 1.00 0.00 H new ATOM 787 N TYR A 50 -14.927 2.322 -11.260 1.00 0.00 N ATOM 788 CA TYR A 50 -14.688 3.704 -11.661 1.00 0.00 C ATOM 789 C TYR A 50 -13.921 3.786 -12.978 1.00 0.00 C ATOM 790 O TYR A 50 -14.432 4.308 -13.970 1.00 0.00 O ATOM 791 CB TYR A 50 -13.923 4.443 -10.563 1.00 0.00 C ATOM 792 CG TYR A 50 -14.727 4.645 -9.298 1.00 0.00 C ATOM 793 CD1 TYR A 50 -15.621 5.704 -9.181 1.00 0.00 C ATOM 794 CD2 TYR A 50 -14.595 3.776 -8.223 1.00 0.00 C ATOM 795 CE1 TYR A 50 -16.358 5.890 -8.028 1.00 0.00 C ATOM 796 CE2 TYR A 50 -15.330 3.955 -7.066 1.00 0.00 C ATOM 797 CZ TYR A 50 -16.210 5.013 -6.974 1.00 0.00 C ATOM 798 OH TYR A 50 -16.943 5.194 -5.824 1.00 0.00 O ATOM 0 H TYR A 50 -14.192 1.667 -11.527 1.00 0.00 H new ATOM 0 HA TYR A 50 -15.658 4.178 -11.812 1.00 0.00 H new ATOM 0 HB2 TYR A 50 -13.018 3.885 -10.323 1.00 0.00 H new ATOM 0 HB3 TYR A 50 -13.607 5.415 -10.942 1.00 0.00 H new ATOM 0 HD1 TYR A 50 -15.741 6.392 -10.005 1.00 0.00 H new ATOM 0 HD2 TYR A 50 -13.907 2.947 -8.292 1.00 0.00 H new ATOM 0 HE1 TYR A 50 -17.047 6.718 -7.952 1.00 0.00 H new ATOM 0 HE2 TYR A 50 -15.216 3.270 -6.239 1.00 0.00 H new ATOM 0 HH TYR A 50 -16.721 4.489 -5.180 1.00 0.00 H new ATOM 808 N ASN A 51 -12.691 3.276 -12.981 1.00 0.00 N ATOM 809 CA ASN A 51 -11.851 3.303 -14.171 1.00 0.00 C ATOM 810 C ASN A 51 -10.390 3.086 -13.787 1.00 0.00 C ATOM 811 O ASN A 51 -9.774 3.944 -13.157 1.00 0.00 O ATOM 812 CB ASN A 51 -12.005 4.636 -14.907 1.00 0.00 C ATOM 813 CG ASN A 51 -11.857 5.827 -13.981 1.00 0.00 C ATOM 814 OD1 ASN A 51 -11.745 5.672 -12.765 1.00 0.00 O ATOM 815 ND2 ASN A 51 -11.858 7.025 -14.553 1.00 0.00 N ATOM 0 H ASN A 51 -12.255 2.839 -12.169 1.00 0.00 H new ATOM 0 HA ASN A 51 -12.168 2.499 -14.836 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -11.258 4.699 -15.698 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -12.983 4.672 -15.388 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -11.763 7.864 -13.980 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -11.953 7.107 -15.565 1.00 0.00 H new ATOM 822 N PRO A 52 -9.816 1.930 -14.157 1.00 0.00 N ATOM 823 CA PRO A 52 -8.423 1.611 -13.839 1.00 0.00 C ATOM 824 C PRO A 52 -7.472 2.776 -14.129 1.00 0.00 C ATOM 825 O PRO A 52 -7.738 3.583 -15.020 1.00 0.00 O ATOM 826 CB PRO A 52 -8.121 0.433 -14.759 1.00 0.00 C ATOM 827 CG PRO A 52 -9.433 -0.243 -14.952 1.00 0.00 C ATOM 828 CD PRO A 52 -10.474 0.842 -14.911 1.00 0.00 C ATOM 0 HA PRO A 52 -8.284 1.395 -12.780 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -7.705 0.769 -15.709 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -7.390 -0.241 -14.312 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -9.461 -0.774 -15.904 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -9.609 -0.981 -14.170 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -10.757 1.164 -15.913 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -11.384 0.505 -14.415 1.00 0.00 H new ATOM 836 N THR A 53 -6.358 2.870 -13.383 1.00 0.00 N ATOM 837 CA THR A 53 -6.024 1.922 -12.322 1.00 0.00 C ATOM 838 C THR A 53 -5.940 2.637 -10.980 1.00 0.00 C ATOM 839 O THR A 53 -5.375 3.727 -10.884 1.00 0.00 O ATOM 840 CB THR A 53 -4.698 1.220 -12.628 1.00 0.00 C ATOM 841 OG1 THR A 53 -4.779 0.506 -13.849 1.00 0.00 O ATOM 842 CG2 THR A 53 -4.276 0.242 -11.553 1.00 0.00 C ATOM 0 H THR A 53 -5.666 3.610 -13.504 1.00 0.00 H new ATOM 0 HA THR A 53 -6.812 1.171 -12.271 1.00 0.00 H new ATOM 0 HB THR A 53 -3.956 2.017 -12.684 1.00 0.00 H new ATOM 0 HG1 THR A 53 -3.922 0.066 -14.028 1.00 0.00 H new ATOM 0 HG21 THR A 53 -3.329 -0.220 -11.833 1.00 0.00 H new ATOM 0 HG22 THR A 53 -4.157 0.770 -10.607 1.00 0.00 H new ATOM 0 HG23 THR A 53 -5.038 -0.530 -11.444 1.00 0.00 H new ATOM 850 N TRP A 54 -6.517 2.030 -9.951 1.00 0.00 N ATOM 851 CA TRP A 54 -6.519 2.627 -8.622 1.00 0.00 C ATOM 852 C TRP A 54 -5.470 1.998 -7.712 1.00 0.00 C ATOM 853 O TRP A 54 -5.210 0.797 -7.772 1.00 0.00 O ATOM 854 CB TRP A 54 -7.900 2.488 -7.982 1.00 0.00 C ATOM 855 CG TRP A 54 -8.987 3.163 -8.759 1.00 0.00 C ATOM 856 CD1 TRP A 54 -9.592 2.702 -9.891 1.00 0.00 C ATOM 857 CD2 TRP A 54 -9.595 4.424 -8.461 1.00 0.00 C ATOM 858 NE1 TRP A 54 -10.542 3.599 -10.315 1.00 0.00 N ATOM 859 CE2 TRP A 54 -10.563 4.665 -9.455 1.00 0.00 C ATOM 860 CE3 TRP A 54 -9.417 5.374 -7.450 1.00 0.00 C ATOM 861 CZ2 TRP A 54 -11.350 5.813 -9.466 1.00 0.00 C ATOM 862 CZ3 TRP A 54 -10.197 6.515 -7.464 1.00 0.00 C ATOM 863 CH2 TRP A 54 -11.154 6.727 -8.465 1.00 0.00 C ATOM 0 H TRP A 54 -6.988 1.127 -10.011 1.00 0.00 H new ATOM 0 HA TRP A 54 -6.272 3.682 -8.741 1.00 0.00 H new ATOM 0 HB2 TRP A 54 -8.140 1.430 -7.880 1.00 0.00 H new ATOM 0 HB3 TRP A 54 -7.870 2.906 -6.976 1.00 0.00 H new ATOM 0 HD1 TRP A 54 -9.358 1.769 -10.382 1.00 0.00 H new ATOM 0 HE1 TRP A 54 -11.136 3.489 -11.137 1.00 0.00 H new ATOM 0 HE3 TRP A 54 -8.684 5.219 -6.673 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 -12.089 5.977 -10.236 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 -10.066 7.256 -6.690 1.00 0.00 H new ATOM 0 HH2 TRP A 54 -11.749 7.628 -8.447 1.00 0.00 H new ATOM 874 N HIS A 55 -4.892 2.832 -6.856 1.00 0.00 N ATOM 875 CA HIS A 55 -3.886 2.395 -5.897 1.00 0.00 C ATOM 876 C HIS A 55 -4.266 2.912 -4.515 1.00 0.00 C ATOM 877 O HIS A 55 -4.115 4.097 -4.226 1.00 0.00 O ATOM 878 CB HIS A 55 -2.499 2.912 -6.292 1.00 0.00 C ATOM 879 CG HIS A 55 -2.266 2.955 -7.774 1.00 0.00 C ATOM 880 ND1 HIS A 55 -3.110 3.224 -8.800 1.00 0.00 N flip ATOM 881 CD2 HIS A 55 -1.036 2.708 -8.348 1.00 0.00 C flip ATOM 882 CE1 HIS A 55 -2.380 3.136 -9.960 1.00 0.00 C flip ATOM 883 NE2 HIS A 55 -1.133 2.824 -9.660 1.00 0.00 N flip ATOM 0 H HIS A 55 -5.107 3.828 -6.807 1.00 0.00 H new ATOM 0 HA HIS A 55 -3.847 1.306 -5.887 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -2.366 3.914 -5.884 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -1.741 2.277 -5.833 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -0.134 2.459 -7.808 1.00 0.00 H new ATOM 0 HE1 HIS A 55 -2.764 3.296 -10.957 1.00 0.00 H new ATOM 0 HE2 HIS A 55 -0.373 2.694 -10.328 1.00 0.00 H new ATOM 892 N CYS A 56 -4.795 2.031 -3.674 1.00 0.00 N ATOM 893 CA CYS A 56 -5.229 2.432 -2.342 1.00 0.00 C ATOM 894 C CYS A 56 -4.483 1.693 -1.239 1.00 0.00 C ATOM 895 O CYS A 56 -3.873 0.648 -1.466 1.00 0.00 O ATOM 896 CB CYS A 56 -6.728 2.184 -2.188 1.00 0.00 C ATOM 897 SG CYS A 56 -7.224 1.680 -0.524 1.00 0.00 S ATOM 0 H CYS A 56 -4.933 1.043 -3.888 1.00 0.00 H new ATOM 0 HA CYS A 56 -5.006 3.494 -2.240 1.00 0.00 H new ATOM 0 HB2 CYS A 56 -7.266 3.093 -2.456 1.00 0.00 H new ATOM 0 HB3 CYS A 56 -7.033 1.413 -2.896 1.00 0.00 H new ATOM 0 HG CYS A 56 -6.588 0.596 -0.191 1.00 0.00 H new ATOM 903 N ILE A 57 -4.561 2.251 -0.036 1.00 0.00 N ATOM 904 CA ILE A 57 -3.924 1.668 1.138 1.00 0.00 C ATOM 905 C ILE A 57 -4.915 1.616 2.297 1.00 0.00 C ATOM 906 O ILE A 57 -6.016 2.158 2.202 1.00 0.00 O ATOM 907 CB ILE A 57 -2.684 2.473 1.572 1.00 0.00 C ATOM 908 CG1 ILE A 57 -1.779 2.748 0.369 1.00 0.00 C ATOM 909 CG2 ILE A 57 -1.919 1.730 2.660 1.00 0.00 C ATOM 910 CD1 ILE A 57 -1.381 1.501 -0.386 1.00 0.00 C ATOM 0 H ILE A 57 -5.066 3.117 0.152 1.00 0.00 H new ATOM 0 HA ILE A 57 -3.605 0.661 0.871 1.00 0.00 H new ATOM 0 HB ILE A 57 -3.016 3.428 1.979 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -2.291 3.427 -0.312 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -0.879 3.258 0.711 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -1.046 2.313 2.954 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -2.566 1.584 3.525 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -1.596 0.761 2.280 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -0.740 1.773 -1.225 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -0.841 0.829 0.281 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -2.275 1.001 -0.759 1.00 0.00 H new ATOM 922 N VAL A 58 -4.527 0.967 3.388 1.00 0.00 N ATOM 923 CA VAL A 58 -5.400 0.861 4.551 1.00 0.00 C ATOM 924 C VAL A 58 -4.657 0.309 5.760 1.00 0.00 C ATOM 925 O VAL A 58 -4.231 -0.845 5.768 1.00 0.00 O ATOM 926 CB VAL A 58 -6.616 -0.034 4.261 1.00 0.00 C ATOM 927 CG1 VAL A 58 -6.186 -1.482 4.109 1.00 0.00 C ATOM 928 CG2 VAL A 58 -7.657 0.109 5.360 1.00 0.00 C ATOM 0 H VAL A 58 -3.621 0.510 3.492 1.00 0.00 H new ATOM 0 HA VAL A 58 -5.743 1.871 4.774 1.00 0.00 H new ATOM 0 HB VAL A 58 -7.067 0.287 3.322 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -7.059 -2.101 3.904 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -5.479 -1.567 3.284 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -5.710 -1.819 5.030 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -8.511 -0.532 5.138 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -7.221 -0.185 6.315 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -7.987 1.146 5.416 1.00 0.00 H new ATOM 938 N GLY A 59 -4.519 1.140 6.786 1.00 0.00 N ATOM 939 CA GLY A 59 -3.840 0.726 7.995 1.00 0.00 C ATOM 940 C GLY A 59 -4.518 1.267 9.233 1.00 0.00 C ATOM 941 O GLY A 59 -5.745 1.300 9.311 1.00 0.00 O ATOM 0 H GLY A 59 -4.868 2.098 6.800 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -3.813 -0.363 8.042 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -2.806 1.070 7.967 1.00 0.00 H new ATOM 945 N ARG A 60 -3.725 1.692 10.208 1.00 0.00 N ATOM 946 CA ARG A 60 -4.269 2.228 11.441 1.00 0.00 C ATOM 947 C ARG A 60 -3.227 3.025 12.219 1.00 0.00 C ATOM 948 O ARG A 60 -3.480 3.462 13.341 1.00 0.00 O ATOM 949 CB ARG A 60 -4.800 1.091 12.298 1.00 0.00 C ATOM 950 CG ARG A 60 -4.050 -0.217 12.102 1.00 0.00 C ATOM 951 CD ARG A 60 -5.005 -1.391 11.967 1.00 0.00 C ATOM 952 NE ARG A 60 -5.440 -1.896 13.265 1.00 0.00 N ATOM 953 CZ ARG A 60 -4.707 -2.707 14.022 1.00 0.00 C ATOM 954 NH1 ARG A 60 -3.505 -3.090 13.613 1.00 0.00 N ATOM 955 NH2 ARG A 60 -5.174 -3.134 15.186 1.00 0.00 N ATOM 0 H ARG A 60 -2.706 1.675 10.166 1.00 0.00 H new ATOM 0 HA ARG A 60 -5.080 2.909 11.185 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -4.742 1.380 13.347 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -5.854 0.934 12.068 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -3.426 -0.150 11.211 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -3.382 -0.385 12.947 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -5.876 -1.085 11.387 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -4.518 -2.192 11.411 1.00 0.00 H new ATOM 0 HE ARG A 60 -6.356 -1.611 13.611 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -3.143 -2.762 12.718 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -2.943 -3.712 14.194 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -6.098 -2.841 15.503 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -4.610 -3.756 15.765 1.00 0.00 H new ATOM 969 N ASN A 61 -2.056 3.217 11.621 1.00 0.00 N ATOM 970 CA ASN A 61 -0.988 3.966 12.271 1.00 0.00 C ATOM 971 C ASN A 61 0.249 4.046 11.383 1.00 0.00 C ATOM 972 O ASN A 61 1.376 4.071 11.875 1.00 0.00 O ATOM 973 CB ASN A 61 -0.624 3.317 13.608 1.00 0.00 C ATOM 974 CG ASN A 61 -0.628 4.310 14.754 1.00 0.00 C ATOM 975 OD1 ASN A 61 0.330 5.060 14.942 1.00 0.00 O ATOM 976 ND2 ASN A 61 -1.707 4.320 15.526 1.00 0.00 N ATOM 0 H ASN A 61 -1.823 2.866 10.692 1.00 0.00 H new ATOM 0 HA ASN A 61 -1.350 4.979 12.448 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -1.330 2.515 13.823 1.00 0.00 H new ATOM 0 HB3 ASN A 61 0.363 2.860 13.530 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -1.766 4.967 16.312 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -2.478 3.681 15.333 1.00 0.00 H new ATOM 983 N PHE A 62 0.032 4.084 10.072 1.00 0.00 N ATOM 984 CA PHE A 62 1.134 4.161 9.120 1.00 0.00 C ATOM 985 C PHE A 62 1.315 5.586 8.603 1.00 0.00 C ATOM 986 O PHE A 62 0.724 6.528 9.129 1.00 0.00 O ATOM 987 CB PHE A 62 0.887 3.210 7.949 1.00 0.00 C ATOM 988 CG PHE A 62 -0.091 3.746 6.943 1.00 0.00 C ATOM 989 CD1 PHE A 62 -1.224 4.428 7.353 1.00 0.00 C ATOM 990 CD2 PHE A 62 0.125 3.569 5.586 1.00 0.00 C ATOM 991 CE1 PHE A 62 -2.123 4.925 6.429 1.00 0.00 C ATOM 992 CE2 PHE A 62 -0.770 4.063 4.657 1.00 0.00 C ATOM 993 CZ PHE A 62 -1.896 4.742 5.079 1.00 0.00 C ATOM 0 H PHE A 62 -0.894 4.063 9.646 1.00 0.00 H new ATOM 0 HA PHE A 62 2.047 3.865 9.637 1.00 0.00 H new ATOM 0 HB2 PHE A 62 1.834 3.005 7.451 1.00 0.00 H new ATOM 0 HB3 PHE A 62 0.517 2.260 8.334 1.00 0.00 H new ATOM 0 HD1 PHE A 62 -1.407 4.573 8.407 1.00 0.00 H new ATOM 0 HD2 PHE A 62 1.004 3.038 5.250 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -3.002 5.456 6.762 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -0.589 3.918 3.602 1.00 0.00 H new ATOM 0 HZ PHE A 62 -2.598 5.129 4.355 1.00 0.00 H new ATOM 1003 N GLY A 63 2.137 5.732 7.569 1.00 0.00 N ATOM 1004 CA GLY A 63 2.386 7.040 6.992 1.00 0.00 C ATOM 1005 C GLY A 63 2.562 6.969 5.490 1.00 0.00 C ATOM 1006 O GLY A 63 3.660 6.713 4.997 1.00 0.00 O ATOM 0 H GLY A 63 2.637 4.965 7.119 1.00 0.00 H new ATOM 0 HA2 GLY A 63 1.556 7.706 7.229 1.00 0.00 H new ATOM 0 HA3 GLY A 63 3.280 7.472 7.442 1.00 0.00 H new ATOM 1010 N SER A 64 1.473 7.182 4.760 1.00 0.00 N ATOM 1011 CA SER A 64 1.508 7.125 3.304 1.00 0.00 C ATOM 1012 C SER A 64 1.997 8.439 2.705 1.00 0.00 C ATOM 1013 O SER A 64 1.552 9.519 3.097 1.00 0.00 O ATOM 1014 CB SER A 64 0.123 6.786 2.750 1.00 0.00 C ATOM 1015 OG SER A 64 -0.896 7.169 3.657 1.00 0.00 O ATOM 0 H SER A 64 0.556 7.395 5.152 1.00 0.00 H new ATOM 0 HA SER A 64 2.211 6.341 3.022 1.00 0.00 H new ATOM 0 HB2 SER A 64 -0.025 7.293 1.797 1.00 0.00 H new ATOM 0 HB3 SER A 64 0.058 5.716 2.555 1.00 0.00 H new ATOM 0 HG SER A 64 -1.370 6.371 3.972 1.00 0.00 H new ATOM 1021 N TYR A 65 2.906 8.333 1.744 1.00 0.00 N ATOM 1022 CA TYR A 65 3.458 9.503 1.070 1.00 0.00 C ATOM 1023 C TYR A 65 3.691 9.201 -0.405 1.00 0.00 C ATOM 1024 O TYR A 65 4.830 9.177 -0.874 1.00 0.00 O ATOM 1025 CB TYR A 65 4.770 9.933 1.729 1.00 0.00 C ATOM 1026 CG TYR A 65 5.149 11.369 1.444 1.00 0.00 C ATOM 1027 CD1 TYR A 65 4.611 12.410 2.189 1.00 0.00 C ATOM 1028 CD2 TYR A 65 6.047 11.685 0.432 1.00 0.00 C ATOM 1029 CE1 TYR A 65 4.955 13.725 1.935 1.00 0.00 C ATOM 1030 CE2 TYR A 65 6.397 12.996 0.171 1.00 0.00 C ATOM 1031 CZ TYR A 65 5.848 14.013 0.924 1.00 0.00 C ATOM 1032 OH TYR A 65 6.195 15.320 0.669 1.00 0.00 O ATOM 0 H TYR A 65 3.279 7.444 1.412 1.00 0.00 H new ATOM 0 HA TYR A 65 2.741 10.319 1.156 1.00 0.00 H new ATOM 0 HB2 TYR A 65 4.688 9.795 2.807 1.00 0.00 H new ATOM 0 HB3 TYR A 65 5.571 9.279 1.384 1.00 0.00 H new ATOM 0 HD1 TYR A 65 3.911 12.189 2.981 1.00 0.00 H new ATOM 0 HD2 TYR A 65 6.479 10.892 -0.161 1.00 0.00 H new ATOM 0 HE1 TYR A 65 4.527 14.522 2.525 1.00 0.00 H new ATOM 0 HE2 TYR A 65 7.097 13.223 -0.619 1.00 0.00 H new ATOM 0 HH TYR A 65 6.834 15.350 -0.073 1.00 0.00 H new ATOM 1042 N VAL A 66 2.604 8.964 -1.131 1.00 0.00 N ATOM 1043 CA VAL A 66 2.688 8.656 -2.552 1.00 0.00 C ATOM 1044 C VAL A 66 2.057 9.757 -3.397 1.00 0.00 C ATOM 1045 O VAL A 66 1.166 10.473 -2.939 1.00 0.00 O ATOM 1046 CB VAL A 66 2.006 7.308 -2.874 1.00 0.00 C ATOM 1047 CG1 VAL A 66 2.380 6.260 -1.838 1.00 0.00 C ATOM 1048 CG2 VAL A 66 0.493 7.468 -2.953 1.00 0.00 C ATOM 0 H VAL A 66 1.655 8.980 -0.758 1.00 0.00 H new ATOM 0 HA VAL A 66 3.747 8.585 -2.799 1.00 0.00 H new ATOM 0 HB VAL A 66 2.361 6.973 -3.848 1.00 0.00 H new ATOM 0 HG11 VAL A 66 1.890 5.317 -2.081 1.00 0.00 H new ATOM 0 HG12 VAL A 66 3.461 6.118 -1.838 1.00 0.00 H new ATOM 0 HG13 VAL A 66 2.057 6.592 -0.851 1.00 0.00 H new ATOM 0 HG21 VAL A 66 0.037 6.505 -3.181 1.00 0.00 H new ATOM 0 HG22 VAL A 66 0.115 7.832 -1.997 1.00 0.00 H new ATOM 0 HG23 VAL A 66 0.243 8.182 -3.737 1.00 0.00 H new ATOM 1058 N THR A 67 2.521 9.881 -4.635 1.00 0.00 N ATOM 1059 CA THR A 67 2.001 10.890 -5.549 1.00 0.00 C ATOM 1060 C THR A 67 0.520 10.656 -5.835 1.00 0.00 C ATOM 1061 O THR A 67 -0.158 9.940 -5.098 1.00 0.00 O ATOM 1062 CB THR A 67 2.791 10.874 -6.857 1.00 0.00 C ATOM 1063 OG1 THR A 67 2.632 12.097 -7.555 1.00 0.00 O ATOM 1064 CG2 THR A 67 2.375 9.757 -7.785 1.00 0.00 C ATOM 0 H THR A 67 3.257 9.295 -5.029 1.00 0.00 H new ATOM 0 HA THR A 67 2.111 11.865 -5.075 1.00 0.00 H new ATOM 0 HB THR A 67 3.831 10.720 -6.569 1.00 0.00 H new ATOM 0 HG1 THR A 67 3.147 12.067 -8.388 1.00 0.00 H new ATOM 0 HG21 THR A 67 2.972 9.799 -8.696 1.00 0.00 H new ATOM 0 HG22 THR A 67 2.532 8.797 -7.292 1.00 0.00 H new ATOM 0 HG23 THR A 67 1.320 9.867 -8.037 1.00 0.00 H new ATOM 1072 N HIS A 68 0.025 11.262 -6.911 1.00 0.00 N ATOM 1073 CA HIS A 68 -1.376 11.116 -7.293 1.00 0.00 C ATOM 1074 C HIS A 68 -1.567 11.396 -8.781 1.00 0.00 C ATOM 1075 O HIS A 68 -0.830 12.183 -9.374 1.00 0.00 O ATOM 1076 CB HIS A 68 -2.255 12.060 -6.470 1.00 0.00 C ATOM 1077 CG HIS A 68 -1.577 13.343 -6.105 1.00 0.00 C ATOM 1078 ND1 HIS A 68 -0.253 13.414 -5.723 1.00 0.00 N ATOM 1079 CD2 HIS A 68 -2.046 14.614 -6.063 1.00 0.00 C ATOM 1080 CE1 HIS A 68 0.062 14.671 -5.464 1.00 0.00 C ATOM 1081 NE2 HIS A 68 -1.007 15.418 -5.664 1.00 0.00 N ATOM 0 H HIS A 68 0.572 11.858 -7.532 1.00 0.00 H new ATOM 0 HA HIS A 68 -1.674 10.087 -7.093 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -3.160 12.285 -7.034 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -2.566 11.551 -5.558 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -3.050 14.935 -6.299 1.00 0.00 H new ATOM 0 HE1 HIS A 68 1.030 15.026 -5.143 1.00 0.00 H new ATOM 0 HE2 HIS A 68 -1.054 16.430 -5.542 1.00 0.00 H new ATOM 1090 N GLU A 69 -2.562 10.746 -9.377 1.00 0.00 N ATOM 1091 CA GLU A 69 -2.852 10.926 -10.794 1.00 0.00 C ATOM 1092 C GLU A 69 -4.355 10.884 -11.048 1.00 0.00 C ATOM 1093 O GLU A 69 -5.142 10.630 -10.135 1.00 0.00 O ATOM 1094 CB GLU A 69 -2.152 9.846 -11.621 1.00 0.00 C ATOM 1095 CG GLU A 69 -1.012 9.162 -10.885 1.00 0.00 C ATOM 1096 CD GLU A 69 0.298 9.914 -11.012 1.00 0.00 C ATOM 1097 OE1 GLU A 69 0.397 10.789 -11.899 1.00 0.00 O ATOM 1098 OE2 GLU A 69 1.225 9.628 -10.226 1.00 0.00 O ATOM 0 H GLU A 69 -3.181 10.090 -8.900 1.00 0.00 H new ATOM 0 HA GLU A 69 -2.477 11.904 -11.096 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -2.884 9.095 -11.918 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -1.766 10.294 -12.537 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -1.271 9.066 -9.831 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -0.886 8.152 -11.276 1.00 0.00 H new ATOM 1105 N THR A 70 -4.751 11.139 -12.291 1.00 0.00 N ATOM 1106 CA THR A 70 -6.163 11.133 -12.656 1.00 0.00 C ATOM 1107 C THR A 70 -6.999 11.828 -11.585 1.00 0.00 C ATOM 1108 O THR A 70 -6.860 13.031 -11.361 1.00 0.00 O ATOM 1109 CB THR A 70 -6.655 9.699 -12.859 1.00 0.00 C ATOM 1110 OG1 THR A 70 -5.686 8.927 -13.548 1.00 0.00 O ATOM 1111 CG2 THR A 70 -7.949 9.617 -13.639 1.00 0.00 C ATOM 0 H THR A 70 -4.116 11.352 -13.060 1.00 0.00 H new ATOM 0 HA THR A 70 -6.276 11.679 -13.592 1.00 0.00 H new ATOM 0 HB THR A 70 -6.828 9.308 -11.856 1.00 0.00 H new ATOM 0 HG1 THR A 70 -6.019 8.013 -13.666 1.00 0.00 H new ATOM 0 HG21 THR A 70 -8.243 8.573 -13.748 1.00 0.00 H new ATOM 0 HG22 THR A 70 -8.730 10.160 -13.107 1.00 0.00 H new ATOM 0 HG23 THR A 70 -7.808 10.059 -14.625 1.00 0.00 H new ATOM 1119 N LYS A 71 -7.862 11.065 -10.920 1.00 0.00 N ATOM 1120 CA LYS A 71 -8.711 11.614 -9.869 1.00 0.00 C ATOM 1121 C LYS A 71 -7.881 11.982 -8.646 1.00 0.00 C ATOM 1122 O LYS A 71 -8.392 12.028 -7.527 1.00 0.00 O ATOM 1123 CB LYS A 71 -9.797 10.609 -9.480 1.00 0.00 C ATOM 1124 CG LYS A 71 -10.905 10.479 -10.512 1.00 0.00 C ATOM 1125 CD LYS A 71 -11.490 11.835 -10.874 1.00 0.00 C ATOM 1126 CE LYS A 71 -11.691 11.973 -12.374 1.00 0.00 C ATOM 1127 NZ LYS A 71 -10.729 12.937 -12.974 1.00 0.00 N ATOM 0 H LYS A 71 -7.991 10.068 -11.090 1.00 0.00 H new ATOM 0 HA LYS A 71 -9.187 12.517 -10.253 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -9.338 9.632 -9.327 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -10.233 10.909 -8.527 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -10.514 9.999 -11.409 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -11.693 9.834 -10.123 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -12.444 11.968 -10.364 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -10.827 12.625 -10.521 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -11.572 10.999 -12.848 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -12.710 12.303 -12.575 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -10.898 13.004 -13.998 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -10.859 13.873 -12.540 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -9.757 12.609 -12.804 1.00 0.00 H new ATOM 1141 N HIS A 72 -6.597 12.241 -8.867 1.00 0.00 N ATOM 1142 CA HIS A 72 -5.695 12.602 -7.783 1.00 0.00 C ATOM 1143 C HIS A 72 -5.580 11.463 -6.776 1.00 0.00 C ATOM 1144 O HIS A 72 -4.707 10.603 -6.894 1.00 0.00 O ATOM 1145 CB HIS A 72 -6.186 13.871 -7.084 1.00 0.00 C ATOM 1146 CG HIS A 72 -6.047 15.106 -7.920 1.00 0.00 C ATOM 1147 ND1 HIS A 72 -5.086 16.067 -7.688 1.00 0.00 N ATOM 1148 CD2 HIS A 72 -6.753 15.534 -8.993 1.00 0.00 C ATOM 1149 CE1 HIS A 72 -5.208 17.034 -8.581 1.00 0.00 C ATOM 1150 NE2 HIS A 72 -6.211 16.734 -9.383 1.00 0.00 N ATOM 0 H HIS A 72 -6.159 12.207 -9.787 1.00 0.00 H new ATOM 0 HA HIS A 72 -4.709 12.791 -8.208 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -7.233 13.743 -6.810 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -5.628 14.005 -6.157 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -7.587 15.027 -9.456 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -4.592 17.919 -8.643 1.00 0.00 H new ATOM 0 HE2 HIS A 72 -6.532 17.302 -10.167 1.00 0.00 H new ATOM 1159 N PHE A 73 -6.470 11.463 -5.790 1.00 0.00 N ATOM 1160 CA PHE A 73 -6.479 10.431 -4.760 1.00 0.00 C ATOM 1161 C PHE A 73 -7.287 10.887 -3.551 1.00 0.00 C ATOM 1162 O PHE A 73 -7.977 11.906 -3.600 1.00 0.00 O ATOM 1163 CB PHE A 73 -5.047 10.085 -4.333 1.00 0.00 C ATOM 1164 CG PHE A 73 -4.498 10.984 -3.258 1.00 0.00 C ATOM 1165 CD1 PHE A 73 -4.591 12.361 -3.374 1.00 0.00 C ATOM 1166 CD2 PHE A 73 -3.892 10.449 -2.132 1.00 0.00 C ATOM 1167 CE1 PHE A 73 -4.091 13.190 -2.387 1.00 0.00 C ATOM 1168 CE2 PHE A 73 -3.391 11.272 -1.141 1.00 0.00 C ATOM 1169 CZ PHE A 73 -3.490 12.644 -1.268 1.00 0.00 C ATOM 0 H PHE A 73 -7.198 12.170 -5.682 1.00 0.00 H new ATOM 0 HA PHE A 73 -6.947 9.539 -5.177 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -5.023 9.054 -3.979 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -4.395 10.138 -5.205 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -5.060 12.792 -4.246 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -3.810 9.377 -2.028 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -4.170 14.262 -2.490 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -2.922 10.843 -0.268 1.00 0.00 H new ATOM 0 HZ PHE A 73 -3.099 13.289 -0.495 1.00 0.00 H new ATOM 1179 N ILE A 74 -7.189 10.134 -2.462 1.00 0.00 N ATOM 1180 CA ILE A 74 -7.902 10.468 -1.239 1.00 0.00 C ATOM 1181 C ILE A 74 -7.297 9.764 -0.032 1.00 0.00 C ATOM 1182 O ILE A 74 -6.901 8.601 -0.109 1.00 0.00 O ATOM 1183 CB ILE A 74 -9.395 10.102 -1.322 1.00 0.00 C ATOM 1184 CG1 ILE A 74 -10.160 10.806 -0.186 1.00 0.00 C ATOM 1185 CG2 ILE A 74 -9.562 8.585 -1.267 1.00 0.00 C ATOM 1186 CD1 ILE A 74 -11.482 10.168 0.190 1.00 0.00 C ATOM 0 H ILE A 74 -6.622 9.288 -2.403 1.00 0.00 H new ATOM 0 HA ILE A 74 -7.806 11.547 -1.121 1.00 0.00 H new ATOM 0 HB ILE A 74 -9.811 10.444 -2.270 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -9.523 10.833 0.698 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -10.343 11.840 -0.479 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -10.621 8.333 -1.326 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -9.033 8.130 -2.105 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -9.151 8.207 -0.331 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -11.943 10.736 0.998 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -12.144 10.165 -0.676 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -11.311 9.143 0.519 1.00 0.00 H new ATOM 1198 N TYR A 75 -7.248 10.476 1.085 1.00 0.00 N ATOM 1199 CA TYR A 75 -6.710 9.932 2.323 1.00 0.00 C ATOM 1200 C TYR A 75 -7.674 10.209 3.470 1.00 0.00 C ATOM 1201 O TYR A 75 -8.257 11.290 3.549 1.00 0.00 O ATOM 1202 CB TYR A 75 -5.339 10.541 2.626 1.00 0.00 C ATOM 1203 CG TYR A 75 -4.574 9.812 3.709 1.00 0.00 C ATOM 1204 CD1 TYR A 75 -4.536 8.424 3.749 1.00 0.00 C ATOM 1205 CD2 TYR A 75 -3.887 10.515 4.690 1.00 0.00 C ATOM 1206 CE1 TYR A 75 -3.836 7.757 4.737 1.00 0.00 C ATOM 1207 CE2 TYR A 75 -3.183 9.856 5.680 1.00 0.00 C ATOM 1208 CZ TYR A 75 -3.161 8.478 5.699 1.00 0.00 C ATOM 1209 OH TYR A 75 -2.463 7.819 6.685 1.00 0.00 O ATOM 0 H TYR A 75 -7.577 11.439 1.159 1.00 0.00 H new ATOM 0 HA TYR A 75 -6.590 8.855 2.210 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -4.744 10.545 1.713 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -5.471 11.581 2.925 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -5.062 7.856 2.996 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -3.903 11.595 4.679 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -3.818 6.677 4.755 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -2.653 10.418 6.435 1.00 0.00 H new ATOM 0 HH TYR A 75 -2.072 6.999 6.317 1.00 0.00 H new ATOM 1219 N PHE A 76 -7.849 9.233 4.350 1.00 0.00 N ATOM 1220 CA PHE A 76 -8.754 9.388 5.483 1.00 0.00 C ATOM 1221 C PHE A 76 -8.456 8.361 6.567 1.00 0.00 C ATOM 1222 O PHE A 76 -7.592 7.499 6.400 1.00 0.00 O ATOM 1223 CB PHE A 76 -10.207 9.255 5.024 1.00 0.00 C ATOM 1224 CG PHE A 76 -10.428 8.130 4.055 1.00 0.00 C ATOM 1225 CD1 PHE A 76 -9.774 8.113 2.834 1.00 0.00 C ATOM 1226 CD2 PHE A 76 -11.287 7.089 4.367 1.00 0.00 C ATOM 1227 CE1 PHE A 76 -9.973 7.078 1.940 1.00 0.00 C ATOM 1228 CE2 PHE A 76 -11.491 6.051 3.477 1.00 0.00 C ATOM 1229 CZ PHE A 76 -10.833 6.046 2.261 1.00 0.00 C ATOM 0 H PHE A 76 -7.379 8.329 4.303 1.00 0.00 H new ATOM 0 HA PHE A 76 -8.601 10.383 5.902 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -10.843 9.103 5.896 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -10.520 10.190 4.560 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -9.101 8.918 2.578 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -11.803 7.088 5.316 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -9.457 7.076 0.991 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -12.163 5.245 3.731 1.00 0.00 H new ATOM 0 HZ PHE A 76 -10.991 5.237 1.564 1.00 0.00 H new ATOM 1239 N TYR A 77 -9.175 8.458 7.681 1.00 0.00 N ATOM 1240 CA TYR A 77 -8.982 7.539 8.793 1.00 0.00 C ATOM 1241 C TYR A 77 -10.320 7.056 9.349 1.00 0.00 C ATOM 1242 O TYR A 77 -10.945 7.734 10.163 1.00 0.00 O ATOM 1243 CB TYR A 77 -8.171 8.216 9.898 1.00 0.00 C ATOM 1244 CG TYR A 77 -7.891 7.319 11.082 1.00 0.00 C ATOM 1245 CD1 TYR A 77 -8.832 7.152 12.089 1.00 0.00 C ATOM 1246 CD2 TYR A 77 -6.685 6.639 11.190 1.00 0.00 C ATOM 1247 CE1 TYR A 77 -8.579 6.332 13.173 1.00 0.00 C ATOM 1248 CE2 TYR A 77 -6.424 5.818 12.271 1.00 0.00 C ATOM 1249 CZ TYR A 77 -7.375 5.668 13.258 1.00 0.00 C ATOM 1250 OH TYR A 77 -7.120 4.852 14.335 1.00 0.00 O ATOM 0 H TYR A 77 -9.895 9.163 7.836 1.00 0.00 H new ATOM 0 HA TYR A 77 -8.435 6.672 8.424 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -7.224 8.561 9.482 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -8.709 9.100 10.242 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -9.777 7.671 12.025 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -5.939 6.753 10.417 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -9.321 6.213 13.949 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -5.481 5.297 12.342 1.00 0.00 H new ATOM 0 HH TYR A 77 -6.228 4.458 14.243 1.00 0.00 H new ATOM 1260 N LEU A 78 -10.748 5.876 8.909 1.00 0.00 N ATOM 1261 CA LEU A 78 -12.008 5.301 9.369 1.00 0.00 C ATOM 1262 C LEU A 78 -11.979 5.093 10.880 1.00 0.00 C ATOM 1263 O LEU A 78 -11.070 5.567 11.563 1.00 0.00 O ATOM 1264 CB LEU A 78 -12.272 3.965 8.665 1.00 0.00 C ATOM 1265 CG LEU A 78 -12.600 4.054 7.170 1.00 0.00 C ATOM 1266 CD1 LEU A 78 -14.055 4.446 6.962 1.00 0.00 C ATOM 1267 CD2 LEU A 78 -11.674 5.039 6.469 1.00 0.00 C ATOM 0 H LEU A 78 -10.242 5.300 8.236 1.00 0.00 H new ATOM 0 HA LEU A 78 -12.812 5.996 9.125 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -11.394 3.331 8.788 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -13.099 3.466 9.170 1.00 0.00 H new ATOM 0 HG LEU A 78 -12.444 3.069 6.730 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -14.267 4.504 5.894 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -14.702 3.699 7.421 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -14.239 5.417 7.422 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -11.926 5.085 5.410 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -11.791 6.028 6.913 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -10.641 4.711 6.582 1.00 0.00 H new ATOM 1279 N GLY A 79 -12.973 4.379 11.396 1.00 0.00 N ATOM 1280 CA GLY A 79 -13.031 4.118 12.822 1.00 0.00 C ATOM 1281 C GLY A 79 -11.833 3.326 13.305 1.00 0.00 C ATOM 1282 O GLY A 79 -11.832 2.097 13.257 1.00 0.00 O ATOM 0 H GLY A 79 -13.738 3.977 10.854 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -13.081 5.064 13.362 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -13.945 3.570 13.053 1.00 0.00 H new ATOM 1286 N GLN A 80 -10.804 4.033 13.762 1.00 0.00 N ATOM 1287 CA GLN A 80 -9.589 3.385 14.241 1.00 0.00 C ATOM 1288 C GLN A 80 -8.814 2.787 13.073 1.00 0.00 C ATOM 1289 O GLN A 80 -7.928 1.953 13.258 1.00 0.00 O ATOM 1290 CB GLN A 80 -9.932 2.295 15.258 1.00 0.00 C ATOM 1291 CG GLN A 80 -9.980 2.792 16.693 1.00 0.00 C ATOM 1292 CD GLN A 80 -8.641 3.321 17.170 1.00 0.00 C ATOM 1293 OE1 GLN A 80 -7.563 2.834 16.568 1.00 0.00 O flip ATOM 1294 NE2 GLN A 80 -8.577 4.159 18.070 1.00 0.00 N flip ATOM 0 H GLN A 80 -10.788 5.052 13.810 1.00 0.00 H new ATOM 0 HA GLN A 80 -8.966 4.134 14.729 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -10.898 1.861 15.001 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -9.194 1.496 15.184 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -10.729 3.580 16.776 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -10.299 1.979 17.345 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -9.432 4.506 18.505 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -7.669 4.506 18.380 1.00 0.00 H new ATOM 1303 N VAL A 81 -9.164 3.222 11.866 1.00 0.00 N ATOM 1304 CA VAL A 81 -8.514 2.738 10.655 1.00 0.00 C ATOM 1305 C VAL A 81 -8.225 3.891 9.698 1.00 0.00 C ATOM 1306 O VAL A 81 -8.769 4.984 9.847 1.00 0.00 O ATOM 1307 CB VAL A 81 -9.387 1.690 9.934 1.00 0.00 C ATOM 1308 CG1 VAL A 81 -8.827 1.376 8.554 1.00 0.00 C ATOM 1309 CG2 VAL A 81 -9.502 0.425 10.771 1.00 0.00 C ATOM 0 H VAL A 81 -9.897 3.912 11.702 1.00 0.00 H new ATOM 0 HA VAL A 81 -7.576 2.272 10.955 1.00 0.00 H new ATOM 0 HB VAL A 81 -10.386 2.107 9.805 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -9.459 0.635 8.065 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -8.805 2.286 7.955 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -7.816 0.982 8.653 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -10.121 -0.303 10.247 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -8.509 0.006 10.935 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -9.958 0.665 11.732 1.00 0.00 H new ATOM 1319 N ALA A 82 -7.371 3.638 8.714 1.00 0.00 N ATOM 1320 CA ALA A 82 -7.015 4.653 7.732 1.00 0.00 C ATOM 1321 C ALA A 82 -6.956 4.051 6.332 1.00 0.00 C ATOM 1322 O ALA A 82 -6.684 2.862 6.172 1.00 0.00 O ATOM 1323 CB ALA A 82 -5.684 5.296 8.094 1.00 0.00 C ATOM 0 H ALA A 82 -6.912 2.738 8.575 1.00 0.00 H new ATOM 0 HA ALA A 82 -7.786 5.424 7.739 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -5.431 6.052 7.351 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -5.761 5.763 9.076 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -4.905 4.534 8.115 1.00 0.00 H new ATOM 1329 N ILE A 83 -7.217 4.872 5.322 1.00 0.00 N ATOM 1330 CA ILE A 83 -7.195 4.405 3.942 1.00 0.00 C ATOM 1331 C ILE A 83 -6.570 5.441 3.014 1.00 0.00 C ATOM 1332 O ILE A 83 -6.991 6.600 2.984 1.00 0.00 O ATOM 1333 CB ILE A 83 -8.611 4.071 3.429 1.00 0.00 C ATOM 1334 CG1 ILE A 83 -9.579 3.871 4.601 1.00 0.00 C ATOM 1335 CG2 ILE A 83 -8.574 2.832 2.544 1.00 0.00 C ATOM 1336 CD1 ILE A 83 -9.370 2.572 5.352 1.00 0.00 C ATOM 0 H ILE A 83 -7.445 5.860 5.432 1.00 0.00 H new ATOM 0 HA ILE A 83 -6.590 3.499 3.935 1.00 0.00 H new ATOM 0 HB ILE A 83 -8.970 4.911 2.834 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -9.470 4.703 5.296 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -10.602 3.902 4.225 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -9.580 2.608 2.189 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -7.920 3.014 1.691 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -8.195 1.986 3.118 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -10.091 2.502 6.166 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -9.509 1.732 4.671 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -8.359 2.546 5.760 1.00 0.00 H new ATOM 1348 N LEU A 84 -5.568 5.014 2.253 1.00 0.00 N ATOM 1349 CA LEU A 84 -4.887 5.898 1.314 1.00 0.00 C ATOM 1350 C LEU A 84 -5.180 5.479 -0.122 1.00 0.00 C ATOM 1351 O LEU A 84 -4.497 4.620 -0.680 1.00 0.00 O ATOM 1352 CB LEU A 84 -3.378 5.885 1.561 1.00 0.00 C ATOM 1353 CG LEU A 84 -2.538 6.505 0.444 1.00 0.00 C ATOM 1354 CD1 LEU A 84 -2.140 7.925 0.805 1.00 0.00 C ATOM 1355 CD2 LEU A 84 -1.306 5.656 0.170 1.00 0.00 C ATOM 0 H LEU A 84 -5.209 4.059 2.268 1.00 0.00 H new ATOM 0 HA LEU A 84 -5.260 6.910 1.470 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -3.172 6.418 2.489 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -3.057 4.854 1.707 1.00 0.00 H new ATOM 0 HG LEU A 84 -3.140 6.538 -0.464 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -1.543 8.351 -0.001 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -3.036 8.528 0.951 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -1.555 7.916 1.725 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -0.720 6.112 -0.628 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -0.700 5.591 1.074 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -1.614 4.655 -0.133 1.00 0.00 H new ATOM 1367 N LEU A 85 -6.203 6.087 -0.712 1.00 0.00 N ATOM 1368 CA LEU A 85 -6.592 5.773 -2.082 1.00 0.00 C ATOM 1369 C LEU A 85 -5.903 6.700 -3.076 1.00 0.00 C ATOM 1370 O LEU A 85 -5.644 7.865 -2.779 1.00 0.00 O ATOM 1371 CB LEU A 85 -8.111 5.884 -2.237 1.00 0.00 C ATOM 1372 CG LEU A 85 -8.806 4.620 -2.744 1.00 0.00 C ATOM 1373 CD1 LEU A 85 -9.177 3.713 -1.581 1.00 0.00 C ATOM 1374 CD2 LEU A 85 -10.043 4.982 -3.552 1.00 0.00 C ATOM 0 H LEU A 85 -6.778 6.800 -0.263 1.00 0.00 H new ATOM 0 HA LEU A 85 -6.280 4.750 -2.294 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -8.540 6.154 -1.272 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -8.332 6.701 -2.924 1.00 0.00 H new ATOM 0 HG LEU A 85 -8.114 4.083 -3.393 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -9.671 2.818 -1.960 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -8.275 3.428 -1.040 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -9.852 4.242 -0.908 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -10.526 4.071 -3.906 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -10.737 5.541 -2.924 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -9.753 5.594 -4.406 1.00 0.00 H new ATOM 1386 N PHE A 86 -5.612 6.175 -4.261 1.00 0.00 N ATOM 1387 CA PHE A 86 -4.957 6.958 -5.303 1.00 0.00 C ATOM 1388 C PHE A 86 -4.721 6.119 -6.558 1.00 0.00 C ATOM 1389 O PHE A 86 -4.016 5.111 -6.518 1.00 0.00 O ATOM 1390 CB PHE A 86 -3.631 7.526 -4.788 1.00 0.00 C ATOM 1391 CG PHE A 86 -2.483 6.563 -4.881 1.00 0.00 C ATOM 1392 CD1 PHE A 86 -1.751 6.453 -6.053 1.00 0.00 C ATOM 1393 CD2 PHE A 86 -2.135 5.769 -3.801 1.00 0.00 C ATOM 1394 CE1 PHE A 86 -0.694 5.568 -6.144 1.00 0.00 C ATOM 1395 CE2 PHE A 86 -1.079 4.883 -3.886 1.00 0.00 C ATOM 1396 CZ PHE A 86 -0.357 4.781 -5.059 1.00 0.00 C ATOM 0 H PHE A 86 -5.819 5.212 -4.524 1.00 0.00 H new ATOM 0 HA PHE A 86 -5.617 7.784 -5.568 1.00 0.00 H new ATOM 0 HB2 PHE A 86 -3.387 8.424 -5.355 1.00 0.00 H new ATOM 0 HB3 PHE A 86 -3.756 7.829 -3.748 1.00 0.00 H new ATOM 0 HD1 PHE A 86 -2.010 7.066 -6.904 1.00 0.00 H new ATOM 0 HD2 PHE A 86 -2.696 5.844 -2.881 1.00 0.00 H new ATOM 0 HE1 PHE A 86 -0.131 5.491 -7.063 1.00 0.00 H new ATOM 0 HE2 PHE A 86 -0.818 4.270 -3.036 1.00 0.00 H new ATOM 0 HZ PHE A 86 0.469 4.088 -5.128 1.00 0.00 H new ATOM 1406 N LYS A 87 -5.319 6.543 -7.668 1.00 0.00 N ATOM 1407 CA LYS A 87 -5.178 5.836 -8.938 1.00 0.00 C ATOM 1408 C LYS A 87 -4.166 6.535 -9.840 1.00 0.00 C ATOM 1409 O LYS A 87 -3.981 7.749 -9.759 1.00 0.00 O ATOM 1410 CB LYS A 87 -6.532 5.738 -9.644 1.00 0.00 C ATOM 1411 CG LYS A 87 -7.239 7.074 -9.804 1.00 0.00 C ATOM 1412 CD LYS A 87 -8.652 6.894 -10.335 1.00 0.00 C ATOM 1413 CE LYS A 87 -8.734 7.206 -11.821 1.00 0.00 C ATOM 1414 NZ LYS A 87 -9.964 7.972 -12.162 1.00 0.00 N ATOM 0 H LYS A 87 -5.907 7.375 -7.714 1.00 0.00 H new ATOM 0 HA LYS A 87 -4.814 4.830 -8.728 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -6.386 5.294 -10.629 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -7.176 5.062 -9.082 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -7.273 7.587 -8.843 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -6.671 7.709 -10.484 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -8.980 5.870 -10.159 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -9.333 7.545 -9.787 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -7.856 7.778 -12.121 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -8.717 6.276 -12.388 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -9.981 8.164 -13.184 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -10.803 7.416 -11.900 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -9.968 8.872 -11.641 1.00 0.00 H new ATOM 1428 N SER A 88 -3.509 5.758 -10.696 1.00 0.00 N ATOM 1429 CA SER A 88 -2.512 6.300 -11.612 1.00 0.00 C ATOM 1430 C SER A 88 -3.070 6.404 -13.021 1.00 0.00 C ATOM 1431 O SER A 88 -2.326 6.467 -13.999 1.00 0.00 O ATOM 1432 CB SER A 88 -1.266 5.422 -11.615 1.00 0.00 C ATOM 1433 OG SER A 88 -0.155 6.103 -11.059 1.00 0.00 O ATOM 0 H SER A 88 -3.649 4.751 -10.774 1.00 0.00 H new ATOM 0 HA SER A 88 -2.246 7.300 -11.269 1.00 0.00 H new ATOM 0 HB2 SER A 88 -1.459 4.512 -11.047 1.00 0.00 H new ATOM 0 HB3 SER A 88 -1.035 5.118 -12.636 1.00 0.00 H new ATOM 0 HG SER A 88 -0.405 6.482 -10.190 1.00 0.00 H new ATOM 1490 N ARG B 4 20.167 -0.229 7.538 1.00 0.00 N ATOM 1491 CA ARG B 4 19.061 -1.122 7.205 1.00 0.00 C ATOM 1492 C ARG B 4 18.044 -1.173 8.341 1.00 0.00 C ATOM 1493 O ARG B 4 16.903 -0.735 8.188 1.00 0.00 O ATOM 1494 CB ARG B 4 19.583 -2.531 6.907 1.00 0.00 C ATOM 1495 CG ARG B 4 21.054 -2.725 7.241 1.00 0.00 C ATOM 1496 CD ARG B 4 21.884 -2.953 5.988 1.00 0.00 C ATOM 1497 NE ARG B 4 23.076 -3.752 6.259 1.00 0.00 N ATOM 1498 CZ ARG B 4 24.057 -3.361 7.068 1.00 0.00 C ATOM 1499 NH1 ARG B 4 23.985 -2.190 7.685 1.00 0.00 N ATOM 1500 NH2 ARG B 4 25.110 -4.143 7.264 1.00 0.00 N ATOM 0 HA ARG B 4 18.567 -0.731 6.315 1.00 0.00 H new ATOM 0 HB2 ARG B 4 18.994 -3.253 7.472 1.00 0.00 H new ATOM 0 HB3 ARG B 4 19.428 -2.750 5.850 1.00 0.00 H new ATOM 0 HG2 ARG B 4 21.427 -1.848 7.771 1.00 0.00 H new ATOM 0 HG3 ARG B 4 21.167 -3.576 7.913 1.00 0.00 H new ATOM 0 HD2 ARG B 4 21.275 -3.454 5.236 1.00 0.00 H new ATOM 0 HD3 ARG B 4 22.180 -1.991 5.569 1.00 0.00 H new ATOM 0 HE ARG B 4 23.161 -4.660 5.803 1.00 0.00 H new ATOM 0 HH11 ARG B 4 23.176 -1.586 7.540 1.00 0.00 H new ATOM 0 HH12 ARG B 4 24.739 -1.893 8.305 1.00 0.00 H new ATOM 0 HH21 ARG B 4 25.169 -5.046 6.794 1.00 0.00 H new ATOM 0 HH22 ARG B 4 25.861 -3.841 7.885 1.00 0.00 H new ATOM 1514 N LYS B 5 18.466 -1.708 9.483 1.00 0.00 N ATOM 1515 CA LYS B 5 17.598 -1.815 10.652 1.00 0.00 C ATOM 1516 C LYS B 5 16.142 -2.030 10.243 1.00 0.00 C ATOM 1517 O LYS B 5 15.229 -1.464 10.845 1.00 0.00 O ATOM 1518 CB LYS B 5 17.722 -0.558 11.518 1.00 0.00 C ATOM 1519 CG LYS B 5 16.886 -0.605 12.787 1.00 0.00 C ATOM 1520 CD LYS B 5 17.755 -0.806 14.019 1.00 0.00 C ATOM 1521 CE LYS B 5 18.621 0.413 14.298 1.00 0.00 C ATOM 1522 NZ LYS B 5 18.741 0.686 15.757 1.00 0.00 N ATOM 0 H LYS B 5 19.407 -2.075 9.624 1.00 0.00 H new ATOM 0 HA LYS B 5 17.917 -2.682 11.231 1.00 0.00 H new ATOM 0 HB2 LYS B 5 18.768 -0.415 11.788 1.00 0.00 H new ATOM 0 HB3 LYS B 5 17.424 0.309 10.929 1.00 0.00 H new ATOM 0 HG2 LYS B 5 16.321 0.322 12.886 1.00 0.00 H new ATOM 0 HG3 LYS B 5 16.160 -1.415 12.716 1.00 0.00 H new ATOM 0 HD2 LYS B 5 17.122 -1.008 14.883 1.00 0.00 H new ATOM 0 HD3 LYS B 5 18.391 -1.680 13.878 1.00 0.00 H new ATOM 0 HE2 LYS B 5 19.613 0.258 13.875 1.00 0.00 H new ATOM 0 HE3 LYS B 5 18.194 1.283 13.800 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 19.339 1.524 15.905 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 17.797 0.859 16.157 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 19.172 -0.134 16.229 1.00 0.00 H new ATOM 1536 N ALA B 6 15.934 -2.856 9.222 1.00 0.00 N ATOM 1537 CA ALA B 6 14.592 -3.153 8.736 1.00 0.00 C ATOM 1538 C ALA B 6 14.385 -4.654 8.565 1.00 0.00 C ATOM 1539 O ALA B 6 15.262 -5.454 8.889 1.00 0.00 O ATOM 1540 CB ALA B 6 14.330 -2.435 7.420 1.00 0.00 C ATOM 0 H ALA B 6 16.680 -3.332 8.715 1.00 0.00 H new ATOM 0 HA ALA B 6 13.882 -2.795 9.482 1.00 0.00 H new ATOM 0 HB1 ALA B 6 13.324 -2.668 7.072 1.00 0.00 H new ATOM 0 HB2 ALA B 6 14.422 -1.359 7.568 1.00 0.00 H new ATOM 0 HB3 ALA B 6 15.056 -2.763 6.676 1.00 0.00 H new ATOM 1546 N VAL B 7 13.217 -5.028 8.052 1.00 0.00 N ATOM 1547 CA VAL B 7 12.888 -6.432 7.832 1.00 0.00 C ATOM 1548 C VAL B 7 12.024 -6.600 6.588 1.00 0.00 C ATOM 1549 O VAL B 7 10.829 -6.878 6.684 1.00 0.00 O ATOM 1550 CB VAL B 7 12.146 -7.033 9.041 1.00 0.00 C ATOM 1551 CG1 VAL B 7 11.895 -8.516 8.829 1.00 0.00 C ATOM 1552 CG2 VAL B 7 12.931 -6.794 10.322 1.00 0.00 C ATOM 0 H VAL B 7 12.481 -4.376 7.780 1.00 0.00 H new ATOM 0 HA VAL B 7 13.831 -6.961 7.695 1.00 0.00 H new ATOM 0 HB VAL B 7 11.181 -6.535 9.136 1.00 0.00 H new ATOM 0 HG11 VAL B 7 11.370 -8.923 9.693 1.00 0.00 H new ATOM 0 HG12 VAL B 7 11.288 -8.658 7.935 1.00 0.00 H new ATOM 0 HG13 VAL B 7 12.847 -9.032 8.706 1.00 0.00 H new ATOM 0 HG21 VAL B 7 12.392 -7.225 11.165 1.00 0.00 H new ATOM 0 HG22 VAL B 7 13.912 -7.263 10.241 1.00 0.00 H new ATOM 0 HG23 VAL B 7 13.053 -5.722 10.479 1.00 0.00 H new ATOM 1562 N ILE B 8 12.634 -6.429 5.421 1.00 0.00 N ATOM 1563 CA ILE B 8 11.915 -6.560 4.161 1.00 0.00 C ATOM 1564 C ILE B 8 10.818 -7.617 4.276 1.00 0.00 C ATOM 1565 O ILE B 8 10.955 -8.597 5.008 1.00 0.00 O ATOM 1566 CB ILE B 8 12.890 -6.883 2.990 1.00 0.00 C ATOM 1567 CG1 ILE B 8 13.095 -5.636 2.131 1.00 0.00 C ATOM 1568 CG2 ILE B 8 12.404 -8.044 2.123 1.00 0.00 C ATOM 1569 CD1 ILE B 8 14.035 -4.623 2.752 1.00 0.00 C ATOM 0 H ILE B 8 13.623 -6.200 5.322 1.00 0.00 H new ATOM 0 HA ILE B 8 11.441 -5.604 3.938 1.00 0.00 H new ATOM 0 HB ILE B 8 13.837 -7.192 3.432 1.00 0.00 H new ATOM 0 HG12 ILE B 8 13.486 -5.935 1.158 1.00 0.00 H new ATOM 0 HG13 ILE B 8 12.129 -5.163 1.954 1.00 0.00 H new ATOM 0 HG21 ILE B 8 13.121 -8.226 1.323 1.00 0.00 H new ATOM 0 HG22 ILE B 8 12.309 -8.941 2.736 1.00 0.00 H new ATOM 0 HG23 ILE B 8 11.435 -7.795 1.691 1.00 0.00 H new ATOM 0 HD11 ILE B 8 14.134 -3.764 2.088 1.00 0.00 H new ATOM 0 HD12 ILE B 8 13.635 -4.296 3.712 1.00 0.00 H new ATOM 0 HD13 ILE B 8 15.013 -5.079 2.903 1.00 0.00 H new ATOM 1581 N LYS B 9 9.732 -7.404 3.544 1.00 0.00 N ATOM 1582 CA LYS B 9 8.605 -8.331 3.558 1.00 0.00 C ATOM 1583 C LYS B 9 8.124 -8.614 2.142 1.00 0.00 C ATOM 1584 O LYS B 9 7.337 -9.532 1.914 1.00 0.00 O ATOM 1585 CB LYS B 9 7.454 -7.763 4.391 1.00 0.00 C ATOM 1586 CG LYS B 9 7.865 -7.340 5.791 1.00 0.00 C ATOM 1587 CD LYS B 9 7.487 -8.390 6.824 1.00 0.00 C ATOM 1588 CE LYS B 9 8.685 -8.804 7.663 1.00 0.00 C ATOM 1589 NZ LYS B 9 9.254 -10.104 7.215 1.00 0.00 N ATOM 0 H LYS B 9 9.607 -6.597 2.932 1.00 0.00 H new ATOM 0 HA LYS B 9 8.942 -9.265 4.008 1.00 0.00 H new ATOM 0 HB2 LYS B 9 7.030 -6.904 3.871 1.00 0.00 H new ATOM 0 HB3 LYS B 9 6.666 -8.512 4.464 1.00 0.00 H new ATOM 0 HG2 LYS B 9 8.941 -7.171 5.820 1.00 0.00 H new ATOM 0 HG3 LYS B 9 7.387 -6.393 6.041 1.00 0.00 H new ATOM 0 HD2 LYS B 9 6.705 -7.997 7.474 1.00 0.00 H new ATOM 0 HD3 LYS B 9 7.074 -9.265 6.321 1.00 0.00 H new ATOM 0 HE2 LYS B 9 9.453 -8.032 7.605 1.00 0.00 H new ATOM 0 HE3 LYS B 9 8.387 -8.879 8.709 1.00 0.00 H new ATOM 0 HZ1 LYS B 9 9.782 -10.540 7.998 1.00 0.00 H new ATOM 0 HZ2 LYS B 9 8.483 -10.738 6.921 1.00 0.00 H new ATOM 0 HZ3 LYS B 9 9.895 -9.944 6.412 1.00 0.00 H new ATOM 1603 N ASN B 10 8.600 -7.816 1.193 1.00 0.00 N ATOM 1604 CA ASN B 10 8.212 -7.979 -0.201 1.00 0.00 C ATOM 1605 C ASN B 10 8.770 -6.848 -1.054 1.00 0.00 C ATOM 1606 O ASN B 10 8.261 -5.727 -1.024 1.00 0.00 O ATOM 1607 CB ASN B 10 6.690 -8.019 -0.323 1.00 0.00 C ATOM 1608 CG ASN B 10 6.209 -9.148 -1.213 1.00 0.00 C ATOM 1609 OD1 ASN B 10 5.213 -9.808 -0.915 1.00 0.00 O ATOM 1610 ND2 ASN B 10 6.917 -9.377 -2.313 1.00 0.00 N ATOM 0 H ASN B 10 9.254 -7.052 1.364 1.00 0.00 H new ATOM 0 HA ASN B 10 8.625 -8.921 -0.562 1.00 0.00 H new ATOM 0 HB2 ASN B 10 6.252 -8.131 0.669 1.00 0.00 H new ATOM 0 HB3 ASN B 10 6.336 -7.069 -0.723 1.00 0.00 H new ATOM 0 HD21 ASN B 10 6.642 -10.125 -2.950 1.00 0.00 H new ATOM 0 HD22 ASN B 10 7.736 -8.805 -2.521 1.00 0.00 H new ATOM 1617 N ALA B 11 9.819 -7.146 -1.810 1.00 0.00 N ATOM 1618 CA ALA B 11 10.448 -6.148 -2.664 1.00 0.00 C ATOM 1619 C ALA B 11 10.637 -6.669 -4.085 1.00 0.00 C ATOM 1620 O ALA B 11 10.746 -7.874 -4.309 1.00 0.00 O ATOM 1621 CB ALA B 11 11.785 -5.726 -2.078 1.00 0.00 C ATOM 0 H ALA B 11 10.251 -8.069 -1.849 1.00 0.00 H new ATOM 0 HA ALA B 11 9.787 -5.282 -2.711 1.00 0.00 H new ATOM 0 HB1 ALA B 11 12.246 -4.980 -2.725 1.00 0.00 H new ATOM 0 HB2 ALA B 11 11.630 -5.301 -1.086 1.00 0.00 H new ATOM 0 HB3 ALA B 11 12.439 -6.594 -2.002 1.00 0.00 H new ATOM 1627 N ASP B 12 10.685 -5.746 -5.037 1.00 0.00 N ATOM 1628 CA ASP B 12 10.870 -6.095 -6.439 1.00 0.00 C ATOM 1629 C ASP B 12 11.666 -5.009 -7.155 1.00 0.00 C ATOM 1630 O ASP B 12 11.529 -4.810 -8.362 1.00 0.00 O ATOM 1631 CB ASP B 12 9.516 -6.295 -7.123 1.00 0.00 C ATOM 1632 CG ASP B 12 8.619 -7.252 -6.362 1.00 0.00 C ATOM 1633 OD1 ASP B 12 8.990 -8.438 -6.232 1.00 0.00 O ATOM 1634 OD2 ASP B 12 7.546 -6.817 -5.896 1.00 0.00 O ATOM 0 H ASP B 12 10.598 -4.745 -4.862 1.00 0.00 H new ATOM 0 HA ASP B 12 11.428 -7.030 -6.491 1.00 0.00 H new ATOM 0 HB2 ASP B 12 9.015 -5.332 -7.220 1.00 0.00 H new ATOM 0 HB3 ASP B 12 9.675 -6.675 -8.132 1.00 0.00 H new ATOM 1639 N MET B 13 12.498 -4.310 -6.391 1.00 0.00 N ATOM 1640 CA MET B 13 13.326 -3.237 -6.927 1.00 0.00 C ATOM 1641 C MET B 13 14.791 -3.663 -6.977 1.00 0.00 C ATOM 1642 O MET B 13 15.136 -4.772 -6.569 1.00 0.00 O ATOM 1643 CB MET B 13 13.166 -1.978 -6.068 1.00 0.00 C ATOM 1644 CG MET B 13 14.140 -0.864 -6.414 1.00 0.00 C ATOM 1645 SD MET B 13 13.472 0.774 -6.069 1.00 0.00 S ATOM 1646 CE MET B 13 12.852 0.541 -4.405 1.00 0.00 C ATOM 0 H MET B 13 12.617 -4.470 -5.391 1.00 0.00 H new ATOM 0 HA MET B 13 13.000 -3.017 -7.944 1.00 0.00 H new ATOM 0 HB2 MET B 13 12.148 -1.603 -6.177 1.00 0.00 H new ATOM 0 HB3 MET B 13 13.296 -2.247 -5.020 1.00 0.00 H new ATOM 0 HG2 MET B 13 15.061 -1.003 -5.848 1.00 0.00 H new ATOM 0 HG3 MET B 13 14.402 -0.930 -7.470 1.00 0.00 H new ATOM 0 HE1 MET B 13 12.920 1.480 -3.856 1.00 0.00 H new ATOM 0 HE2 MET B 13 11.811 0.220 -4.446 1.00 0.00 H new ATOM 0 HE3 MET B 13 13.447 -0.219 -3.898 1.00 0.00 H new ATOM 1656 N SER B 14 15.649 -2.786 -7.486 1.00 0.00 N ATOM 1657 CA SER B 14 17.071 -3.087 -7.586 1.00 0.00 C ATOM 1658 C SER B 14 17.663 -3.394 -6.214 1.00 0.00 C ATOM 1659 O SER B 14 17.488 -2.630 -5.268 1.00 0.00 O ATOM 1660 CB SER B 14 17.820 -1.920 -8.238 1.00 0.00 C ATOM 1661 OG SER B 14 17.766 -2.004 -9.651 1.00 0.00 O ATOM 0 H SER B 14 15.385 -1.864 -7.834 1.00 0.00 H new ATOM 0 HA SER B 14 17.185 -3.972 -8.212 1.00 0.00 H new ATOM 0 HB2 SER B 14 17.385 -0.976 -7.910 1.00 0.00 H new ATOM 0 HB3 SER B 14 18.860 -1.923 -7.910 1.00 0.00 H new ATOM 0 HG SER B 14 18.250 -1.247 -10.042 1.00 0.00 H new ATOM 1667 N GLU B 15 18.360 -4.525 -6.114 1.00 0.00 N ATOM 1668 CA GLU B 15 18.976 -4.938 -4.857 1.00 0.00 C ATOM 1669 C GLU B 15 19.437 -3.728 -4.055 1.00 0.00 C ATOM 1670 O GLU B 15 18.862 -3.403 -3.016 1.00 0.00 O ATOM 1671 CB GLU B 15 20.159 -5.870 -5.123 1.00 0.00 C ATOM 1672 CG GLU B 15 19.874 -7.325 -4.788 1.00 0.00 C ATOM 1673 CD GLU B 15 20.764 -8.286 -5.550 1.00 0.00 C ATOM 1674 OE1 GLU B 15 21.888 -8.557 -5.076 1.00 0.00 O ATOM 1675 OE2 GLU B 15 20.338 -8.769 -6.619 1.00 0.00 O ATOM 0 H GLU B 15 18.511 -5.171 -6.889 1.00 0.00 H new ATOM 0 HA GLU B 15 18.227 -5.474 -4.274 1.00 0.00 H new ATOM 0 HB2 GLU B 15 20.440 -5.796 -6.174 1.00 0.00 H new ATOM 0 HB3 GLU B 15 21.015 -5.532 -4.539 1.00 0.00 H new ATOM 0 HG2 GLU B 15 20.011 -7.481 -3.718 1.00 0.00 H new ATOM 0 HG3 GLU B 15 18.831 -7.547 -5.012 1.00 0.00 H new ATOM 1682 N GLU B 16 20.476 -3.063 -4.544 1.00 0.00 N ATOM 1683 CA GLU B 16 21.008 -1.884 -3.874 1.00 0.00 C ATOM 1684 C GLU B 16 19.908 -0.852 -3.670 1.00 0.00 C ATOM 1685 O GLU B 16 19.962 -0.036 -2.749 1.00 0.00 O ATOM 1686 CB GLU B 16 22.152 -1.281 -4.689 1.00 0.00 C ATOM 1687 CG GLU B 16 23.392 -2.159 -4.739 1.00 0.00 C ATOM 1688 CD GLU B 16 24.589 -1.518 -4.065 1.00 0.00 C ATOM 1689 OE1 GLU B 16 24.384 -0.675 -3.166 1.00 0.00 O ATOM 1690 OE2 GLU B 16 25.732 -1.858 -4.437 1.00 0.00 O ATOM 0 H GLU B 16 20.966 -3.320 -5.401 1.00 0.00 H new ATOM 0 HA GLU B 16 21.393 -2.183 -2.899 1.00 0.00 H new ATOM 0 HB2 GLU B 16 21.805 -1.098 -5.706 1.00 0.00 H new ATOM 0 HB3 GLU B 16 22.419 -0.313 -4.264 1.00 0.00 H new ATOM 0 HG2 GLU B 16 23.177 -3.113 -4.258 1.00 0.00 H new ATOM 0 HG3 GLU B 16 23.638 -2.375 -5.779 1.00 0.00 H new ATOM 1697 N MET B 17 18.906 -0.903 -4.541 1.00 0.00 N ATOM 1698 CA MET B 17 17.779 0.017 -4.469 1.00 0.00 C ATOM 1699 C MET B 17 16.875 -0.325 -3.291 1.00 0.00 C ATOM 1700 O MET B 17 16.299 0.563 -2.661 1.00 0.00 O ATOM 1701 CB MET B 17 16.977 -0.029 -5.771 1.00 0.00 C ATOM 1702 CG MET B 17 17.500 0.915 -6.841 1.00 0.00 C ATOM 1703 SD MET B 17 17.715 2.600 -6.236 1.00 0.00 S ATOM 1704 CE MET B 17 16.119 2.892 -5.478 1.00 0.00 C ATOM 0 H MET B 17 18.852 -1.574 -5.307 1.00 0.00 H new ATOM 0 HA MET B 17 18.170 1.024 -4.324 1.00 0.00 H new ATOM 0 HB2 MET B 17 16.989 -1.047 -6.159 1.00 0.00 H new ATOM 0 HB3 MET B 17 15.937 0.218 -5.557 1.00 0.00 H new ATOM 0 HG2 MET B 17 18.454 0.542 -7.214 1.00 0.00 H new ATOM 0 HG3 MET B 17 16.809 0.921 -7.684 1.00 0.00 H new ATOM 0 HE1 MET B 17 15.985 3.961 -5.313 1.00 0.00 H new ATOM 0 HE2 MET B 17 15.331 2.525 -6.136 1.00 0.00 H new ATOM 0 HE3 MET B 17 16.068 2.368 -4.524 1.00 0.00 H new ATOM 1714 N GLN B 18 16.752 -1.616 -2.995 1.00 0.00 N ATOM 1715 CA GLN B 18 15.915 -2.060 -1.889 1.00 0.00 C ATOM 1716 C GLN B 18 16.564 -1.724 -0.557 1.00 0.00 C ATOM 1717 O GLN B 18 15.931 -1.153 0.331 1.00 0.00 O ATOM 1718 CB GLN B 18 15.644 -3.555 -1.978 1.00 0.00 C ATOM 1719 CG GLN B 18 14.586 -3.902 -3.005 1.00 0.00 C ATOM 1720 CD GLN B 18 15.110 -4.838 -4.061 1.00 0.00 C ATOM 1721 OE1 GLN B 18 16.368 -4.649 -4.418 1.00 0.00 O flip ATOM 1722 NE2 GLN B 18 14.399 -5.717 -4.546 1.00 0.00 N flip ATOM 0 H GLN B 18 17.219 -2.367 -3.503 1.00 0.00 H new ATOM 0 HA GLN B 18 14.963 -1.533 -1.957 1.00 0.00 H new ATOM 0 HB2 GLN B 18 16.570 -4.073 -2.228 1.00 0.00 H new ATOM 0 HB3 GLN B 18 15.329 -3.921 -1.001 1.00 0.00 H new ATOM 0 HG2 GLN B 18 13.733 -4.361 -2.505 1.00 0.00 H new ATOM 0 HG3 GLN B 18 14.226 -2.988 -3.477 1.00 0.00 H new ATOM 0 HE21 GLN B 18 13.433 -5.821 -4.235 1.00 0.00 H new ATOM 0 HE22 GLN B 18 14.775 -6.342 -5.259 1.00 0.00 H new ATOM 1731 N GLN B 19 17.840 -2.066 -0.432 1.00 0.00 N ATOM 1732 CA GLN B 19 18.584 -1.781 0.782 1.00 0.00 C ATOM 1733 C GLN B 19 18.772 -0.280 0.908 1.00 0.00 C ATOM 1734 O GLN B 19 18.956 0.256 2.003 1.00 0.00 O ATOM 1735 CB GLN B 19 19.943 -2.485 0.762 1.00 0.00 C ATOM 1736 CG GLN B 19 19.855 -3.987 0.979 1.00 0.00 C ATOM 1737 CD GLN B 19 20.117 -4.385 2.418 1.00 0.00 C ATOM 1738 OE1 GLN B 19 21.323 -4.106 2.899 1.00 0.00 O flip ATOM 1739 NE2 GLN B 19 19.244 -4.937 3.089 1.00 0.00 N flip ATOM 0 H GLN B 19 18.378 -2.540 -1.157 1.00 0.00 H new ATOM 0 HA GLN B 19 18.025 -2.154 1.640 1.00 0.00 H new ATOM 0 HB2 GLN B 19 20.428 -2.293 -0.195 1.00 0.00 H new ATOM 0 HB3 GLN B 19 20.578 -2.052 1.534 1.00 0.00 H new ATOM 0 HG2 GLN B 19 18.865 -4.335 0.684 1.00 0.00 H new ATOM 0 HG3 GLN B 19 20.575 -4.487 0.331 1.00 0.00 H new ATOM 0 HE21 GLN B 19 18.331 -5.132 2.677 1.00 0.00 H new ATOM 0 HE22 GLN B 19 19.434 -5.199 4.056 1.00 0.00 H new ATOM 1748 N ASP B 20 18.701 0.396 -0.234 1.00 0.00 N ATOM 1749 CA ASP B 20 18.843 1.842 -0.273 1.00 0.00 C ATOM 1750 C ASP B 20 17.539 2.501 0.151 1.00 0.00 C ATOM 1751 O ASP B 20 17.538 3.544 0.805 1.00 0.00 O ATOM 1752 CB ASP B 20 19.243 2.307 -1.675 1.00 0.00 C ATOM 1753 CG ASP B 20 20.694 2.740 -1.747 1.00 0.00 C ATOM 1754 OD1 ASP B 20 21.501 2.247 -0.930 1.00 0.00 O ATOM 1755 OD2 ASP B 20 21.024 3.570 -2.619 1.00 0.00 O ATOM 0 H ASP B 20 18.546 -0.037 -1.144 1.00 0.00 H new ATOM 0 HA ASP B 20 19.631 2.135 0.421 1.00 0.00 H new ATOM 0 HB2 ASP B 20 19.072 1.498 -2.386 1.00 0.00 H new ATOM 0 HB3 ASP B 20 18.603 3.137 -1.976 1.00 0.00 H new ATOM 1760 N SER B 21 16.429 1.869 -0.213 1.00 0.00 N ATOM 1761 CA SER B 21 15.113 2.374 0.141 1.00 0.00 C ATOM 1762 C SER B 21 14.923 2.311 1.650 1.00 0.00 C ATOM 1763 O SER B 21 14.395 3.239 2.261 1.00 0.00 O ATOM 1764 CB SER B 21 14.025 1.565 -0.566 1.00 0.00 C ATOM 1765 OG SER B 21 14.482 0.261 -0.879 1.00 0.00 O ATOM 0 H SER B 21 16.417 1.004 -0.754 1.00 0.00 H new ATOM 0 HA SER B 21 15.035 3.412 -0.182 1.00 0.00 H new ATOM 0 HB2 SER B 21 13.143 1.501 0.071 1.00 0.00 H new ATOM 0 HB3 SER B 21 13.722 2.077 -1.480 1.00 0.00 H new ATOM 0 HG SER B 21 14.816 -0.172 -0.066 1.00 0.00 H new ATOM 1771 N VAL B 22 15.374 1.212 2.246 1.00 0.00 N ATOM 1772 CA VAL B 22 15.272 1.031 3.686 1.00 0.00 C ATOM 1773 C VAL B 22 16.105 2.081 4.410 1.00 0.00 C ATOM 1774 O VAL B 22 15.620 2.756 5.318 1.00 0.00 O ATOM 1775 CB VAL B 22 15.742 -0.369 4.121 1.00 0.00 C ATOM 1776 CG1 VAL B 22 15.664 -0.509 5.632 1.00 0.00 C ATOM 1777 CG2 VAL B 22 14.920 -1.448 3.432 1.00 0.00 C ATOM 0 H VAL B 22 15.813 0.435 1.753 1.00 0.00 H new ATOM 0 HA VAL B 22 14.220 1.140 3.951 1.00 0.00 H new ATOM 0 HB VAL B 22 16.782 -0.494 3.821 1.00 0.00 H new ATOM 0 HG11 VAL B 22 16.000 -1.504 5.923 1.00 0.00 H new ATOM 0 HG12 VAL B 22 16.302 0.240 6.100 1.00 0.00 H new ATOM 0 HG13 VAL B 22 14.634 -0.364 5.958 1.00 0.00 H new ATOM 0 HG21 VAL B 22 15.267 -2.430 3.752 1.00 0.00 H new ATOM 0 HG22 VAL B 22 13.869 -1.330 3.698 1.00 0.00 H new ATOM 0 HG23 VAL B 22 15.033 -1.358 2.352 1.00 0.00 H new ATOM 1787 N GLU B 23 17.364 2.220 3.996 1.00 0.00 N ATOM 1788 CA GLU B 23 18.259 3.197 4.601 1.00 0.00 C ATOM 1789 C GLU B 23 17.611 4.577 4.616 1.00 0.00 C ATOM 1790 O GLU B 23 17.715 5.313 5.599 1.00 0.00 O ATOM 1791 CB GLU B 23 19.585 3.251 3.841 1.00 0.00 C ATOM 1792 CG GLU B 23 20.255 1.894 3.692 1.00 0.00 C ATOM 1793 CD GLU B 23 21.303 1.878 2.597 1.00 0.00 C ATOM 1794 OE1 GLU B 23 21.103 2.565 1.574 1.00 0.00 O ATOM 1795 OE2 GLU B 23 22.325 1.179 2.764 1.00 0.00 O ATOM 0 H GLU B 23 17.783 1.669 3.247 1.00 0.00 H new ATOM 0 HA GLU B 23 18.455 2.890 5.628 1.00 0.00 H new ATOM 0 HB2 GLU B 23 19.410 3.672 2.851 1.00 0.00 H new ATOM 0 HB3 GLU B 23 20.264 3.928 4.359 1.00 0.00 H new ATOM 0 HG2 GLU B 23 20.719 1.616 4.638 1.00 0.00 H new ATOM 0 HG3 GLU B 23 19.497 1.141 3.476 1.00 0.00 H new ATOM 1802 N CYS B 24 16.936 4.918 3.524 1.00 0.00 N ATOM 1803 CA CYS B 24 16.261 6.206 3.418 1.00 0.00 C ATOM 1804 C CYS B 24 15.105 6.280 4.406 1.00 0.00 C ATOM 1805 O CYS B 24 14.862 7.320 5.024 1.00 0.00 O ATOM 1806 CB CYS B 24 15.749 6.426 1.992 1.00 0.00 C ATOM 1807 SG CYS B 24 14.874 7.990 1.755 1.00 0.00 S ATOM 0 H CYS B 24 16.842 4.322 2.702 1.00 0.00 H new ATOM 0 HA CYS B 24 16.978 6.992 3.656 1.00 0.00 H new ATOM 0 HB2 CYS B 24 16.594 6.387 1.304 1.00 0.00 H new ATOM 0 HB3 CYS B 24 15.083 5.605 1.726 1.00 0.00 H new ATOM 0 HG CYS B 24 15.357 8.604 0.716 1.00 0.00 H new ATOM 1813 N ALA B 25 14.414 5.156 4.582 1.00 0.00 N ATOM 1814 CA ALA B 25 13.311 5.092 5.524 1.00 0.00 C ATOM 1815 C ALA B 25 13.879 5.181 6.922 1.00 0.00 C ATOM 1816 O ALA B 25 13.246 5.690 7.847 1.00 0.00 O ATOM 1817 CB ALA B 25 12.517 3.806 5.342 1.00 0.00 C ATOM 0 H ALA B 25 14.601 4.285 4.086 1.00 0.00 H new ATOM 0 HA ALA B 25 12.625 5.921 5.349 1.00 0.00 H new ATOM 0 HB1 ALA B 25 11.696 3.781 6.059 1.00 0.00 H new ATOM 0 HB2 ALA B 25 12.116 3.766 4.329 1.00 0.00 H new ATOM 0 HB3 ALA B 25 13.170 2.949 5.508 1.00 0.00 H new ATOM 1823 N THR B 26 15.110 4.703 7.043 1.00 0.00 N ATOM 1824 CA THR B 26 15.830 4.734 8.297 1.00 0.00 C ATOM 1825 C THR B 26 16.217 6.167 8.625 1.00 0.00 C ATOM 1826 O THR B 26 16.077 6.619 9.761 1.00 0.00 O ATOM 1827 CB THR B 26 17.079 3.863 8.198 1.00 0.00 C ATOM 1828 OG1 THR B 26 16.791 2.644 7.535 1.00 0.00 O ATOM 1829 CG2 THR B 26 17.673 3.524 9.541 1.00 0.00 C ATOM 0 H THR B 26 15.632 4.285 6.273 1.00 0.00 H new ATOM 0 HA THR B 26 15.192 4.345 9.091 1.00 0.00 H new ATOM 0 HB THR B 26 17.801 4.455 7.636 1.00 0.00 H new ATOM 0 HG1 THR B 26 16.575 2.825 6.596 1.00 0.00 H new ATOM 0 HG21 THR B 26 18.558 2.903 9.401 1.00 0.00 H new ATOM 0 HG22 THR B 26 17.952 4.442 10.058 1.00 0.00 H new ATOM 0 HG23 THR B 26 16.939 2.981 10.137 1.00 0.00 H new ATOM 1837 N GLN B 27 16.691 6.884 7.609 1.00 0.00 N ATOM 1838 CA GLN B 27 17.083 8.274 7.775 1.00 0.00 C ATOM 1839 C GLN B 27 15.937 9.060 8.393 1.00 0.00 C ATOM 1840 O GLN B 27 16.123 9.810 9.352 1.00 0.00 O ATOM 1841 CB GLN B 27 17.475 8.886 6.429 1.00 0.00 C ATOM 1842 CG GLN B 27 18.220 7.923 5.519 1.00 0.00 C ATOM 1843 CD GLN B 27 18.897 8.627 4.360 1.00 0.00 C ATOM 1844 OE1 GLN B 27 18.123 9.393 3.602 1.00 0.00 O flip ATOM 1845 NE2 GLN B 27 20.101 8.481 4.149 1.00 0.00 N flip ATOM 0 H GLN B 27 16.812 6.522 6.663 1.00 0.00 H new ATOM 0 HA GLN B 27 17.947 8.318 8.438 1.00 0.00 H new ATOM 0 HB2 GLN B 27 16.575 9.232 5.920 1.00 0.00 H new ATOM 0 HB3 GLN B 27 18.098 9.763 6.605 1.00 0.00 H new ATOM 0 HG2 GLN B 27 18.968 7.384 6.100 1.00 0.00 H new ATOM 0 HG3 GLN B 27 17.522 7.181 5.132 1.00 0.00 H new ATOM 0 HE21 GLN B 27 20.657 7.882 4.759 1.00 0.00 H new ATOM 0 HE22 GLN B 27 20.543 8.960 3.364 1.00 0.00 H new ATOM 1854 N ALA B 28 14.744 8.865 7.842 1.00 0.00 N ATOM 1855 CA ALA B 28 13.553 9.539 8.341 1.00 0.00 C ATOM 1856 C ALA B 28 13.071 8.891 9.633 1.00 0.00 C ATOM 1857 O ALA B 28 12.332 9.497 10.409 1.00 0.00 O ATOM 1858 CB ALA B 28 12.451 9.512 7.292 1.00 0.00 C ATOM 0 H ALA B 28 14.577 8.245 7.049 1.00 0.00 H new ATOM 0 HA ALA B 28 13.809 10.577 8.552 1.00 0.00 H new ATOM 0 HB1 ALA B 28 11.567 10.019 7.679 1.00 0.00 H new ATOM 0 HB2 ALA B 28 12.795 10.019 6.390 1.00 0.00 H new ATOM 0 HB3 ALA B 28 12.201 8.478 7.054 1.00 0.00 H new ATOM 1864 N LEU B 29 13.496 7.652 9.856 1.00 0.00 N ATOM 1865 CA LEU B 29 13.112 6.911 11.051 1.00 0.00 C ATOM 1866 C LEU B 29 13.864 7.415 12.281 1.00 0.00 C ATOM 1867 O LEU B 29 13.297 7.516 13.369 1.00 0.00 O ATOM 1868 CB LEU B 29 13.378 5.423 10.855 1.00 0.00 C ATOM 1869 CG LEU B 29 12.285 4.681 10.094 1.00 0.00 C ATOM 1870 CD1 LEU B 29 12.879 3.530 9.309 1.00 0.00 C ATOM 1871 CD2 LEU B 29 11.215 4.180 11.052 1.00 0.00 C ATOM 0 H LEU B 29 14.109 7.139 9.222 1.00 0.00 H new ATOM 0 HA LEU B 29 12.046 7.069 11.215 1.00 0.00 H new ATOM 0 HB2 LEU B 29 14.321 5.302 10.321 1.00 0.00 H new ATOM 0 HB3 LEU B 29 13.503 4.957 11.832 1.00 0.00 H new ATOM 0 HG LEU B 29 11.819 5.373 9.393 1.00 0.00 H new ATOM 0 HD11 LEU B 29 12.087 3.009 8.771 1.00 0.00 H new ATOM 0 HD12 LEU B 29 13.610 3.914 8.597 1.00 0.00 H new ATOM 0 HD13 LEU B 29 13.369 2.837 9.993 1.00 0.00 H new ATOM 0 HD21 LEU B 29 10.443 3.653 10.492 1.00 0.00 H new ATOM 0 HD22 LEU B 29 11.665 3.501 11.777 1.00 0.00 H new ATOM 0 HD23 LEU B 29 10.770 5.026 11.575 1.00 0.00 H new ATOM 1883 N GLU B 30 15.146 7.720 12.101 1.00 0.00 N ATOM 1884 CA GLU B 30 15.980 8.204 13.196 1.00 0.00 C ATOM 1885 C GLU B 30 15.812 9.706 13.401 1.00 0.00 C ATOM 1886 O GLU B 30 15.944 10.207 14.516 1.00 0.00 O ATOM 1887 CB GLU B 30 17.449 7.877 12.923 1.00 0.00 C ATOM 1888 CG GLU B 30 18.070 6.961 13.964 1.00 0.00 C ATOM 1889 CD GLU B 30 18.736 7.727 15.090 1.00 0.00 C ATOM 1890 OE1 GLU B 30 19.768 8.382 14.835 1.00 0.00 O ATOM 1891 OE2 GLU B 30 18.226 7.670 16.228 1.00 0.00 O ATOM 0 H GLU B 30 15.630 7.640 11.207 1.00 0.00 H new ATOM 0 HA GLU B 30 15.660 7.700 14.108 1.00 0.00 H new ATOM 0 HB2 GLU B 30 17.532 7.409 11.942 1.00 0.00 H new ATOM 0 HB3 GLU B 30 18.018 8.806 12.882 1.00 0.00 H new ATOM 0 HG2 GLU B 30 17.299 6.311 14.378 1.00 0.00 H new ATOM 0 HG3 GLU B 30 18.806 6.316 13.483 1.00 0.00 H new ATOM 1898 N LYS B 31 15.525 10.422 12.320 1.00 0.00 N ATOM 1899 CA LYS B 31 15.346 11.867 12.389 1.00 0.00 C ATOM 1900 C LYS B 31 13.936 12.222 12.854 1.00 0.00 C ATOM 1901 O LYS B 31 13.733 13.223 13.540 1.00 0.00 O ATOM 1902 CB LYS B 31 15.620 12.500 11.025 1.00 0.00 C ATOM 1903 CG LYS B 31 17.032 13.037 10.875 1.00 0.00 C ATOM 1904 CD LYS B 31 17.596 12.737 9.495 1.00 0.00 C ATOM 1905 CE LYS B 31 19.033 13.214 9.364 1.00 0.00 C ATOM 1906 NZ LYS B 31 19.282 13.868 8.050 1.00 0.00 N ATOM 0 H LYS B 31 15.411 10.026 11.387 1.00 0.00 H new ATOM 0 HA LYS B 31 16.057 12.261 13.115 1.00 0.00 H new ATOM 0 HB2 LYS B 31 15.438 11.759 10.247 1.00 0.00 H new ATOM 0 HB3 LYS B 31 14.912 13.313 10.863 1.00 0.00 H new ATOM 0 HG2 LYS B 31 17.033 14.114 11.044 1.00 0.00 H new ATOM 0 HG3 LYS B 31 17.674 12.594 11.636 1.00 0.00 H new ATOM 0 HD2 LYS B 31 17.549 11.664 9.307 1.00 0.00 H new ATOM 0 HD3 LYS B 31 16.981 13.221 8.736 1.00 0.00 H new ATOM 0 HE2 LYS B 31 19.257 13.916 10.167 1.00 0.00 H new ATOM 0 HE3 LYS B 31 19.709 12.367 9.482 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 20.273 14.179 7.999 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 19.092 13.191 7.284 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 18.655 14.691 7.948 1.00 0.00 H new ATOM 1920 N TYR B 32 12.968 11.394 12.476 1.00 0.00 N ATOM 1921 CA TYR B 32 11.578 11.620 12.855 1.00 0.00 C ATOM 1922 C TYR B 32 10.865 10.297 13.111 1.00 0.00 C ATOM 1923 O TYR B 32 11.280 9.251 12.614 1.00 0.00 O ATOM 1924 CB TYR B 32 10.845 12.402 11.762 1.00 0.00 C ATOM 1925 CG TYR B 32 11.765 13.059 10.760 1.00 0.00 C ATOM 1926 CD1 TYR B 32 12.624 12.301 9.973 1.00 0.00 C ATOM 1927 CD2 TYR B 32 11.773 14.439 10.595 1.00 0.00 C ATOM 1928 CE1 TYR B 32 13.462 12.897 9.052 1.00 0.00 C ATOM 1929 CE2 TYR B 32 12.609 15.043 9.675 1.00 0.00 C ATOM 1930 CZ TYR B 32 13.453 14.268 8.907 1.00 0.00 C ATOM 1931 OH TYR B 32 14.287 14.865 7.990 1.00 0.00 O ATOM 0 H TYR B 32 13.120 10.561 11.908 1.00 0.00 H new ATOM 0 HA TYR B 32 11.570 12.204 13.775 1.00 0.00 H new ATOM 0 HB2 TYR B 32 10.172 11.726 11.234 1.00 0.00 H new ATOM 0 HB3 TYR B 32 10.226 13.168 12.229 1.00 0.00 H new ATOM 0 HD1 TYR B 32 12.636 11.227 10.084 1.00 0.00 H new ATOM 0 HD2 TYR B 32 11.115 15.049 11.196 1.00 0.00 H new ATOM 0 HE1 TYR B 32 14.122 12.292 8.448 1.00 0.00 H new ATOM 0 HE2 TYR B 32 12.602 16.117 9.558 1.00 0.00 H new ATOM 0 HH TYR B 32 14.156 15.836 8.012 1.00 0.00 H new ATOM 1941 N ASN B 33 9.790 10.349 13.891 1.00 0.00 N ATOM 1942 CA ASN B 33 9.024 9.149 14.211 1.00 0.00 C ATOM 1943 C ASN B 33 7.560 9.307 13.815 1.00 0.00 C ATOM 1944 O ASN B 33 6.673 8.709 14.424 1.00 0.00 O ATOM 1945 CB ASN B 33 9.132 8.830 15.703 1.00 0.00 C ATOM 1946 CG ASN B 33 9.125 10.077 16.567 1.00 0.00 C ATOM 1947 OD1 ASN B 33 8.069 10.874 16.449 1.00 0.00 O flip ATOM 1948 ND2 ASN B 33 10.058 10.320 17.333 1.00 0.00 N flip ATOM 0 H ASN B 33 9.430 11.206 14.312 1.00 0.00 H new ATOM 0 HA ASN B 33 9.444 8.322 13.639 1.00 0.00 H new ATOM 0 HB2 ASN B 33 8.302 8.186 15.994 1.00 0.00 H new ATOM 0 HB3 ASN B 33 10.049 8.271 15.886 1.00 0.00 H new ATOM 0 HD21 ASN B 33 10.850 9.680 17.392 1.00 0.00 H new ATOM 0 HD22 ASN B 33 10.039 11.162 17.909 1.00 0.00 H new ATOM 1955 N ILE B 34 7.315 10.109 12.784 1.00 0.00 N ATOM 1956 CA ILE B 34 5.959 10.336 12.299 1.00 0.00 C ATOM 1957 C ILE B 34 5.742 9.632 10.966 1.00 0.00 C ATOM 1958 O ILE B 34 6.279 10.049 9.941 1.00 0.00 O ATOM 1959 CB ILE B 34 5.658 11.837 12.128 1.00 0.00 C ATOM 1960 CG1 ILE B 34 6.355 12.651 13.218 1.00 0.00 C ATOM 1961 CG2 ILE B 34 4.158 12.084 12.156 1.00 0.00 C ATOM 1962 CD1 ILE B 34 6.050 12.166 14.614 1.00 0.00 C ATOM 0 H ILE B 34 8.037 10.612 12.269 1.00 0.00 H new ATOM 0 HA ILE B 34 5.280 9.928 13.048 1.00 0.00 H new ATOM 0 HB ILE B 34 6.043 12.158 11.160 1.00 0.00 H new ATOM 0 HG12 ILE B 34 7.432 12.615 13.056 1.00 0.00 H new ATOM 0 HG13 ILE B 34 6.054 13.695 13.130 1.00 0.00 H new ATOM 0 HG21 ILE B 34 3.962 13.149 12.034 1.00 0.00 H new ATOM 0 HG22 ILE B 34 3.683 11.533 11.344 1.00 0.00 H new ATOM 0 HG23 ILE B 34 3.752 11.747 13.110 1.00 0.00 H new ATOM 0 HD11 ILE B 34 6.576 12.788 15.338 1.00 0.00 H new ATOM 0 HD12 ILE B 34 4.977 12.228 14.794 1.00 0.00 H new ATOM 0 HD13 ILE B 34 6.376 11.131 14.719 1.00 0.00 H new ATOM 1974 N GLU B 35 4.961 8.557 10.988 1.00 0.00 N ATOM 1975 CA GLU B 35 4.683 7.788 9.780 1.00 0.00 C ATOM 1976 C GLU B 35 4.722 8.677 8.541 1.00 0.00 C ATOM 1977 O GLU B 35 5.643 8.586 7.730 1.00 0.00 O ATOM 1978 CB GLU B 35 3.321 7.106 9.890 1.00 0.00 C ATOM 1979 CG GLU B 35 2.961 6.692 11.307 1.00 0.00 C ATOM 1980 CD GLU B 35 1.514 6.985 11.651 1.00 0.00 C ATOM 1981 OE1 GLU B 35 0.927 7.894 11.026 1.00 0.00 O ATOM 1982 OE2 GLU B 35 0.968 6.306 12.545 1.00 0.00 O ATOM 0 H GLU B 35 4.509 8.198 11.829 1.00 0.00 H new ATOM 0 HA GLU B 35 5.457 7.028 9.679 1.00 0.00 H new ATOM 0 HB2 GLU B 35 2.554 7.782 9.512 1.00 0.00 H new ATOM 0 HB3 GLU B 35 3.313 6.224 9.249 1.00 0.00 H new ATOM 0 HG2 GLU B 35 3.151 5.626 11.429 1.00 0.00 H new ATOM 0 HG3 GLU B 35 3.610 7.214 12.010 1.00 0.00 H new ATOM 1989 N LYS B 36 3.721 9.537 8.398 1.00 0.00 N ATOM 1990 CA LYS B 36 3.653 10.439 7.256 1.00 0.00 C ATOM 1991 C LYS B 36 4.978 11.174 7.071 1.00 0.00 C ATOM 1992 O LYS B 36 5.576 11.138 5.994 1.00 0.00 O ATOM 1993 CB LYS B 36 2.516 11.448 7.432 1.00 0.00 C ATOM 1994 CG LYS B 36 1.567 11.110 8.571 1.00 0.00 C ATOM 1995 CD LYS B 36 0.117 11.317 8.166 1.00 0.00 C ATOM 1996 CE LYS B 36 -0.674 12.013 9.262 1.00 0.00 C ATOM 1997 NZ LYS B 36 -1.051 13.402 8.879 1.00 0.00 N ATOM 0 H LYS B 36 2.948 9.629 9.057 1.00 0.00 H new ATOM 0 HA LYS B 36 3.456 9.842 6.366 1.00 0.00 H new ATOM 0 HB2 LYS B 36 2.943 12.435 7.608 1.00 0.00 H new ATOM 0 HB3 LYS B 36 1.948 11.507 6.504 1.00 0.00 H new ATOM 0 HG2 LYS B 36 1.717 10.074 8.876 1.00 0.00 H new ATOM 0 HG3 LYS B 36 1.797 11.733 9.435 1.00 0.00 H new ATOM 0 HD2 LYS B 36 0.074 11.910 7.253 1.00 0.00 H new ATOM 0 HD3 LYS B 36 -0.340 10.353 7.942 1.00 0.00 H new ATOM 0 HE2 LYS B 36 -1.575 11.439 9.480 1.00 0.00 H new ATOM 0 HE3 LYS B 36 -0.083 12.037 10.177 1.00 0.00 H new ATOM 0 HZ1 LYS B 36 -1.589 13.842 9.653 1.00 0.00 H new ATOM 0 HZ2 LYS B 36 -0.191 13.957 8.696 1.00 0.00 H new ATOM 0 HZ3 LYS B 36 -1.637 13.378 8.020 1.00 0.00 H new ATOM 2011 N ASP B 37 5.434 11.840 8.130 1.00 0.00 N ATOM 2012 CA ASP B 37 6.691 12.582 8.087 1.00 0.00 C ATOM 2013 C ASP B 37 7.787 11.745 7.439 1.00 0.00 C ATOM 2014 O ASP B 37 8.297 12.086 6.372 1.00 0.00 O ATOM 2015 CB ASP B 37 7.112 12.986 9.503 1.00 0.00 C ATOM 2016 CG ASP B 37 6.478 14.292 9.942 1.00 0.00 C ATOM 2017 OD1 ASP B 37 5.338 14.257 10.452 1.00 0.00 O ATOM 2018 OD2 ASP B 37 7.122 15.350 9.775 1.00 0.00 O ATOM 0 H ASP B 37 4.952 11.881 9.028 1.00 0.00 H new ATOM 0 HA ASP B 37 6.540 13.480 7.488 1.00 0.00 H new ATOM 0 HB2 ASP B 37 6.834 12.197 10.201 1.00 0.00 H new ATOM 0 HB3 ASP B 37 8.197 13.080 9.544 1.00 0.00 H new ATOM 2023 N ILE B 38 8.140 10.646 8.093 1.00 0.00 N ATOM 2024 CA ILE B 38 9.171 9.749 7.593 1.00 0.00 C ATOM 2025 C ILE B 38 9.001 9.489 6.098 1.00 0.00 C ATOM 2026 O ILE B 38 9.919 9.716 5.311 1.00 0.00 O ATOM 2027 CB ILE B 38 9.146 8.406 8.346 1.00 0.00 C ATOM 2028 CG1 ILE B 38 9.182 8.646 9.857 1.00 0.00 C ATOM 2029 CG2 ILE B 38 10.313 7.532 7.917 1.00 0.00 C ATOM 2030 CD1 ILE B 38 8.263 7.732 10.638 1.00 0.00 C ATOM 0 H ILE B 38 7.723 10.354 8.977 1.00 0.00 H new ATOM 0 HA ILE B 38 10.131 10.238 7.761 1.00 0.00 H new ATOM 0 HB ILE B 38 8.221 7.886 8.098 1.00 0.00 H new ATOM 0 HG12 ILE B 38 10.203 8.511 10.214 1.00 0.00 H new ATOM 0 HG13 ILE B 38 8.908 9.682 10.059 1.00 0.00 H new ATOM 0 HG21 ILE B 38 10.279 6.587 8.460 1.00 0.00 H new ATOM 0 HG22 ILE B 38 10.248 7.338 6.846 1.00 0.00 H new ATOM 0 HG23 ILE B 38 11.250 8.043 8.137 1.00 0.00 H new ATOM 0 HD11 ILE B 38 8.341 7.959 11.701 1.00 0.00 H new ATOM 0 HD12 ILE B 38 7.235 7.883 10.309 1.00 0.00 H new ATOM 0 HD13 ILE B 38 8.550 6.695 10.467 1.00 0.00 H new ATOM 2042 N ALA B 39 7.821 9.009 5.716 1.00 0.00 N ATOM 2043 CA ALA B 39 7.530 8.714 4.317 1.00 0.00 C ATOM 2044 C ALA B 39 7.753 9.935 3.431 1.00 0.00 C ATOM 2045 O ALA B 39 8.241 9.816 2.307 1.00 0.00 O ATOM 2046 CB ALA B 39 6.101 8.212 4.172 1.00 0.00 C ATOM 0 H ALA B 39 7.051 8.816 6.356 1.00 0.00 H new ATOM 0 HA ALA B 39 8.218 7.934 3.990 1.00 0.00 H new ATOM 0 HB1 ALA B 39 5.896 7.995 3.124 1.00 0.00 H new ATOM 0 HB2 ALA B 39 5.973 7.304 4.762 1.00 0.00 H new ATOM 0 HB3 ALA B 39 5.409 8.976 4.527 1.00 0.00 H new ATOM 2052 N ALA B 40 7.391 11.106 3.941 1.00 0.00 N ATOM 2053 CA ALA B 40 7.550 12.348 3.192 1.00 0.00 C ATOM 2054 C ALA B 40 9.004 12.566 2.787 1.00 0.00 C ATOM 2055 O ALA B 40 9.321 12.681 1.602 1.00 0.00 O ATOM 2056 CB ALA B 40 7.050 13.525 4.015 1.00 0.00 C ATOM 0 H ALA B 40 6.985 11.222 4.870 1.00 0.00 H new ATOM 0 HA ALA B 40 6.955 12.272 2.282 1.00 0.00 H new ATOM 0 HB1 ALA B 40 7.174 14.446 3.445 1.00 0.00 H new ATOM 0 HB2 ALA B 40 5.995 13.383 4.250 1.00 0.00 H new ATOM 0 HB3 ALA B 40 7.622 13.591 4.940 1.00 0.00 H new ATOM 2062 N HIS B 41 9.883 12.624 3.780 1.00 0.00 N ATOM 2063 CA HIS B 41 11.305 12.832 3.537 1.00 0.00 C ATOM 2064 C HIS B 41 11.873 11.744 2.631 1.00 0.00 C ATOM 2065 O HIS B 41 12.772 11.999 1.829 1.00 0.00 O ATOM 2066 CB HIS B 41 12.065 12.856 4.865 1.00 0.00 C ATOM 2067 CG HIS B 41 11.196 13.191 6.037 1.00 0.00 C ATOM 2068 ND1 HIS B 41 10.111 13.996 6.133 1.00 0.00 N flip ATOM 2069 CD2 HIS B 41 11.396 12.669 7.297 1.00 0.00 C flip ATOM 2070 CE1 HIS B 41 9.682 13.945 7.435 1.00 0.00 C flip ATOM 2071 NE2 HIS B 41 10.471 13.138 8.116 1.00 0.00 N flip ATOM 0 H HIS B 41 9.635 12.529 4.765 1.00 0.00 H new ATOM 0 HA HIS B 41 11.427 13.791 3.034 1.00 0.00 H new ATOM 0 HB2 HIS B 41 12.526 11.882 5.030 1.00 0.00 H new ATOM 0 HB3 HIS B 41 12.873 13.585 4.800 1.00 0.00 H new ATOM 0 HD2 HIS B 41 12.185 11.984 7.572 1.00 0.00 H new ATOM 0 HE1 HIS B 41 8.834 14.480 7.837 1.00 0.00 H new ATOM 0 HE2 HIS B 41 10.383 12.914 9.107 1.00 0.00 H new ATOM 2080 N ILE B 42 11.347 10.532 2.764 1.00 0.00 N ATOM 2081 CA ILE B 42 11.806 9.408 1.957 1.00 0.00 C ATOM 2082 C ILE B 42 11.472 9.612 0.482 1.00 0.00 C ATOM 2083 O ILE B 42 12.363 9.824 -0.340 1.00 0.00 O ATOM 2084 CB ILE B 42 11.190 8.079 2.436 1.00 0.00 C ATOM 2085 CG1 ILE B 42 11.466 7.869 3.926 1.00 0.00 C ATOM 2086 CG2 ILE B 42 11.738 6.918 1.623 1.00 0.00 C ATOM 2087 CD1 ILE B 42 10.713 6.698 4.522 1.00 0.00 C ATOM 0 H ILE B 42 10.603 10.303 3.423 1.00 0.00 H new ATOM 0 HA ILE B 42 12.888 9.359 2.076 1.00 0.00 H new ATOM 0 HB ILE B 42 10.111 8.124 2.289 1.00 0.00 H new ATOM 0 HG12 ILE B 42 12.535 7.714 4.071 1.00 0.00 H new ATOM 0 HG13 ILE B 42 11.199 8.776 4.468 1.00 0.00 H new ATOM 0 HG21 ILE B 42 11.293 5.987 1.973 1.00 0.00 H new ATOM 0 HG22 ILE B 42 11.494 7.063 0.571 1.00 0.00 H new ATOM 0 HG23 ILE B 42 12.821 6.870 1.741 1.00 0.00 H new ATOM 0 HD11 ILE B 42 10.957 6.609 5.581 1.00 0.00 H new ATOM 0 HD12 ILE B 42 9.641 6.859 4.409 1.00 0.00 H new ATOM 0 HD13 ILE B 42 10.998 5.781 4.006 1.00 0.00 H new ATOM 2099 N LYS B 43 10.186 9.548 0.155 1.00 0.00 N ATOM 2100 CA LYS B 43 9.742 9.725 -1.225 1.00 0.00 C ATOM 2101 C LYS B 43 10.441 10.916 -1.875 1.00 0.00 C ATOM 2102 O LYS B 43 10.777 10.879 -3.059 1.00 0.00 O ATOM 2103 CB LYS B 43 8.224 9.919 -1.277 1.00 0.00 C ATOM 2104 CG LYS B 43 7.678 10.049 -2.690 1.00 0.00 C ATOM 2105 CD LYS B 43 7.546 11.504 -3.106 1.00 0.00 C ATOM 2106 CE LYS B 43 7.712 11.673 -4.609 1.00 0.00 C ATOM 2107 NZ LYS B 43 6.412 11.567 -5.328 1.00 0.00 N ATOM 0 H LYS B 43 9.434 9.376 0.823 1.00 0.00 H new ATOM 0 HA LYS B 43 10.005 8.825 -1.781 1.00 0.00 H new ATOM 0 HB2 LYS B 43 7.741 9.075 -0.785 1.00 0.00 H new ATOM 0 HB3 LYS B 43 7.960 10.812 -0.710 1.00 0.00 H new ATOM 0 HG2 LYS B 43 8.338 9.530 -3.385 1.00 0.00 H new ATOM 0 HG3 LYS B 43 6.704 9.563 -2.751 1.00 0.00 H new ATOM 0 HD2 LYS B 43 6.570 11.883 -2.802 1.00 0.00 H new ATOM 0 HD3 LYS B 43 8.296 12.101 -2.587 1.00 0.00 H new ATOM 0 HE2 LYS B 43 8.164 12.643 -4.817 1.00 0.00 H new ATOM 0 HE3 LYS B 43 8.398 10.914 -4.986 1.00 0.00 H new ATOM 0 HZ1 LYS B 43 6.586 11.483 -6.350 1.00 0.00 H new ATOM 0 HZ2 LYS B 43 5.898 10.726 -4.995 1.00 0.00 H new ATOM 0 HZ3 LYS B 43 5.842 12.417 -5.142 1.00 0.00 H new ATOM 2121 N LYS B 44 10.656 11.971 -1.095 1.00 0.00 N ATOM 2122 CA LYS B 44 11.313 13.172 -1.597 1.00 0.00 C ATOM 2123 C LYS B 44 12.796 12.921 -1.845 1.00 0.00 C ATOM 2124 O LYS B 44 13.315 13.205 -2.927 1.00 0.00 O ATOM 2125 CB LYS B 44 11.138 14.325 -0.607 1.00 0.00 C ATOM 2126 CG LYS B 44 9.815 15.057 -0.750 1.00 0.00 C ATOM 2127 CD LYS B 44 9.876 16.111 -1.844 1.00 0.00 C ATOM 2128 CE LYS B 44 8.542 16.822 -2.011 1.00 0.00 C ATOM 2129 NZ LYS B 44 8.642 17.975 -2.948 1.00 0.00 N ATOM 0 H LYS B 44 10.385 12.018 -0.113 1.00 0.00 H new ATOM 0 HA LYS B 44 10.847 13.440 -2.545 1.00 0.00 H new ATOM 0 HB2 LYS B 44 11.220 13.936 0.408 1.00 0.00 H new ATOM 0 HB3 LYS B 44 11.953 15.036 -0.743 1.00 0.00 H new ATOM 0 HG2 LYS B 44 9.025 14.341 -0.977 1.00 0.00 H new ATOM 0 HG3 LYS B 44 9.555 15.529 0.197 1.00 0.00 H new ATOM 0 HD2 LYS B 44 10.650 16.840 -1.605 1.00 0.00 H new ATOM 0 HD3 LYS B 44 10.160 15.642 -2.786 1.00 0.00 H new ATOM 0 HE2 LYS B 44 7.798 16.116 -2.381 1.00 0.00 H new ATOM 0 HE3 LYS B 44 8.193 17.172 -1.040 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 7.712 18.433 -3.035 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 9.333 18.661 -2.582 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 8.950 17.637 -3.882 1.00 0.00 H new ATOM 2143 N GLU B 45 13.473 12.388 -0.836 1.00 0.00 N ATOM 2144 CA GLU B 45 14.898 12.095 -0.936 1.00 0.00 C ATOM 2145 C GLU B 45 15.166 11.054 -2.018 1.00 0.00 C ATOM 2146 O GLU B 45 16.257 11.002 -2.585 1.00 0.00 O ATOM 2147 CB GLU B 45 15.433 11.600 0.409 1.00 0.00 C ATOM 2148 CG GLU B 45 15.763 12.720 1.383 1.00 0.00 C ATOM 2149 CD GLU B 45 17.132 12.557 2.015 1.00 0.00 C ATOM 2150 OE1 GLU B 45 17.270 11.706 2.919 1.00 0.00 O ATOM 2151 OE2 GLU B 45 18.064 13.279 1.607 1.00 0.00 O ATOM 0 H GLU B 45 13.057 12.149 0.064 1.00 0.00 H new ATOM 0 HA GLU B 45 15.414 13.015 -1.208 1.00 0.00 H new ATOM 0 HB2 GLU B 45 14.694 10.940 0.864 1.00 0.00 H new ATOM 0 HB3 GLU B 45 16.329 11.004 0.237 1.00 0.00 H new ATOM 0 HG2 GLU B 45 15.719 13.676 0.861 1.00 0.00 H new ATOM 0 HG3 GLU B 45 15.006 12.750 2.167 1.00 0.00 H new ATOM 2158 N PHE B 46 14.164 10.229 -2.299 1.00 0.00 N ATOM 2159 CA PHE B 46 14.293 9.191 -3.315 1.00 0.00 C ATOM 2160 C PHE B 46 14.216 9.795 -4.712 1.00 0.00 C ATOM 2161 O PHE B 46 15.041 9.494 -5.574 1.00 0.00 O ATOM 2162 CB PHE B 46 13.201 8.136 -3.141 1.00 0.00 C ATOM 2163 CG PHE B 46 13.734 6.784 -2.768 1.00 0.00 C ATOM 2164 CD1 PHE B 46 14.361 6.586 -1.549 1.00 0.00 C ATOM 2165 CD2 PHE B 46 13.608 5.712 -3.635 1.00 0.00 C ATOM 2166 CE1 PHE B 46 14.852 5.342 -1.201 1.00 0.00 C ATOM 2167 CE2 PHE B 46 14.097 4.466 -3.293 1.00 0.00 C ATOM 2168 CZ PHE B 46 14.720 4.281 -2.076 1.00 0.00 C ATOM 0 H PHE B 46 13.254 10.258 -1.838 1.00 0.00 H new ATOM 0 HA PHE B 46 15.266 8.715 -3.194 1.00 0.00 H new ATOM 0 HB2 PHE B 46 12.504 8.469 -2.372 1.00 0.00 H new ATOM 0 HB3 PHE B 46 12.636 8.052 -4.069 1.00 0.00 H new ATOM 0 HD1 PHE B 46 14.467 7.413 -0.863 1.00 0.00 H new ATOM 0 HD2 PHE B 46 13.122 5.851 -4.589 1.00 0.00 H new ATOM 0 HE1 PHE B 46 15.338 5.199 -0.247 1.00 0.00 H new ATOM 0 HE2 PHE B 46 13.992 3.637 -3.978 1.00 0.00 H new ATOM 0 HZ PHE B 46 15.104 3.308 -1.808 1.00 0.00 H new ATOM 2178 N ASP B 47 13.223 10.651 -4.927 1.00 0.00 N ATOM 2179 CA ASP B 47 13.047 11.301 -6.218 1.00 0.00 C ATOM 2180 C ASP B 47 14.226 12.221 -6.512 1.00 0.00 C ATOM 2181 O ASP B 47 14.531 12.510 -7.669 1.00 0.00 O ATOM 2182 CB ASP B 47 11.742 12.097 -6.241 1.00 0.00 C ATOM 2183 CG ASP B 47 11.871 13.443 -5.555 1.00 0.00 C ATOM 2184 OD1 ASP B 47 12.508 14.346 -6.137 1.00 0.00 O ATOM 2185 OD2 ASP B 47 11.338 13.592 -4.437 1.00 0.00 O ATOM 0 H ASP B 47 12.530 10.910 -4.225 1.00 0.00 H new ATOM 0 HA ASP B 47 13.001 10.531 -6.988 1.00 0.00 H new ATOM 0 HB2 ASP B 47 11.430 12.248 -7.275 1.00 0.00 H new ATOM 0 HB3 ASP B 47 10.958 11.518 -5.753 1.00 0.00 H new ATOM 2190 N LYS B 48 14.885 12.673 -5.452 1.00 0.00 N ATOM 2191 CA LYS B 48 16.034 13.558 -5.584 1.00 0.00 C ATOM 2192 C LYS B 48 17.326 12.750 -5.692 1.00 0.00 C ATOM 2193 O LYS B 48 18.201 13.058 -6.501 1.00 0.00 O ATOM 2194 CB LYS B 48 16.086 14.531 -4.393 1.00 0.00 C ATOM 2195 CG LYS B 48 17.161 14.215 -3.360 1.00 0.00 C ATOM 2196 CD LYS B 48 18.412 15.045 -3.594 1.00 0.00 C ATOM 2197 CE LYS B 48 19.432 14.290 -4.430 1.00 0.00 C ATOM 2198 NZ LYS B 48 20.723 14.120 -3.709 1.00 0.00 N ATOM 0 H LYS B 48 14.642 12.440 -4.489 1.00 0.00 H new ATOM 0 HA LYS B 48 15.930 14.140 -6.500 1.00 0.00 H new ATOM 0 HB2 LYS B 48 16.251 15.540 -4.772 1.00 0.00 H new ATOM 0 HB3 LYS B 48 15.115 14.531 -3.898 1.00 0.00 H new ATOM 0 HG2 LYS B 48 16.775 14.409 -2.359 1.00 0.00 H new ATOM 0 HG3 LYS B 48 17.411 13.155 -3.405 1.00 0.00 H new ATOM 0 HD2 LYS B 48 18.145 15.975 -4.096 1.00 0.00 H new ATOM 0 HD3 LYS B 48 18.855 15.316 -2.636 1.00 0.00 H new ATOM 0 HE2 LYS B 48 19.032 13.311 -4.694 1.00 0.00 H new ATOM 0 HE3 LYS B 48 19.605 14.826 -5.363 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 21.392 13.600 -4.313 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 21.118 15.054 -3.479 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 20.563 13.586 -2.831 1.00 0.00 H new ATOM 2212 N LYS B 49 17.435 11.717 -4.864 1.00 0.00 N ATOM 2213 CA LYS B 49 18.615 10.862 -4.855 1.00 0.00 C ATOM 2214 C LYS B 49 18.529 9.797 -5.946 1.00 0.00 C ATOM 2215 O LYS B 49 19.522 9.147 -6.269 1.00 0.00 O ATOM 2216 CB LYS B 49 18.769 10.194 -3.487 1.00 0.00 C ATOM 2217 CG LYS B 49 20.215 9.936 -3.094 1.00 0.00 C ATOM 2218 CD LYS B 49 20.312 8.932 -1.955 1.00 0.00 C ATOM 2219 CE LYS B 49 21.652 8.215 -1.957 1.00 0.00 C ATOM 2220 NZ LYS B 49 22.407 8.442 -0.694 1.00 0.00 N ATOM 0 H LYS B 49 16.718 11.451 -4.189 1.00 0.00 H new ATOM 0 HA LYS B 49 19.487 11.485 -5.053 1.00 0.00 H new ATOM 0 HB2 LYS B 49 18.303 10.824 -2.730 1.00 0.00 H new ATOM 0 HB3 LYS B 49 18.228 9.248 -3.491 1.00 0.00 H new ATOM 0 HG2 LYS B 49 20.767 9.563 -3.957 1.00 0.00 H new ATOM 0 HG3 LYS B 49 20.685 10.873 -2.796 1.00 0.00 H new ATOM 0 HD2 LYS B 49 20.174 9.445 -1.003 1.00 0.00 H new ATOM 0 HD3 LYS B 49 19.507 8.202 -2.043 1.00 0.00 H new ATOM 0 HE2 LYS B 49 21.491 7.146 -2.096 1.00 0.00 H new ATOM 0 HE3 LYS B 49 22.247 8.561 -2.802 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 23.315 7.936 -0.736 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 22.583 9.460 -0.573 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 21.851 8.089 0.111 1.00 0.00 H new ATOM 2234 N TYR B 50 17.336 9.620 -6.507 1.00 0.00 N ATOM 2235 CA TYR B 50 17.127 8.628 -7.555 1.00 0.00 C ATOM 2236 C TYR B 50 16.435 9.239 -8.772 1.00 0.00 C ATOM 2237 O TYR B 50 17.056 9.412 -9.820 1.00 0.00 O ATOM 2238 CB TYR B 50 16.303 7.457 -7.016 1.00 0.00 C ATOM 2239 CG TYR B 50 16.957 6.743 -5.855 1.00 0.00 C ATOM 2240 CD1 TYR B 50 18.173 6.091 -6.012 1.00 0.00 C ATOM 2241 CD2 TYR B 50 16.360 6.723 -4.600 1.00 0.00 C ATOM 2242 CE1 TYR B 50 18.775 5.438 -4.955 1.00 0.00 C ATOM 2243 CE2 TYR B 50 16.956 6.073 -3.536 1.00 0.00 C ATOM 2244 CZ TYR B 50 18.163 5.432 -3.718 1.00 0.00 C ATOM 2245 OH TYR B 50 18.760 4.783 -2.662 1.00 0.00 O ATOM 0 H TYR B 50 16.502 10.150 -6.254 1.00 0.00 H new ATOM 0 HA TYR B 50 18.105 8.265 -7.871 1.00 0.00 H new ATOM 0 HB2 TYR B 50 15.326 7.825 -6.702 1.00 0.00 H new ATOM 0 HB3 TYR B 50 16.131 6.743 -7.821 1.00 0.00 H new ATOM 0 HD1 TYR B 50 18.656 6.095 -6.978 1.00 0.00 H new ATOM 0 HD2 TYR B 50 15.414 7.224 -4.454 1.00 0.00 H new ATOM 0 HE1 TYR B 50 19.720 4.934 -5.095 1.00 0.00 H new ATOM 0 HE2 TYR B 50 16.479 6.067 -2.567 1.00 0.00 H new ATOM 0 HH TYR B 50 19.733 4.790 -2.782 1.00 0.00 H new ATOM 2255 N ASN B 51 15.147 9.557 -8.621 1.00 0.00 N ATOM 2256 CA ASN B 51 14.355 10.141 -9.701 1.00 0.00 C ATOM 2257 C ASN B 51 12.870 9.860 -9.477 1.00 0.00 C ATOM 2258 O ASN B 51 12.453 8.703 -9.428 1.00 0.00 O ATOM 2259 CB ASN B 51 14.784 9.581 -11.059 1.00 0.00 C ATOM 2260 CG ASN B 51 13.778 9.888 -12.151 1.00 0.00 C ATOM 2261 OD1 ASN B 51 13.150 11.055 -12.065 1.00 0.00 O flip ATOM 2262 ND2 ASN B 51 13.569 9.086 -13.062 1.00 0.00 N flip ATOM 0 H ASN B 51 14.629 9.418 -7.753 1.00 0.00 H new ATOM 0 HA ASN B 51 14.525 11.218 -9.699 1.00 0.00 H new ATOM 0 HB2 ASN B 51 15.753 9.999 -11.332 1.00 0.00 H new ATOM 0 HB3 ASN B 51 14.913 8.502 -10.980 1.00 0.00 H new ATOM 0 HD21 ASN B 51 14.075 8.201 -13.088 1.00 0.00 H new ATOM 0 HD22 ASN B 51 12.890 9.307 -13.790 1.00 0.00 H new ATOM 2269 N PRO B 52 12.049 10.914 -9.334 1.00 0.00 N ATOM 2270 CA PRO B 52 10.607 10.765 -9.110 1.00 0.00 C ATOM 2271 C PRO B 52 9.909 10.001 -10.242 1.00 0.00 C ATOM 2272 O PRO B 52 10.508 9.766 -11.292 1.00 0.00 O ATOM 2273 CB PRO B 52 10.096 12.209 -9.039 1.00 0.00 C ATOM 2274 CG PRO B 52 11.162 13.031 -9.680 1.00 0.00 C ATOM 2275 CD PRO B 52 12.452 12.329 -9.375 1.00 0.00 C ATOM 0 HA PRO B 52 10.400 10.185 -8.211 1.00 0.00 H new ATOM 0 HB2 PRO B 52 9.146 12.317 -9.563 1.00 0.00 H new ATOM 0 HB3 PRO B 52 9.928 12.517 -8.007 1.00 0.00 H new ATOM 0 HG2 PRO B 52 11.003 13.109 -10.756 1.00 0.00 H new ATOM 0 HG3 PRO B 52 11.165 14.046 -9.284 1.00 0.00 H new ATOM 0 HD2 PRO B 52 13.204 12.514 -10.142 1.00 0.00 H new ATOM 0 HD3 PRO B 52 12.877 12.657 -8.426 1.00 0.00 H new ATOM 2283 N THR B 53 8.639 9.609 -10.034 1.00 0.00 N ATOM 2284 CA THR B 53 7.917 9.883 -8.793 1.00 0.00 C ATOM 2285 C THR B 53 7.734 8.604 -7.988 1.00 0.00 C ATOM 2286 O THR B 53 7.218 7.607 -8.493 1.00 0.00 O ATOM 2287 CB THR B 53 6.562 10.524 -9.091 1.00 0.00 C ATOM 2288 OG1 THR B 53 6.103 11.267 -7.978 1.00 0.00 O ATOM 2289 CG2 THR B 53 5.489 9.520 -9.444 1.00 0.00 C ATOM 0 H THR B 53 8.091 9.095 -10.724 1.00 0.00 H new ATOM 0 HA THR B 53 8.507 10.582 -8.201 1.00 0.00 H new ATOM 0 HB THR B 53 6.732 11.168 -9.954 1.00 0.00 H new ATOM 0 HG1 THR B 53 6.425 12.190 -8.045 1.00 0.00 H new ATOM 0 HG21 THR B 53 4.553 10.042 -9.644 1.00 0.00 H new ATOM 0 HG22 THR B 53 5.790 8.963 -10.331 1.00 0.00 H new ATOM 0 HG23 THR B 53 5.349 8.830 -8.612 1.00 0.00 H new ATOM 2297 N TRP B 54 8.176 8.637 -6.738 1.00 0.00 N ATOM 2298 CA TRP B 54 8.079 7.477 -5.864 1.00 0.00 C ATOM 2299 C TRP B 54 6.842 7.529 -4.978 1.00 0.00 C ATOM 2300 O TRP B 54 6.175 8.558 -4.861 1.00 0.00 O ATOM 2301 CB TRP B 54 9.318 7.383 -4.977 1.00 0.00 C ATOM 2302 CG TRP B 54 10.599 7.273 -5.741 1.00 0.00 C ATOM 2303 CD1 TRP B 54 11.206 8.252 -6.471 1.00 0.00 C ATOM 2304 CD2 TRP B 54 11.433 6.116 -5.842 1.00 0.00 C ATOM 2305 NE1 TRP B 54 12.370 7.773 -7.021 1.00 0.00 N ATOM 2306 CE2 TRP B 54 12.532 6.463 -6.648 1.00 0.00 C ATOM 2307 CE3 TRP B 54 11.353 4.820 -5.326 1.00 0.00 C ATOM 2308 CZ2 TRP B 54 13.548 5.556 -6.948 1.00 0.00 C ATOM 2309 CZ3 TRP B 54 12.359 3.922 -5.625 1.00 0.00 C ATOM 2310 CH2 TRP B 54 13.444 4.291 -6.427 1.00 0.00 C ATOM 0 H TRP B 54 8.606 9.455 -6.307 1.00 0.00 H new ATOM 0 HA TRP B 54 8.004 6.599 -6.506 1.00 0.00 H new ATOM 0 HB2 TRP B 54 9.362 8.263 -4.336 1.00 0.00 H new ATOM 0 HB3 TRP B 54 9.220 6.517 -4.323 1.00 0.00 H new ATOM 0 HD1 TRP B 54 10.827 9.256 -6.598 1.00 0.00 H new ATOM 0 HE1 TRP B 54 13.010 8.305 -7.611 1.00 0.00 H new ATOM 0 HE3 TRP B 54 10.520 4.526 -4.705 1.00 0.00 H new ATOM 0 HZ2 TRP B 54 14.386 5.839 -7.568 1.00 0.00 H new ATOM 0 HZ3 TRP B 54 12.307 2.917 -5.233 1.00 0.00 H new ATOM 0 HH2 TRP B 54 14.215 3.566 -6.640 1.00 0.00 H new ATOM 2321 N HIS B 55 6.571 6.401 -4.337 1.00 0.00 N ATOM 2322 CA HIS B 55 5.449 6.266 -3.420 1.00 0.00 C ATOM 2323 C HIS B 55 5.950 5.634 -2.131 1.00 0.00 C ATOM 2324 O HIS B 55 6.094 4.415 -2.041 1.00 0.00 O ATOM 2325 CB HIS B 55 4.344 5.407 -4.040 1.00 0.00 C ATOM 2326 CG HIS B 55 3.830 5.936 -5.343 1.00 0.00 C ATOM 2327 ND1 HIS B 55 2.485 6.062 -5.625 1.00 0.00 N ATOM 2328 CD2 HIS B 55 4.485 6.370 -6.446 1.00 0.00 C ATOM 2329 CE1 HIS B 55 2.336 6.547 -6.845 1.00 0.00 C ATOM 2330 NE2 HIS B 55 3.535 6.744 -7.364 1.00 0.00 N ATOM 0 H HIS B 55 7.125 5.551 -4.439 1.00 0.00 H new ATOM 0 HA HIS B 55 5.028 7.249 -3.212 1.00 0.00 H new ATOM 0 HB2 HIS B 55 4.724 4.397 -4.193 1.00 0.00 H new ATOM 0 HB3 HIS B 55 3.515 5.333 -3.336 1.00 0.00 H new ATOM 0 HD1 HIS B 55 1.724 5.819 -4.990 1.00 0.00 H new ATOM 0 HD2 HIS B 55 5.556 6.414 -6.579 1.00 0.00 H new ATOM 0 HE1 HIS B 55 1.395 6.748 -7.335 1.00 0.00 H new ATOM 2339 N CYS B 56 6.253 6.471 -1.148 1.00 0.00 N ATOM 2340 CA CYS B 56 6.783 5.990 0.120 1.00 0.00 C ATOM 2341 C CYS B 56 5.739 6.018 1.224 1.00 0.00 C ATOM 2342 O CYS B 56 5.179 7.065 1.545 1.00 0.00 O ATOM 2343 CB CYS B 56 7.996 6.824 0.534 1.00 0.00 C ATOM 2344 SG CYS B 56 9.368 6.766 -0.642 1.00 0.00 S ATOM 0 H CYS B 56 6.141 7.483 -1.204 1.00 0.00 H new ATOM 0 HA CYS B 56 7.082 4.952 -0.027 1.00 0.00 H new ATOM 0 HB2 CYS B 56 7.684 7.861 0.661 1.00 0.00 H new ATOM 0 HB3 CYS B 56 8.349 6.476 1.505 1.00 0.00 H new ATOM 0 HG CYS B 56 8.924 7.010 -1.839 1.00 0.00 H new ATOM 2350 N ILE B 57 5.501 4.855 1.812 1.00 0.00 N ATOM 2351 CA ILE B 57 4.544 4.730 2.899 1.00 0.00 C ATOM 2352 C ILE B 57 5.185 4.039 4.092 1.00 0.00 C ATOM 2353 O ILE B 57 5.470 2.843 4.052 1.00 0.00 O ATOM 2354 CB ILE B 57 3.292 3.956 2.468 1.00 0.00 C ATOM 2355 CG1 ILE B 57 2.655 4.658 1.262 1.00 0.00 C ATOM 2356 CG2 ILE B 57 2.319 3.847 3.637 1.00 0.00 C ATOM 2357 CD1 ILE B 57 1.235 4.232 0.975 1.00 0.00 C ATOM 0 H ILE B 57 5.960 3.982 1.553 1.00 0.00 H new ATOM 0 HA ILE B 57 4.240 5.738 3.181 1.00 0.00 H new ATOM 0 HB ILE B 57 3.562 2.943 2.171 1.00 0.00 H new ATOM 0 HG12 ILE B 57 2.672 5.735 1.432 1.00 0.00 H new ATOM 0 HG13 ILE B 57 3.265 4.465 0.380 1.00 0.00 H new ATOM 0 HG21 ILE B 57 1.433 3.296 3.322 1.00 0.00 H new ATOM 0 HG22 ILE B 57 2.799 3.321 4.462 1.00 0.00 H new ATOM 0 HG23 ILE B 57 2.029 4.846 3.963 1.00 0.00 H new ATOM 0 HD11 ILE B 57 0.860 4.776 0.108 1.00 0.00 H new ATOM 0 HD12 ILE B 57 1.211 3.162 0.771 1.00 0.00 H new ATOM 0 HD13 ILE B 57 0.608 4.451 1.839 1.00 0.00 H new ATOM 2369 N VAL B 58 5.421 4.805 5.149 1.00 0.00 N ATOM 2370 CA VAL B 58 6.046 4.274 6.351 1.00 0.00 C ATOM 2371 C VAL B 58 5.061 4.228 7.514 1.00 0.00 C ATOM 2372 O VAL B 58 4.547 5.258 7.951 1.00 0.00 O ATOM 2373 CB VAL B 58 7.279 5.109 6.751 1.00 0.00 C ATOM 2374 CG1 VAL B 58 6.970 6.591 6.645 1.00 0.00 C ATOM 2375 CG2 VAL B 58 7.750 4.750 8.155 1.00 0.00 C ATOM 0 H VAL B 58 5.188 5.797 5.197 1.00 0.00 H new ATOM 0 HA VAL B 58 6.366 3.257 6.123 1.00 0.00 H new ATOM 0 HB VAL B 58 8.089 4.876 6.060 1.00 0.00 H new ATOM 0 HG11 VAL B 58 7.850 7.167 6.931 1.00 0.00 H new ATOM 0 HG12 VAL B 58 6.695 6.833 5.618 1.00 0.00 H new ATOM 0 HG13 VAL B 58 6.143 6.839 7.310 1.00 0.00 H new ATOM 0 HG21 VAL B 58 8.621 5.353 8.412 1.00 0.00 H new ATOM 0 HG22 VAL B 58 6.949 4.946 8.868 1.00 0.00 H new ATOM 0 HG23 VAL B 58 8.017 3.694 8.190 1.00 0.00 H new ATOM 2385 N GLY B 59 4.812 3.024 8.011 1.00 0.00 N ATOM 2386 CA GLY B 59 3.899 2.851 9.122 1.00 0.00 C ATOM 2387 C GLY B 59 4.414 1.841 10.123 1.00 0.00 C ATOM 2388 O GLY B 59 5.535 1.963 10.615 1.00 0.00 O ATOM 0 H GLY B 59 5.228 2.161 7.662 1.00 0.00 H new ATOM 0 HA2 GLY B 59 3.746 3.809 9.619 1.00 0.00 H new ATOM 0 HA3 GLY B 59 2.928 2.528 8.747 1.00 0.00 H new ATOM 2392 N ARG B 60 3.596 0.843 10.430 1.00 0.00 N ATOM 2393 CA ARG B 60 3.980 -0.184 11.379 1.00 0.00 C ATOM 2394 C ARG B 60 2.986 -1.341 11.370 1.00 0.00 C ATOM 2395 O ARG B 60 3.038 -2.221 12.230 1.00 0.00 O ATOM 2396 CB ARG B 60 4.068 0.421 12.772 1.00 0.00 C ATOM 2397 CG ARG B 60 3.146 1.611 12.979 1.00 0.00 C ATOM 2398 CD ARG B 60 3.889 2.792 13.582 1.00 0.00 C ATOM 2399 NE ARG B 60 4.268 2.547 14.971 1.00 0.00 N ATOM 2400 CZ ARG B 60 5.524 2.549 15.404 1.00 0.00 C ATOM 2401 NH1 ARG B 60 6.520 2.782 14.559 1.00 0.00 N ATOM 2402 NH2 ARG B 60 5.787 2.316 16.682 1.00 0.00 N ATOM 0 H ARG B 60 2.663 0.726 10.034 1.00 0.00 H new ATOM 0 HA ARG B 60 4.954 -0.578 11.089 1.00 0.00 H new ATOM 0 HB2 ARG B 60 3.828 -0.346 13.508 1.00 0.00 H new ATOM 0 HB3 ARG B 60 5.096 0.732 12.960 1.00 0.00 H new ATOM 0 HG2 ARG B 60 2.708 1.904 12.025 1.00 0.00 H new ATOM 0 HG3 ARG B 60 2.322 1.325 13.633 1.00 0.00 H new ATOM 0 HD2 ARG B 60 4.783 2.997 12.993 1.00 0.00 H new ATOM 0 HD3 ARG B 60 3.261 3.681 13.529 1.00 0.00 H new ATOM 0 HE ARG B 60 3.526 2.364 15.647 1.00 0.00 H new ATOM 0 HH11 ARG B 60 6.322 2.960 13.574 1.00 0.00 H new ATOM 0 HH12 ARG B 60 7.483 2.783 14.894 1.00 0.00 H new ATOM 0 HH21 ARG B 60 5.024 2.135 17.335 1.00 0.00 H new ATOM 0 HH22 ARG B 60 6.752 2.318 17.013 1.00 0.00 H new ATOM 2416 N ASN B 61 2.086 -1.334 10.393 1.00 0.00 N ATOM 2417 CA ASN B 61 1.081 -2.384 10.273 1.00 0.00 C ATOM 2418 C ASN B 61 -0.053 -1.952 9.349 1.00 0.00 C ATOM 2419 O ASN B 61 -1.205 -2.335 9.546 1.00 0.00 O ATOM 2420 CB ASN B 61 0.521 -2.743 11.651 1.00 0.00 C ATOM 2421 CG ASN B 61 0.227 -4.222 11.787 1.00 0.00 C ATOM 2422 OD1 ASN B 61 0.529 -4.836 12.812 1.00 0.00 O ATOM 2423 ND2 ASN B 61 -0.363 -4.806 10.751 1.00 0.00 N ATOM 0 H ASN B 61 2.032 -0.614 9.673 1.00 0.00 H new ATOM 0 HA ASN B 61 1.561 -3.262 9.842 1.00 0.00 H new ATOM 0 HB2 ASN B 61 1.235 -2.445 12.419 1.00 0.00 H new ATOM 0 HB3 ASN B 61 -0.393 -2.176 11.828 1.00 0.00 H new ATOM 0 HD21 ASN B 61 -0.584 -5.801 10.784 1.00 0.00 H new ATOM 0 HD22 ASN B 61 -0.596 -4.259 9.922 1.00 0.00 H new ATOM 2430 N PHE B 62 0.281 -1.151 8.343 1.00 0.00 N ATOM 2431 CA PHE B 62 -0.712 -0.667 7.393 1.00 0.00 C ATOM 2432 C PHE B 62 -0.976 -1.701 6.304 1.00 0.00 C ATOM 2433 O PHE B 62 -0.293 -2.721 6.219 1.00 0.00 O ATOM 2434 CB PHE B 62 -0.243 0.643 6.760 1.00 0.00 C ATOM 2435 CG PHE B 62 1.028 0.504 5.970 1.00 0.00 C ATOM 2436 CD1 PHE B 62 2.256 0.452 6.611 1.00 0.00 C ATOM 2437 CD2 PHE B 62 0.994 0.424 4.587 1.00 0.00 C ATOM 2438 CE1 PHE B 62 3.426 0.324 5.887 1.00 0.00 C ATOM 2439 CE2 PHE B 62 2.161 0.296 3.858 1.00 0.00 C ATOM 2440 CZ PHE B 62 3.378 0.246 4.508 1.00 0.00 C ATOM 0 H PHE B 62 1.231 -0.824 8.165 1.00 0.00 H new ATOM 0 HA PHE B 62 -1.641 -0.492 7.936 1.00 0.00 H new ATOM 0 HB2 PHE B 62 -1.028 1.023 6.107 1.00 0.00 H new ATOM 0 HB3 PHE B 62 -0.095 1.384 7.545 1.00 0.00 H new ATOM 0 HD1 PHE B 62 2.299 0.512 7.688 1.00 0.00 H new ATOM 0 HD2 PHE B 62 0.045 0.462 4.073 1.00 0.00 H new ATOM 0 HE1 PHE B 62 4.377 0.285 6.398 1.00 0.00 H new ATOM 0 HE2 PHE B 62 2.121 0.235 2.780 1.00 0.00 H new ATOM 0 HZ PHE B 62 4.291 0.146 3.940 1.00 0.00 H new ATOM 2450 N GLY B 63 -1.968 -1.421 5.467 1.00 0.00 N ATOM 2451 CA GLY B 63 -2.310 -2.325 4.385 1.00 0.00 C ATOM 2452 C GLY B 63 -2.197 -1.654 3.031 1.00 0.00 C ATOM 2453 O GLY B 63 -3.204 -1.277 2.432 1.00 0.00 O ATOM 0 H GLY B 63 -2.544 -0.581 5.519 1.00 0.00 H new ATOM 0 HA2 GLY B 63 -1.652 -3.193 4.416 1.00 0.00 H new ATOM 0 HA3 GLY B 63 -3.327 -2.691 4.525 1.00 0.00 H new ATOM 2457 N SER B 64 -0.968 -1.497 2.554 1.00 0.00 N ATOM 2458 CA SER B 64 -0.723 -0.856 1.268 1.00 0.00 C ATOM 2459 C SER B 64 -1.134 -1.757 0.110 1.00 0.00 C ATOM 2460 O SER B 64 -0.637 -2.876 -0.029 1.00 0.00 O ATOM 2461 CB SER B 64 0.753 -0.477 1.135 1.00 0.00 C ATOM 2462 OG SER B 64 1.554 -1.620 0.890 1.00 0.00 O ATOM 0 H SER B 64 -0.125 -1.805 3.039 1.00 0.00 H new ATOM 0 HA SER B 64 -1.331 0.048 1.227 1.00 0.00 H new ATOM 0 HB2 SER B 64 0.876 0.238 0.322 1.00 0.00 H new ATOM 0 HB3 SER B 64 1.088 0.017 2.047 1.00 0.00 H new ATOM 0 HG SER B 64 0.977 -2.389 0.699 1.00 0.00 H new ATOM 2468 N TYR B 65 -2.038 -1.256 -0.725 1.00 0.00 N ATOM 2469 CA TYR B 65 -2.517 -2.001 -1.881 1.00 0.00 C ATOM 2470 C TYR B 65 -2.529 -1.108 -3.119 1.00 0.00 C ATOM 2471 O TYR B 65 -3.581 -0.619 -3.535 1.00 0.00 O ATOM 2472 CB TYR B 65 -3.918 -2.554 -1.619 1.00 0.00 C ATOM 2473 CG TYR B 65 -4.302 -3.694 -2.535 1.00 0.00 C ATOM 2474 CD1 TYR B 65 -3.921 -4.999 -2.249 1.00 0.00 C ATOM 2475 CD2 TYR B 65 -5.046 -3.466 -3.685 1.00 0.00 C ATOM 2476 CE1 TYR B 65 -4.270 -6.044 -3.083 1.00 0.00 C ATOM 2477 CE2 TYR B 65 -5.401 -4.505 -4.525 1.00 0.00 C ATOM 2478 CZ TYR B 65 -5.011 -5.793 -4.219 1.00 0.00 C ATOM 2479 OH TYR B 65 -5.362 -6.831 -5.051 1.00 0.00 O ATOM 0 H TYR B 65 -2.455 -0.331 -0.621 1.00 0.00 H new ATOM 0 HA TYR B 65 -1.840 -2.837 -2.056 1.00 0.00 H new ATOM 0 HB2 TYR B 65 -3.977 -2.894 -0.585 1.00 0.00 H new ATOM 0 HB3 TYR B 65 -4.644 -1.749 -1.732 1.00 0.00 H new ATOM 0 HD1 TYR B 65 -3.342 -5.200 -1.360 1.00 0.00 H new ATOM 0 HD2 TYR B 65 -5.353 -2.459 -3.928 1.00 0.00 H new ATOM 0 HE1 TYR B 65 -3.964 -7.052 -2.847 1.00 0.00 H new ATOM 0 HE2 TYR B 65 -5.980 -4.310 -5.415 1.00 0.00 H new ATOM 0 HH TYR B 65 -5.883 -6.484 -5.805 1.00 0.00 H new ATOM 2489 N VAL B 66 -1.352 -0.892 -3.693 1.00 0.00 N ATOM 2490 CA VAL B 66 -1.220 -0.049 -4.875 1.00 0.00 C ATOM 2491 C VAL B 66 -0.753 -0.852 -6.085 1.00 0.00 C ATOM 2492 O VAL B 66 -0.249 -1.966 -5.948 1.00 0.00 O ATOM 2493 CB VAL B 66 -0.227 1.102 -4.629 1.00 0.00 C ATOM 2494 CG1 VAL B 66 -0.558 1.834 -3.337 1.00 0.00 C ATOM 2495 CG2 VAL B 66 1.199 0.572 -4.596 1.00 0.00 C ATOM 0 H VAL B 66 -0.474 -1.289 -3.359 1.00 0.00 H new ATOM 0 HA VAL B 66 -2.209 0.362 -5.079 1.00 0.00 H new ATOM 0 HB VAL B 66 -0.313 1.812 -5.451 1.00 0.00 H new ATOM 0 HG11 VAL B 66 0.156 2.643 -3.184 1.00 0.00 H new ATOM 0 HG12 VAL B 66 -1.565 2.246 -3.400 1.00 0.00 H new ATOM 0 HG13 VAL B 66 -0.503 1.138 -2.500 1.00 0.00 H new ATOM 0 HG21 VAL B 66 1.890 1.397 -4.421 1.00 0.00 H new ATOM 0 HG22 VAL B 66 1.297 -0.159 -3.794 1.00 0.00 H new ATOM 0 HG23 VAL B 66 1.433 0.098 -5.549 1.00 0.00 H new ATOM 2505 N THR B 67 -0.917 -0.270 -7.269 1.00 0.00 N ATOM 2506 CA THR B 67 -0.506 -0.921 -8.508 1.00 0.00 C ATOM 2507 C THR B 67 0.887 -0.453 -8.920 1.00 0.00 C ATOM 2508 O THR B 67 1.041 0.323 -9.863 1.00 0.00 O ATOM 2509 CB THR B 67 -1.513 -0.622 -9.621 1.00 0.00 C ATOM 2510 OG1 THR B 67 -2.736 -1.295 -9.380 1.00 0.00 O ATOM 2511 CG2 THR B 67 -1.029 -1.031 -10.995 1.00 0.00 C ATOM 0 H THR B 67 -1.332 0.653 -7.396 1.00 0.00 H new ATOM 0 HA THR B 67 -0.475 -1.998 -8.340 1.00 0.00 H new ATOM 0 HB THR B 67 -1.645 0.460 -9.609 1.00 0.00 H new ATOM 0 HG1 THR B 67 -3.008 -1.778 -10.188 1.00 0.00 H new ATOM 0 HG21 THR B 67 -1.791 -0.790 -11.736 1.00 0.00 H new ATOM 0 HG22 THR B 67 -0.111 -0.494 -11.232 1.00 0.00 H new ATOM 0 HG23 THR B 67 -0.836 -2.104 -11.008 1.00 0.00 H new ATOM 2519 N HIS B 68 1.898 -0.926 -8.198 1.00 0.00 N ATOM 2520 CA HIS B 68 3.281 -0.556 -8.472 1.00 0.00 C ATOM 2521 C HIS B 68 3.598 -0.651 -9.961 1.00 0.00 C ATOM 2522 O HIS B 68 2.744 -1.007 -10.772 1.00 0.00 O ATOM 2523 CB HIS B 68 4.235 -1.452 -7.683 1.00 0.00 C ATOM 2524 CG HIS B 68 4.166 -2.893 -8.083 1.00 0.00 C ATOM 2525 ND1 HIS B 68 5.147 -3.808 -8.266 1.00 0.00 N flip ATOM 2526 CD2 HIS B 68 2.982 -3.546 -8.348 1.00 0.00 C flip ATOM 2527 CE1 HIS B 68 4.541 -4.984 -8.635 1.00 0.00 C flip ATOM 2528 NE2 HIS B 68 3.236 -4.800 -8.676 1.00 0.00 N flip ATOM 0 H HIS B 68 1.784 -1.570 -7.415 1.00 0.00 H new ATOM 0 HA HIS B 68 3.415 0.480 -8.160 1.00 0.00 H new ATOM 0 HB2 HIS B 68 5.255 -1.093 -7.820 1.00 0.00 H new ATOM 0 HB3 HIS B 68 4.007 -1.366 -6.621 1.00 0.00 H new ATOM 0 HD1 HIS B 68 6.149 -3.653 -8.151 1.00 0.00 H new ATOM 0 HD2 HIS B 68 1.999 -3.102 -8.296 1.00 0.00 H new ATOM 0 HE1 HIS B 68 5.051 -5.910 -8.856 1.00 0.00 H new ATOM 2537 N GLU B 69 4.840 -0.327 -10.307 1.00 0.00 N ATOM 2538 CA GLU B 69 5.291 -0.371 -11.693 1.00 0.00 C ATOM 2539 C GLU B 69 6.757 0.038 -11.790 1.00 0.00 C ATOM 2540 O GLU B 69 7.403 0.302 -10.777 1.00 0.00 O ATOM 2541 CB GLU B 69 4.432 0.548 -12.562 1.00 0.00 C ATOM 2542 CG GLU B 69 3.698 1.618 -11.772 1.00 0.00 C ATOM 2543 CD GLU B 69 2.284 1.846 -12.271 1.00 0.00 C ATOM 2544 OE1 GLU B 69 2.061 1.738 -13.495 1.00 0.00 O ATOM 2545 OE2 GLU B 69 1.400 2.132 -11.437 1.00 0.00 O ATOM 0 H GLU B 69 5.555 -0.030 -9.643 1.00 0.00 H new ATOM 0 HA GLU B 69 5.188 -1.394 -12.055 1.00 0.00 H new ATOM 0 HB2 GLU B 69 5.067 1.029 -13.306 1.00 0.00 H new ATOM 0 HB3 GLU B 69 3.704 -0.055 -13.105 1.00 0.00 H new ATOM 0 HG2 GLU B 69 3.666 1.331 -10.721 1.00 0.00 H new ATOM 0 HG3 GLU B 69 4.255 2.553 -11.830 1.00 0.00 H new ATOM 2552 N THR B 70 7.276 0.088 -13.010 1.00 0.00 N ATOM 2553 CA THR B 70 8.668 0.465 -13.228 1.00 0.00 C ATOM 2554 C THR B 70 9.607 -0.442 -12.434 1.00 0.00 C ATOM 2555 O THR B 70 9.609 -1.659 -12.619 1.00 0.00 O ATOM 2556 CB THR B 70 8.888 1.927 -12.834 1.00 0.00 C ATOM 2557 OG1 THR B 70 7.653 2.615 -12.754 1.00 0.00 O ATOM 2558 CG2 THR B 70 9.773 2.681 -13.802 1.00 0.00 C ATOM 0 H THR B 70 6.757 -0.127 -13.861 1.00 0.00 H new ATOM 0 HA THR B 70 8.892 0.347 -14.288 1.00 0.00 H new ATOM 0 HB THR B 70 9.385 1.894 -11.864 1.00 0.00 H new ATOM 0 HG1 THR B 70 7.454 2.821 -11.817 1.00 0.00 H new ATOM 0 HG21 THR B 70 9.888 3.711 -13.464 1.00 0.00 H new ATOM 0 HG22 THR B 70 10.752 2.203 -13.848 1.00 0.00 H new ATOM 0 HG23 THR B 70 9.318 2.673 -14.793 1.00 0.00 H new ATOM 2566 N LYS B 71 10.402 0.155 -11.549 1.00 0.00 N ATOM 2567 CA LYS B 71 11.338 -0.608 -10.730 1.00 0.00 C ATOM 2568 C LYS B 71 10.592 -1.432 -9.686 1.00 0.00 C ATOM 2569 O LYS B 71 11.177 -1.888 -8.703 1.00 0.00 O ATOM 2570 CB LYS B 71 12.355 0.332 -10.060 1.00 0.00 C ATOM 2571 CG LYS B 71 12.022 0.696 -8.620 1.00 0.00 C ATOM 2572 CD LYS B 71 11.179 1.957 -8.544 1.00 0.00 C ATOM 2573 CE LYS B 71 9.885 1.718 -7.783 1.00 0.00 C ATOM 2574 NZ LYS B 71 8.916 0.910 -8.574 1.00 0.00 N ATOM 0 H LYS B 71 10.416 1.161 -11.382 1.00 0.00 H new ATOM 0 HA LYS B 71 11.882 -1.296 -11.377 1.00 0.00 H new ATOM 0 HB2 LYS B 71 13.338 -0.139 -10.085 1.00 0.00 H new ATOM 0 HB3 LYS B 71 12.426 1.248 -10.646 1.00 0.00 H new ATOM 0 HG2 LYS B 71 11.487 -0.129 -8.150 1.00 0.00 H new ATOM 0 HG3 LYS B 71 12.945 0.840 -8.058 1.00 0.00 H new ATOM 0 HD2 LYS B 71 11.749 2.748 -8.056 1.00 0.00 H new ATOM 0 HD3 LYS B 71 10.951 2.304 -9.552 1.00 0.00 H new ATOM 0 HE2 LYS B 71 10.104 1.206 -6.846 1.00 0.00 H new ATOM 0 HE3 LYS B 71 9.433 2.676 -7.525 1.00 0.00 H new ATOM 0 HZ1 LYS B 71 8.090 0.683 -7.984 1.00 0.00 H new ATOM 0 HZ2 LYS B 71 8.609 1.453 -9.406 1.00 0.00 H new ATOM 0 HZ3 LYS B 71 9.372 0.028 -8.885 1.00 0.00 H new ATOM 2588 N HIS B 72 9.295 -1.616 -9.905 1.00 0.00 N ATOM 2589 CA HIS B 72 8.467 -2.381 -8.983 1.00 0.00 C ATOM 2590 C HIS B 72 8.303 -1.641 -7.660 1.00 0.00 C ATOM 2591 O HIS B 72 7.377 -0.848 -7.494 1.00 0.00 O ATOM 2592 CB HIS B 72 9.080 -3.760 -8.737 1.00 0.00 C ATOM 2593 CG HIS B 72 8.760 -4.758 -9.806 1.00 0.00 C ATOM 2594 ND1 HIS B 72 9.487 -5.787 -10.302 1.00 0.00 N flip ATOM 2595 CD2 HIS B 72 7.568 -4.763 -10.498 1.00 0.00 C flip ATOM 2596 CE1 HIS B 72 8.727 -6.387 -11.276 1.00 0.00 C flip ATOM 2597 NE2 HIS B 72 7.574 -5.752 -11.374 1.00 0.00 N flip ATOM 0 H HIS B 72 8.795 -1.246 -10.713 1.00 0.00 H new ATOM 0 HA HIS B 72 7.483 -2.505 -9.435 1.00 0.00 H new ATOM 0 HB2 HIS B 72 10.162 -3.658 -8.659 1.00 0.00 H new ATOM 0 HB3 HIS B 72 8.726 -4.140 -7.779 1.00 0.00 H new ATOM 0 HD1 HIS B 72 10.423 -6.064 -10.008 1.00 0.00 H new ATOM 0 HD2 HIS B 72 6.756 -4.067 -10.348 1.00 0.00 H new ATOM 0 HE1 HIS B 72 9.025 -7.241 -11.867 1.00 0.00 H new ATOM 2606 N PHE B 73 9.214 -1.908 -6.724 1.00 0.00 N ATOM 2607 CA PHE B 73 9.183 -1.274 -5.407 1.00 0.00 C ATOM 2608 C PHE B 73 9.948 -2.114 -4.390 1.00 0.00 C ATOM 2609 O PHE B 73 10.702 -3.014 -4.756 1.00 0.00 O ATOM 2610 CB PHE B 73 7.742 -1.093 -4.932 1.00 0.00 C ATOM 2611 CG PHE B 73 7.027 -2.391 -4.684 1.00 0.00 C ATOM 2612 CD1 PHE B 73 6.906 -3.334 -5.693 1.00 0.00 C ATOM 2613 CD2 PHE B 73 6.478 -2.668 -3.444 1.00 0.00 C ATOM 2614 CE1 PHE B 73 6.251 -4.530 -5.467 1.00 0.00 C ATOM 2615 CE2 PHE B 73 5.821 -3.861 -3.212 1.00 0.00 C ATOM 2616 CZ PHE B 73 5.707 -4.793 -4.225 1.00 0.00 C ATOM 0 H PHE B 73 9.986 -2.562 -6.855 1.00 0.00 H new ATOM 0 HA PHE B 73 9.657 -0.296 -5.494 1.00 0.00 H new ATOM 0 HB2 PHE B 73 7.741 -0.505 -4.014 1.00 0.00 H new ATOM 0 HB3 PHE B 73 7.191 -0.520 -5.678 1.00 0.00 H new ATOM 0 HD1 PHE B 73 7.328 -3.132 -6.666 1.00 0.00 H new ATOM 0 HD2 PHE B 73 6.564 -1.943 -2.648 1.00 0.00 H new ATOM 0 HE1 PHE B 73 6.165 -5.258 -6.260 1.00 0.00 H new ATOM 0 HE2 PHE B 73 5.397 -4.065 -2.240 1.00 0.00 H new ATOM 0 HZ PHE B 73 5.193 -5.726 -4.046 1.00 0.00 H new ATOM 2626 N ILE B 74 9.735 -1.823 -3.110 1.00 0.00 N ATOM 2627 CA ILE B 74 10.391 -2.562 -2.040 1.00 0.00 C ATOM 2628 C ILE B 74 9.688 -2.343 -0.705 1.00 0.00 C ATOM 2629 O ILE B 74 9.653 -1.228 -0.183 1.00 0.00 O ATOM 2630 CB ILE B 74 11.875 -2.175 -1.887 1.00 0.00 C ATOM 2631 CG1 ILE B 74 12.550 -3.143 -0.892 1.00 0.00 C ATOM 2632 CG2 ILE B 74 11.992 -0.718 -1.453 1.00 0.00 C ATOM 2633 CD1 ILE B 74 13.651 -2.548 -0.034 1.00 0.00 C ATOM 0 H ILE B 74 9.113 -1.081 -2.790 1.00 0.00 H new ATOM 0 HA ILE B 74 10.331 -3.614 -2.320 1.00 0.00 H new ATOM 0 HB ILE B 74 12.392 -2.264 -2.843 1.00 0.00 H new ATOM 0 HG12 ILE B 74 11.783 -3.550 -0.234 1.00 0.00 H new ATOM 0 HG13 ILE B 74 12.965 -3.980 -1.454 1.00 0.00 H new ATOM 0 HG21 ILE B 74 13.044 -0.453 -1.347 1.00 0.00 H new ATOM 0 HG22 ILE B 74 11.530 -0.077 -2.203 1.00 0.00 H new ATOM 0 HG23 ILE B 74 11.486 -0.581 -0.497 1.00 0.00 H new ATOM 0 HD11 ILE B 74 14.053 -3.316 0.626 1.00 0.00 H new ATOM 0 HD12 ILE B 74 14.446 -2.168 -0.675 1.00 0.00 H new ATOM 0 HD13 ILE B 74 13.245 -1.732 0.564 1.00 0.00 H new ATOM 2645 N TYR B 75 9.136 -3.419 -0.156 1.00 0.00 N ATOM 2646 CA TYR B 75 8.440 -3.358 1.122 1.00 0.00 C ATOM 2647 C TYR B 75 9.279 -4.015 2.213 1.00 0.00 C ATOM 2648 O TYR B 75 9.831 -5.097 2.014 1.00 0.00 O ATOM 2649 CB TYR B 75 7.078 -4.049 1.020 1.00 0.00 C ATOM 2650 CG TYR B 75 6.088 -3.598 2.069 1.00 0.00 C ATOM 2651 CD1 TYR B 75 6.405 -3.654 3.420 1.00 0.00 C ATOM 2652 CD2 TYR B 75 4.837 -3.114 1.708 1.00 0.00 C ATOM 2653 CE1 TYR B 75 5.502 -3.243 4.383 1.00 0.00 C ATOM 2654 CE2 TYR B 75 3.928 -2.701 2.664 1.00 0.00 C ATOM 2655 CZ TYR B 75 4.265 -2.767 4.000 1.00 0.00 C ATOM 2656 OH TYR B 75 3.364 -2.357 4.956 1.00 0.00 O ATOM 0 H TYR B 75 9.158 -4.347 -0.579 1.00 0.00 H new ATOM 0 HA TYR B 75 8.283 -2.311 1.381 1.00 0.00 H new ATOM 0 HB2 TYR B 75 6.658 -3.861 0.032 1.00 0.00 H new ATOM 0 HB3 TYR B 75 7.220 -5.126 1.106 1.00 0.00 H new ATOM 0 HD1 TYR B 75 7.373 -4.025 3.723 1.00 0.00 H new ATOM 0 HD2 TYR B 75 4.570 -3.059 0.663 1.00 0.00 H new ATOM 0 HE1 TYR B 75 5.764 -3.294 5.430 1.00 0.00 H new ATOM 0 HE2 TYR B 75 2.959 -2.329 2.366 1.00 0.00 H new ATOM 0 HH TYR B 75 3.591 -1.451 5.252 1.00 0.00 H new ATOM 2666 N PHE B 76 9.375 -3.354 3.360 1.00 0.00 N ATOM 2667 CA PHE B 76 10.154 -3.876 4.476 1.00 0.00 C ATOM 2668 C PHE B 76 9.607 -3.375 5.809 1.00 0.00 C ATOM 2669 O PHE B 76 8.813 -2.435 5.854 1.00 0.00 O ATOM 2670 CB PHE B 76 11.623 -3.474 4.330 1.00 0.00 C ATOM 2671 CG PHE B 76 11.815 -2.073 3.824 1.00 0.00 C ATOM 2672 CD1 PHE B 76 11.687 -1.785 2.475 1.00 0.00 C ATOM 2673 CD2 PHE B 76 12.127 -1.044 4.698 1.00 0.00 C ATOM 2674 CE1 PHE B 76 11.865 -0.496 2.007 1.00 0.00 C ATOM 2675 CE2 PHE B 76 12.306 0.246 4.236 1.00 0.00 C ATOM 2676 CZ PHE B 76 12.174 0.520 2.889 1.00 0.00 C ATOM 0 H PHE B 76 8.924 -2.457 3.542 1.00 0.00 H new ATOM 0 HA PHE B 76 10.077 -4.963 4.461 1.00 0.00 H new ATOM 0 HB2 PHE B 76 12.116 -3.573 5.297 1.00 0.00 H new ATOM 0 HB3 PHE B 76 12.115 -4.168 3.649 1.00 0.00 H new ATOM 0 HD1 PHE B 76 11.445 -2.576 1.781 1.00 0.00 H new ATOM 0 HD2 PHE B 76 12.231 -1.253 5.752 1.00 0.00 H new ATOM 0 HE1 PHE B 76 11.762 -0.284 0.953 1.00 0.00 H new ATOM 0 HE2 PHE B 76 12.549 1.039 4.928 1.00 0.00 H new ATOM 0 HZ PHE B 76 12.312 1.528 2.526 1.00 0.00 H new ATOM 2686 N TYR B 77 10.037 -4.014 6.893 1.00 0.00 N ATOM 2687 CA TYR B 77 9.593 -3.641 8.230 1.00 0.00 C ATOM 2688 C TYR B 77 10.783 -3.376 9.148 1.00 0.00 C ATOM 2689 O TYR B 77 11.493 -4.302 9.543 1.00 0.00 O ATOM 2690 CB TYR B 77 8.717 -4.748 8.820 1.00 0.00 C ATOM 2691 CG TYR B 77 8.399 -4.553 10.285 1.00 0.00 C ATOM 2692 CD1 TYR B 77 9.282 -4.980 11.270 1.00 0.00 C ATOM 2693 CD2 TYR B 77 7.218 -3.940 10.683 1.00 0.00 C ATOM 2694 CE1 TYR B 77 8.995 -4.804 12.609 1.00 0.00 C ATOM 2695 CE2 TYR B 77 6.924 -3.759 12.021 1.00 0.00 C ATOM 2696 CZ TYR B 77 7.816 -4.192 12.980 1.00 0.00 C ATOM 2697 OH TYR B 77 7.527 -4.015 14.313 1.00 0.00 O ATOM 0 H TYR B 77 10.694 -4.794 6.870 1.00 0.00 H new ATOM 0 HA TYR B 77 9.010 -2.723 8.151 1.00 0.00 H new ATOM 0 HB2 TYR B 77 7.784 -4.800 8.258 1.00 0.00 H new ATOM 0 HB3 TYR B 77 9.221 -5.706 8.691 1.00 0.00 H new ATOM 0 HD1 TYR B 77 10.207 -5.457 10.983 1.00 0.00 H new ATOM 0 HD2 TYR B 77 6.518 -3.599 9.935 1.00 0.00 H new ATOM 0 HE1 TYR B 77 9.690 -5.144 13.362 1.00 0.00 H new ATOM 0 HE2 TYR B 77 6.001 -3.281 12.314 1.00 0.00 H new ATOM 0 HH TYR B 77 6.660 -3.568 14.403 1.00 0.00 H new ATOM 2707 N LEU B 78 10.993 -2.108 9.488 1.00 0.00 N ATOM 2708 CA LEU B 78 12.095 -1.724 10.363 1.00 0.00 C ATOM 2709 C LEU B 78 11.847 -2.207 11.789 1.00 0.00 C ATOM 2710 O LEU B 78 10.756 -2.677 12.111 1.00 0.00 O ATOM 2711 CB LEU B 78 12.282 -0.202 10.352 1.00 0.00 C ATOM 2712 CG LEU B 78 12.803 0.404 9.039 1.00 0.00 C ATOM 2713 CD1 LEU B 78 14.319 0.299 8.968 1.00 0.00 C ATOM 2714 CD2 LEU B 78 12.167 -0.266 7.828 1.00 0.00 C ATOM 0 H LEU B 78 10.415 -1.330 9.171 1.00 0.00 H new ATOM 0 HA LEU B 78 13.004 -2.195 9.989 1.00 0.00 H new ATOM 0 HB2 LEU B 78 11.325 0.263 10.589 1.00 0.00 H new ATOM 0 HB3 LEU B 78 12.973 0.065 11.151 1.00 0.00 H new ATOM 0 HG LEU B 78 12.523 1.457 9.024 1.00 0.00 H new ATOM 0 HD11 LEU B 78 14.670 0.733 8.032 1.00 0.00 H new ATOM 0 HD12 LEU B 78 14.761 0.838 9.806 1.00 0.00 H new ATOM 0 HD13 LEU B 78 14.614 -0.749 9.015 1.00 0.00 H new ATOM 0 HD21 LEU B 78 12.557 0.186 6.916 1.00 0.00 H new ATOM 0 HD22 LEU B 78 12.403 -1.330 7.835 1.00 0.00 H new ATOM 0 HD23 LEU B 78 11.086 -0.134 7.865 1.00 0.00 H new ATOM 2726 N GLY B 79 12.868 -2.090 12.635 1.00 0.00 N ATOM 2727 CA GLY B 79 12.749 -2.519 14.018 1.00 0.00 C ATOM 2728 C GLY B 79 11.323 -2.464 14.533 1.00 0.00 C ATOM 2729 O GLY B 79 10.899 -3.330 15.297 1.00 0.00 O ATOM 0 H GLY B 79 13.779 -1.704 12.386 1.00 0.00 H new ATOM 0 HA2 GLY B 79 13.124 -3.538 14.110 1.00 0.00 H new ATOM 0 HA3 GLY B 79 13.381 -1.889 14.644 1.00 0.00 H new ATOM 2733 N GLN B 80 10.580 -1.444 14.111 1.00 0.00 N ATOM 2734 CA GLN B 80 9.194 -1.284 14.537 1.00 0.00 C ATOM 2735 C GLN B 80 8.418 -0.406 13.559 1.00 0.00 C ATOM 2736 O GLN B 80 7.634 0.451 13.968 1.00 0.00 O ATOM 2737 CB GLN B 80 9.132 -0.677 15.938 1.00 0.00 C ATOM 2738 CG GLN B 80 7.728 -0.633 16.519 1.00 0.00 C ATOM 2739 CD GLN B 80 7.703 -0.909 18.009 1.00 0.00 C ATOM 2740 OE1 GLN B 80 7.588 0.008 18.821 1.00 0.00 O ATOM 2741 NE2 GLN B 80 7.812 -2.181 18.377 1.00 0.00 N ATOM 0 H GLN B 80 10.914 -0.718 13.476 1.00 0.00 H new ATOM 0 HA GLN B 80 8.735 -2.272 14.555 1.00 0.00 H new ATOM 0 HB2 GLN B 80 9.774 -1.254 16.604 1.00 0.00 H new ATOM 0 HB3 GLN B 80 9.535 0.335 15.905 1.00 0.00 H new ATOM 0 HG2 GLN B 80 7.291 0.347 16.328 1.00 0.00 H new ATOM 0 HG3 GLN B 80 7.104 -1.366 16.007 1.00 0.00 H new ATOM 0 HE21 GLN B 80 7.906 -2.910 17.670 1.00 0.00 H new ATOM 0 HE22 GLN B 80 7.802 -2.428 19.367 1.00 0.00 H new ATOM 2750 N VAL B 81 8.644 -0.622 12.268 1.00 0.00 N ATOM 2751 CA VAL B 81 7.968 0.152 11.236 1.00 0.00 C ATOM 2752 C VAL B 81 7.954 -0.601 9.908 1.00 0.00 C ATOM 2753 O VAL B 81 8.696 -1.565 9.722 1.00 0.00 O ATOM 2754 CB VAL B 81 8.645 1.521 11.040 1.00 0.00 C ATOM 2755 CG1 VAL B 81 8.045 2.265 9.856 1.00 0.00 C ATOM 2756 CG2 VAL B 81 8.532 2.353 12.309 1.00 0.00 C ATOM 0 H VAL B 81 9.290 -1.327 11.912 1.00 0.00 H new ATOM 0 HA VAL B 81 6.941 0.308 11.567 1.00 0.00 H new ATOM 0 HB VAL B 81 9.700 1.351 10.827 1.00 0.00 H new ATOM 0 HG11 VAL B 81 8.542 3.228 9.742 1.00 0.00 H new ATOM 0 HG12 VAL B 81 8.182 1.676 8.949 1.00 0.00 H new ATOM 0 HG13 VAL B 81 6.981 2.425 10.028 1.00 0.00 H new ATOM 0 HG21 VAL B 81 9.015 3.318 12.156 1.00 0.00 H new ATOM 0 HG22 VAL B 81 7.480 2.508 12.550 1.00 0.00 H new ATOM 0 HG23 VAL B 81 9.020 1.830 13.132 1.00 0.00 H new ATOM 2766 N ALA B 82 7.107 -0.152 8.988 1.00 0.00 N ATOM 2767 CA ALA B 82 6.995 -0.778 7.678 1.00 0.00 C ATOM 2768 C ALA B 82 6.998 0.275 6.577 1.00 0.00 C ATOM 2769 O ALA B 82 6.056 1.057 6.451 1.00 0.00 O ATOM 2770 CB ALA B 82 5.732 -1.623 7.602 1.00 0.00 C ATOM 0 H ALA B 82 6.487 0.646 9.127 1.00 0.00 H new ATOM 0 HA ALA B 82 7.858 -1.428 7.532 1.00 0.00 H new ATOM 0 HB1 ALA B 82 5.662 -2.085 6.617 1.00 0.00 H new ATOM 0 HB2 ALA B 82 5.768 -2.400 8.365 1.00 0.00 H new ATOM 0 HB3 ALA B 82 4.860 -0.990 7.769 1.00 0.00 H new ATOM 2776 N ILE B 83 8.064 0.297 5.786 1.00 0.00 N ATOM 2777 CA ILE B 83 8.185 1.264 4.703 1.00 0.00 C ATOM 2778 C ILE B 83 7.855 0.635 3.353 1.00 0.00 C ATOM 2779 O ILE B 83 8.334 -0.450 3.026 1.00 0.00 O ATOM 2780 CB ILE B 83 9.602 1.872 4.637 1.00 0.00 C ATOM 2781 CG1 ILE B 83 10.352 1.643 5.952 1.00 0.00 C ATOM 2782 CG2 ILE B 83 9.523 3.358 4.318 1.00 0.00 C ATOM 2783 CD1 ILE B 83 9.810 2.454 7.111 1.00 0.00 C ATOM 0 H ILE B 83 8.854 -0.342 5.874 1.00 0.00 H new ATOM 0 HA ILE B 83 7.467 2.056 4.917 1.00 0.00 H new ATOM 0 HB ILE B 83 10.155 1.374 3.840 1.00 0.00 H new ATOM 0 HG12 ILE B 83 10.305 0.584 6.207 1.00 0.00 H new ATOM 0 HG13 ILE B 83 11.404 1.890 5.808 1.00 0.00 H new ATOM 0 HG21 ILE B 83 10.529 3.775 4.274 1.00 0.00 H new ATOM 0 HG22 ILE B 83 9.030 3.498 3.356 1.00 0.00 H new ATOM 0 HG23 ILE B 83 8.953 3.867 5.095 1.00 0.00 H new ATOM 0 HD11 ILE B 83 10.391 2.240 8.008 1.00 0.00 H new ATOM 0 HD12 ILE B 83 9.882 3.516 6.877 1.00 0.00 H new ATOM 0 HD13 ILE B 83 8.766 2.191 7.283 1.00 0.00 H new ATOM 2795 N LEU B 84 7.038 1.334 2.573 1.00 0.00 N ATOM 2796 CA LEU B 84 6.639 0.864 1.251 1.00 0.00 C ATOM 2797 C LEU B 84 7.079 1.862 0.183 1.00 0.00 C ATOM 2798 O LEU B 84 6.474 2.922 0.026 1.00 0.00 O ATOM 2799 CB LEU B 84 5.121 0.657 1.201 1.00 0.00 C ATOM 2800 CG LEU B 84 4.468 0.879 -0.167 1.00 0.00 C ATOM 2801 CD1 LEU B 84 4.023 -0.445 -0.766 1.00 0.00 C ATOM 2802 CD2 LEU B 84 3.288 1.835 -0.046 1.00 0.00 C ATOM 0 H LEU B 84 6.637 2.234 2.836 1.00 0.00 H new ATOM 0 HA LEU B 84 7.126 -0.091 1.053 1.00 0.00 H new ATOM 0 HB2 LEU B 84 4.900 -0.359 1.529 1.00 0.00 H new ATOM 0 HB3 LEU B 84 4.656 1.332 1.919 1.00 0.00 H new ATOM 0 HG LEU B 84 5.206 1.326 -0.833 1.00 0.00 H new ATOM 0 HD11 LEU B 84 3.561 -0.268 -1.737 1.00 0.00 H new ATOM 0 HD12 LEU B 84 4.887 -1.098 -0.888 1.00 0.00 H new ATOM 0 HD13 LEU B 84 3.301 -0.920 -0.102 1.00 0.00 H new ATOM 0 HD21 LEU B 84 2.836 1.981 -1.027 1.00 0.00 H new ATOM 0 HD22 LEU B 84 2.548 1.415 0.635 1.00 0.00 H new ATOM 0 HD23 LEU B 84 3.634 2.794 0.340 1.00 0.00 H new ATOM 2814 N LEU B 85 8.142 1.523 -0.538 1.00 0.00 N ATOM 2815 CA LEU B 85 8.666 2.401 -1.579 1.00 0.00 C ATOM 2816 C LEU B 85 8.361 1.861 -2.972 1.00 0.00 C ATOM 2817 O LEU B 85 8.826 0.785 -3.349 1.00 0.00 O ATOM 2818 CB LEU B 85 10.176 2.579 -1.411 1.00 0.00 C ATOM 2819 CG LEU B 85 10.605 3.916 -0.807 1.00 0.00 C ATOM 2820 CD1 LEU B 85 9.962 4.112 0.556 1.00 0.00 C ATOM 2821 CD2 LEU B 85 12.119 3.989 -0.700 1.00 0.00 C ATOM 0 H LEU B 85 8.656 0.650 -0.422 1.00 0.00 H new ATOM 0 HA LEU B 85 8.173 3.368 -1.475 1.00 0.00 H new ATOM 0 HB2 LEU B 85 10.554 1.774 -0.780 1.00 0.00 H new ATOM 0 HB3 LEU B 85 10.650 2.469 -2.386 1.00 0.00 H new ATOM 0 HG LEU B 85 10.269 4.718 -1.464 1.00 0.00 H new ATOM 0 HD11 LEU B 85 10.277 5.068 0.973 1.00 0.00 H new ATOM 0 HD12 LEU B 85 8.877 4.102 0.451 1.00 0.00 H new ATOM 0 HD13 LEU B 85 10.270 3.306 1.223 1.00 0.00 H new ATOM 0 HD21 LEU B 85 12.407 4.947 -0.268 1.00 0.00 H new ATOM 0 HD22 LEU B 85 12.478 3.181 -0.063 1.00 0.00 H new ATOM 0 HD23 LEU B 85 12.559 3.891 -1.692 1.00 0.00 H new ATOM 2833 N PHE B 86 7.581 2.621 -3.732 1.00 0.00 N ATOM 2834 CA PHE B 86 7.214 2.228 -5.090 1.00 0.00 C ATOM 2835 C PHE B 86 6.911 3.453 -5.949 1.00 0.00 C ATOM 2836 O PHE B 86 6.266 4.393 -5.495 1.00 0.00 O ATOM 2837 CB PHE B 86 6.005 1.294 -5.065 1.00 0.00 C ATOM 2838 CG PHE B 86 4.706 1.998 -4.804 1.00 0.00 C ATOM 2839 CD1 PHE B 86 3.955 2.503 -5.853 1.00 0.00 C ATOM 2840 CD2 PHE B 86 4.235 2.151 -3.511 1.00 0.00 C ATOM 2841 CE1 PHE B 86 2.757 3.150 -5.616 1.00 0.00 C ATOM 2842 CE2 PHE B 86 3.038 2.798 -3.267 1.00 0.00 C ATOM 2843 CZ PHE B 86 2.297 3.297 -4.322 1.00 0.00 C ATOM 0 H PHE B 86 7.190 3.514 -3.432 1.00 0.00 H new ATOM 0 HA PHE B 86 8.061 1.700 -5.530 1.00 0.00 H new ATOM 0 HB2 PHE B 86 5.940 0.772 -6.020 1.00 0.00 H new ATOM 0 HB3 PHE B 86 6.158 0.536 -4.297 1.00 0.00 H new ATOM 0 HD1 PHE B 86 4.310 2.390 -6.867 1.00 0.00 H new ATOM 0 HD2 PHE B 86 4.809 1.761 -2.684 1.00 0.00 H new ATOM 0 HE1 PHE B 86 2.181 3.540 -6.442 1.00 0.00 H new ATOM 0 HE2 PHE B 86 2.682 2.913 -2.254 1.00 0.00 H new ATOM 0 HZ PHE B 86 1.360 3.801 -4.135 1.00 0.00 H new ATOM 2853 N LYS B 87 7.380 3.438 -7.193 1.00 0.00 N ATOM 2854 CA LYS B 87 7.158 4.555 -8.108 1.00 0.00 C ATOM 2855 C LYS B 87 6.022 4.254 -9.081 1.00 0.00 C ATOM 2856 O LYS B 87 5.667 3.096 -9.298 1.00 0.00 O ATOM 2857 CB LYS B 87 8.439 4.863 -8.880 1.00 0.00 C ATOM 2858 CG LYS B 87 9.637 5.107 -7.981 1.00 0.00 C ATOM 2859 CD LYS B 87 10.935 5.065 -8.765 1.00 0.00 C ATOM 2860 CE LYS B 87 11.025 6.214 -9.756 1.00 0.00 C ATOM 2861 NZ LYS B 87 10.475 5.841 -11.089 1.00 0.00 N ATOM 0 H LYS B 87 7.915 2.666 -7.591 1.00 0.00 H new ATOM 0 HA LYS B 87 6.876 5.426 -7.516 1.00 0.00 H new ATOM 0 HB2 LYS B 87 8.660 4.032 -9.550 1.00 0.00 H new ATOM 0 HB3 LYS B 87 8.277 5.742 -9.504 1.00 0.00 H new ATOM 0 HG2 LYS B 87 9.536 6.076 -7.493 1.00 0.00 H new ATOM 0 HG3 LYS B 87 9.662 4.354 -7.193 1.00 0.00 H new ATOM 0 HD2 LYS B 87 11.779 5.110 -8.076 1.00 0.00 H new ATOM 0 HD3 LYS B 87 11.009 4.117 -9.298 1.00 0.00 H new ATOM 0 HE2 LYS B 87 10.480 7.074 -9.366 1.00 0.00 H new ATOM 0 HE3 LYS B 87 12.066 6.519 -9.865 1.00 0.00 H new ATOM 0 HZ1 LYS B 87 11.242 5.835 -11.792 1.00 0.00 H new ATOM 0 HZ2 LYS B 87 10.047 4.895 -11.036 1.00 0.00 H new ATOM 0 HZ3 LYS B 87 9.751 6.532 -11.372 1.00 0.00 H new ATOM 2875 N SER B 88 5.456 5.308 -9.661 1.00 0.00 N ATOM 2876 CA SER B 88 4.358 5.165 -10.610 1.00 0.00 C ATOM 2877 C SER B 88 4.868 5.234 -12.041 1.00 0.00 C ATOM 2878 O SER B 88 4.109 5.487 -12.977 1.00 0.00 O ATOM 2879 CB SER B 88 3.316 6.254 -10.379 1.00 0.00 C ATOM 2880 OG SER B 88 2.170 5.738 -9.725 1.00 0.00 O ATOM 0 H SER B 88 5.741 6.272 -9.490 1.00 0.00 H new ATOM 0 HA SER B 88 3.898 4.190 -10.452 1.00 0.00 H new ATOM 0 HB2 SER B 88 3.750 7.055 -9.780 1.00 0.00 H new ATOM 0 HB3 SER B 88 3.026 6.692 -11.334 1.00 0.00 H new ATOM 0 HG SER B 88 1.391 5.826 -10.312 1.00 0.00 H new ATOM 2886 N GLY B 89 6.159 5.006 -12.194 1.00 0.00 N ATOM 2887 CA GLY B 89 6.776 5.041 -13.507 1.00 0.00 C ATOM 2888 C GLY B 89 6.449 6.310 -14.270 1.00 0.00 C ATOM 2889 O GLY B 89 6.985 7.377 -13.906 1.00 0.00 O ATOM 2890 OXT GLY B 89 5.658 6.236 -15.235 1.00 0.00 O ATOM 0 H GLY B 89 6.799 4.795 -11.428 1.00 0.00 H new ATOM 0 HA2 GLY B 89 7.857 4.955 -13.399 1.00 0.00 H new ATOM 0 HA3 GLY B 89 6.443 4.178 -14.084 1.00 0.00 H new