USER MOD reduce.3.24.130724 H: found=0, std=0, add=883, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 877 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: A 76 TYR OH : rot -114:sc= 0.943 USER MOD Set 1.2: A 83 CYS SG : rot 58:sc= 0.731 USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 8 CYS SG : rot 70:sc= -0.847 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A -2 MET CE :methyl -168:sc= -0.0375 (180deg=-0.281) USER MOD Single : A -3 HIS :FLIP no HE2:sc= -0.255 F(o=-0.76,f=-0.26) USER MOD Single : A -4 SER OG : rot 180:sc= -0.174 USER MOD Single : A -5 GLY N :NH3+ -173:sc= 0 (180deg=-0.0383) USER MOD Single : A 11 LYS NZ :NH3+ -150:sc= 0.0313 (180deg=0) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ 158:sc= -0.0111 (180deg=-0.17) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 ASN :FLIP amide:sc= -0.128 F(o=-1.6,f=-0.13) USER MOD Single : A 26 GLN :FLIP amide:sc=-0.00424 F(o=-0.61,f=-0.0042) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 GLN : amide:sc= -0.194 X(o=-0.19,f=-0.042) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 LYS NZ :NH3+ -157:sc= -0.0507 (180deg=-0.372) USER MOD Single : A 36 GLN :FLIP amide:sc= -0.601 F(o=-1.4,f=-0.6) USER MOD Single : A 47 THR OG1 : rot 85:sc= 1.22 USER MOD Single : A 50 GLN :FLIP amide:sc= -1.39 F(o=-2,f=-1.4) USER MOD Single : A 52 GLN : amide:sc= -0.539 K(o=-0.54,f=-1.1) USER MOD Single : A 54 HIS : no HD1:sc= -0.151 X(o=-0.15,f=-0.18) USER MOD Single : A 55 HIS : no HD1:sc= -0.0671 X(o=-0.067,f=-0.47) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 ASN :FLIP amide:sc= -1.59 F(o=-6.9!,f=-1.6) USER MOD Single : A 62 SER OG : rot 18:sc= 0.778 USER MOD Single : A 64 THR OG1 : rot 180:sc= -0.699 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 THR OG1 : rot -148:sc= 0.5 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 MET CE :methyl 157:sc= -1.72 (180deg=-2.84) USER MOD Single : A 80 GLN : amide:sc= -0.281 X(o=-0.28,f=-0.28) USER MOD Single : A 82 GLN :FLIP amide:sc= -0.0727 F(o=-0.78,f=-0.073) USER MOD Single : A 89 THR OG1 : rot 180:sc= -0.425 USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 92 HIS : no HD1:sc= -0.114 X(o=-0.11,f=-0.12) USER MOD Single : A 93 SER OG : rot 55:sc= 1.08 USER MOD Single : A 95 SER OG : rot 180:sc= -0.197 USER MOD Single : A 98 SER OG : rot 18:sc= 1.3 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -5 -1.452 4.705 -16.154 1.00 0.00 N ATOM 2 CA GLY A -5 -0.257 4.518 -16.956 1.00 0.00 C ATOM 3 C GLY A -5 0.455 3.218 -16.639 1.00 0.00 C ATOM 4 O GLY A -5 0.932 2.528 -17.540 1.00 0.00 O ATOM 0 H1 GLY A -5 -1.966 5.545 -16.488 1.00 0.00 H new ATOM 0 H2 GLY A -5 -2.063 3.868 -16.241 1.00 0.00 H new ATOM 0 H3 GLY A -5 -1.184 4.836 -15.158 1.00 0.00 H new ATOM 0 HA2 GLY A -5 -0.526 4.534 -18.012 1.00 0.00 H new ATOM 0 HA3 GLY A -5 0.424 5.352 -16.788 1.00 0.00 H new ATOM 8 N SER A -4 0.529 2.883 -15.354 1.00 0.00 N ATOM 9 CA SER A -4 1.194 1.660 -14.920 1.00 0.00 C ATOM 10 C SER A -4 0.895 1.371 -13.452 1.00 0.00 C ATOM 11 O SER A -4 0.596 0.236 -13.079 1.00 0.00 O ATOM 12 CB SER A -4 2.705 1.773 -15.132 1.00 0.00 C ATOM 13 OG SER A -4 3.072 3.093 -15.491 1.00 0.00 O ATOM 0 H SER A -4 0.137 3.441 -14.596 1.00 0.00 H new ATOM 0 HA SER A -4 0.811 0.835 -15.520 1.00 0.00 H new ATOM 0 HB2 SER A -4 3.226 1.483 -14.220 1.00 0.00 H new ATOM 0 HB3 SER A -4 3.019 1.080 -15.913 1.00 0.00 H new ATOM 0 HG SER A -4 4.042 3.139 -15.619 1.00 0.00 H new ATOM 19 N HIS A -3 0.977 2.406 -12.623 1.00 0.00 N ATOM 20 CA HIS A -3 0.714 2.265 -11.195 1.00 0.00 C ATOM 21 C HIS A -3 0.794 3.617 -10.492 1.00 0.00 C ATOM 22 O HIS A -3 1.871 4.054 -10.087 1.00 0.00 O ATOM 23 CB HIS A -3 1.710 1.290 -10.566 1.00 0.00 C ATOM 24 CG HIS A -3 3.076 1.351 -11.179 1.00 0.00 C ATOM 25 ND1 HIS A -3 3.823 2.409 -11.573 1.00 0.00 N flip ATOM 26 CD2 HIS A -3 3.829 0.229 -11.452 1.00 0.00 C flip ATOM 27 CE1 HIS A -3 5.002 1.911 -12.071 1.00 0.00 C flip ATOM 28 NE2 HIS A -3 4.981 0.593 -11.986 1.00 0.00 N flip ATOM 0 H HIS A -3 1.223 3.352 -12.915 1.00 0.00 H new ATOM 0 HA HIS A -3 -0.295 1.871 -11.073 1.00 0.00 H new ATOM 0 HB2 HIS A -3 1.789 1.502 -9.500 1.00 0.00 H new ATOM 0 HB3 HIS A -3 1.323 0.276 -10.662 1.00 0.00 H new ATOM 0 HD1 HIS A -3 3.559 3.392 -11.511 1.00 0.00 H new ATOM 0 HD2 HIS A -3 3.524 -0.789 -11.259 1.00 0.00 H new ATOM 0 HE1 HIS A -3 5.815 2.501 -12.468 1.00 0.00 H new ATOM 36 N MET A -2 -0.353 4.274 -10.351 1.00 0.00 N ATOM 37 CA MET A -2 -0.412 5.575 -9.697 1.00 0.00 C ATOM 38 C MET A -2 -1.776 5.797 -9.051 1.00 0.00 C ATOM 39 O MET A -2 -2.506 6.717 -9.421 1.00 0.00 O ATOM 40 CB MET A -2 -0.124 6.690 -10.704 1.00 0.00 C ATOM 41 CG MET A -2 1.241 6.576 -11.363 1.00 0.00 C ATOM 42 SD MET A -2 1.712 8.073 -12.249 1.00 0.00 S ATOM 43 CE MET A -2 0.372 8.204 -13.431 1.00 0.00 C ATOM 0 H MET A -2 -1.253 3.926 -10.681 1.00 0.00 H new ATOM 0 HA MET A -2 0.348 5.596 -8.916 1.00 0.00 H new ATOM 0 HB2 MET A -2 -0.893 6.679 -11.476 1.00 0.00 H new ATOM 0 HB3 MET A -2 -0.195 7.653 -10.198 1.00 0.00 H new ATOM 0 HG2 MET A -2 1.990 6.358 -10.602 1.00 0.00 H new ATOM 0 HG3 MET A -2 1.236 5.735 -12.056 1.00 0.00 H new ATOM 0 HE1 MET A -2 0.624 8.949 -14.186 1.00 0.00 H new ATOM 0 HE2 MET A -2 0.216 7.239 -13.912 1.00 0.00 H new ATOM 0 HE3 MET A -2 -0.540 8.504 -12.915 1.00 0.00 H new ATOM 53 N ALA A -1 -2.114 4.949 -8.085 1.00 0.00 N ATOM 54 CA ALA A -1 -3.389 5.055 -7.388 1.00 0.00 C ATOM 55 C ALA A -1 -4.542 5.221 -8.372 1.00 0.00 C ATOM 56 O ALA A -1 -5.442 6.032 -8.157 1.00 0.00 O ATOM 57 CB ALA A -1 -3.359 6.217 -6.406 1.00 0.00 C ATOM 0 H ALA A -1 -1.522 4.181 -7.768 1.00 0.00 H new ATOM 0 HA ALA A -1 -3.549 4.130 -6.835 1.00 0.00 H new ATOM 0 HB1 ALA A -1 -4.318 6.284 -5.892 1.00 0.00 H new ATOM 0 HB2 ALA A -1 -2.567 6.055 -5.675 1.00 0.00 H new ATOM 0 HB3 ALA A -1 -3.171 7.145 -6.946 1.00 0.00 H new ATOM 63 N SER A 1 -4.506 4.449 -9.454 1.00 0.00 N ATOM 64 CA SER A 1 -5.546 4.515 -10.474 1.00 0.00 C ATOM 65 C SER A 1 -5.242 3.556 -11.622 1.00 0.00 C ATOM 66 O SER A 1 -6.151 3.055 -12.283 1.00 0.00 O ATOM 67 CB SER A 1 -5.676 5.943 -11.008 1.00 0.00 C ATOM 68 OG SER A 1 -6.310 5.957 -12.275 1.00 0.00 O ATOM 0 H SER A 1 -3.768 3.771 -9.647 1.00 0.00 H new ATOM 0 HA SER A 1 -6.490 4.219 -10.016 1.00 0.00 H new ATOM 0 HB2 SER A 1 -6.249 6.547 -10.304 1.00 0.00 H new ATOM 0 HB3 SER A 1 -4.688 6.397 -11.087 1.00 0.00 H new ATOM 0 HG SER A 1 -6.383 6.881 -12.594 1.00 0.00 H new ATOM 74 N ALA A 2 -3.957 3.307 -11.851 1.00 0.00 N ATOM 75 CA ALA A 2 -3.532 2.407 -12.917 1.00 0.00 C ATOM 76 C ALA A 2 -3.953 0.971 -12.623 1.00 0.00 C ATOM 77 O ALA A 2 -4.124 0.165 -13.538 1.00 0.00 O ATOM 78 CB ALA A 2 -2.025 2.490 -13.107 1.00 0.00 C ATOM 0 H ALA A 2 -3.192 3.715 -11.313 1.00 0.00 H new ATOM 0 HA ALA A 2 -4.021 2.719 -13.840 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -1.721 1.813 -13.906 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -1.747 3.510 -13.371 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -1.525 2.206 -12.181 1.00 0.00 H new ATOM 84 N ASP A 3 -4.117 0.658 -11.343 1.00 0.00 N ATOM 85 CA ASP A 3 -4.518 -0.682 -10.929 1.00 0.00 C ATOM 86 C ASP A 3 -6.009 -0.899 -11.163 1.00 0.00 C ATOM 87 O ASP A 3 -6.426 -1.954 -11.644 1.00 0.00 O ATOM 88 CB ASP A 3 -4.183 -0.904 -9.453 1.00 0.00 C ATOM 89 CG ASP A 3 -3.794 -2.339 -9.158 1.00 0.00 C ATOM 90 OD1 ASP A 3 -2.875 -2.855 -9.828 1.00 0.00 O ATOM 91 OD2 ASP A 3 -4.409 -2.948 -8.257 1.00 0.00 O ATOM 0 H ASP A 3 -3.979 1.313 -10.574 1.00 0.00 H new ATOM 0 HA ASP A 3 -3.965 -1.403 -11.532 1.00 0.00 H new ATOM 0 HB2 ASP A 3 -3.366 -0.242 -9.165 1.00 0.00 H new ATOM 0 HB3 ASP A 3 -5.044 -0.631 -8.843 1.00 0.00 H new ATOM 96 N LEU A 4 -6.809 0.104 -10.819 1.00 0.00 N ATOM 97 CA LEU A 4 -8.256 0.023 -10.991 1.00 0.00 C ATOM 98 C LEU A 4 -8.631 0.058 -12.468 1.00 0.00 C ATOM 99 O LEU A 4 -9.530 -0.659 -12.909 1.00 0.00 O ATOM 100 CB LEU A 4 -8.942 1.172 -10.250 1.00 0.00 C ATOM 101 CG LEU A 4 -10.469 1.114 -10.190 1.00 0.00 C ATOM 102 CD1 LEU A 4 -10.944 1.050 -8.747 1.00 0.00 C ATOM 103 CD2 LEU A 4 -11.076 2.315 -10.900 1.00 0.00 C ATOM 0 H LEU A 4 -6.481 0.983 -10.419 1.00 0.00 H new ATOM 0 HA LEU A 4 -8.595 -0.924 -10.572 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -8.559 1.200 -9.230 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -8.652 2.109 -10.725 1.00 0.00 H new ATOM 0 HG LEU A 4 -10.800 0.210 -10.700 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -12.033 1.009 -8.724 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -10.537 0.159 -8.269 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -10.603 1.936 -8.212 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -12.163 2.257 -10.848 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -10.737 3.232 -10.418 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -10.763 2.317 -11.944 1.00 0.00 H new ATOM 115 N VAL A 5 -7.936 0.896 -13.231 1.00 0.00 N ATOM 116 CA VAL A 5 -8.194 1.023 -14.660 1.00 0.00 C ATOM 117 C VAL A 5 -7.748 -0.227 -15.412 1.00 0.00 C ATOM 118 O VAL A 5 -8.517 -0.812 -16.174 1.00 0.00 O ATOM 119 CB VAL A 5 -7.475 2.249 -15.254 1.00 0.00 C ATOM 120 CG1 VAL A 5 -7.697 2.323 -16.756 1.00 0.00 C ATOM 121 CG2 VAL A 5 -7.949 3.525 -14.573 1.00 0.00 C ATOM 0 H VAL A 5 -7.189 1.497 -12.883 1.00 0.00 H new ATOM 0 HA VAL A 5 -9.270 1.150 -14.777 1.00 0.00 H new ATOM 0 HB VAL A 5 -6.405 2.143 -15.075 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -7.182 3.195 -17.157 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -7.305 1.421 -17.227 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -8.764 2.405 -16.962 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -7.431 4.382 -15.004 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -9.023 3.638 -14.720 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -7.733 3.470 -13.506 1.00 0.00 H new ATOM 131 N SER A 6 -6.501 -0.630 -15.191 1.00 0.00 N ATOM 132 CA SER A 6 -5.951 -1.809 -15.851 1.00 0.00 C ATOM 133 C SER A 6 -6.754 -3.056 -15.492 1.00 0.00 C ATOM 134 O SER A 6 -7.011 -3.908 -16.343 1.00 0.00 O ATOM 135 CB SER A 6 -4.485 -2.002 -15.458 1.00 0.00 C ATOM 136 OG SER A 6 -3.913 -3.100 -16.146 1.00 0.00 O ATOM 0 H SER A 6 -5.853 -0.158 -14.561 1.00 0.00 H new ATOM 0 HA SER A 6 -6.014 -1.655 -16.928 1.00 0.00 H new ATOM 0 HB2 SER A 6 -3.923 -1.096 -15.682 1.00 0.00 H new ATOM 0 HB3 SER A 6 -4.412 -2.165 -14.383 1.00 0.00 H new ATOM 0 HG SER A 6 -2.976 -3.201 -15.879 1.00 0.00 H new ATOM 142 N SER A 7 -7.147 -3.155 -14.226 1.00 0.00 N ATOM 143 CA SER A 7 -7.917 -4.299 -13.753 1.00 0.00 C ATOM 144 C SER A 7 -9.329 -4.281 -14.332 1.00 0.00 C ATOM 145 O SER A 7 -9.814 -5.291 -14.844 1.00 0.00 O ATOM 146 CB SER A 7 -7.982 -4.300 -12.224 1.00 0.00 C ATOM 147 OG SER A 7 -8.906 -5.266 -11.753 1.00 0.00 O ATOM 0 H SER A 7 -6.945 -2.457 -13.510 1.00 0.00 H new ATOM 0 HA SER A 7 -7.416 -5.207 -14.090 1.00 0.00 H new ATOM 0 HB2 SER A 7 -6.993 -4.508 -11.815 1.00 0.00 H new ATOM 0 HB3 SER A 7 -8.272 -3.311 -11.869 1.00 0.00 H new ATOM 0 HG SER A 7 -8.928 -5.248 -10.773 1.00 0.00 H new ATOM 153 N CYS A 8 -9.981 -3.127 -14.248 1.00 0.00 N ATOM 154 CA CYS A 8 -11.337 -2.977 -14.763 1.00 0.00 C ATOM 155 C CYS A 8 -11.384 -3.258 -16.262 1.00 0.00 C ATOM 156 O CYS A 8 -12.302 -3.915 -16.753 1.00 0.00 O ATOM 157 CB CYS A 8 -11.859 -1.567 -14.480 1.00 0.00 C ATOM 158 SG CYS A 8 -12.536 -1.351 -12.817 1.00 0.00 S ATOM 0 H CYS A 8 -9.593 -2.282 -13.828 1.00 0.00 H new ATOM 0 HA CYS A 8 -11.974 -3.702 -14.256 1.00 0.00 H new ATOM 0 HB2 CYS A 8 -11.047 -0.854 -14.626 1.00 0.00 H new ATOM 0 HB3 CYS A 8 -12.631 -1.324 -15.210 1.00 0.00 H new ATOM 0 HG CYS A 8 -11.571 -1.394 -11.947 1.00 0.00 H new ATOM 164 N LYS A 9 -10.389 -2.755 -16.984 1.00 0.00 N ATOM 165 CA LYS A 9 -10.316 -2.950 -18.427 1.00 0.00 C ATOM 166 C LYS A 9 -10.129 -4.426 -18.767 1.00 0.00 C ATOM 167 O LYS A 9 -10.899 -4.996 -19.540 1.00 0.00 O ATOM 168 CB LYS A 9 -9.165 -2.131 -19.016 1.00 0.00 C ATOM 169 CG LYS A 9 -8.836 -2.490 -20.455 1.00 0.00 C ATOM 170 CD LYS A 9 -7.491 -3.188 -20.562 1.00 0.00 C ATOM 171 CE LYS A 9 -6.459 -2.307 -21.249 1.00 0.00 C ATOM 172 NZ LYS A 9 -6.573 -2.373 -22.732 1.00 0.00 N ATOM 0 H LYS A 9 -9.621 -2.209 -16.593 1.00 0.00 H new ATOM 0 HA LYS A 9 -11.256 -2.610 -18.862 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -9.420 -1.072 -18.964 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -8.276 -2.276 -18.402 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -9.616 -3.137 -20.857 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -8.827 -1.586 -21.064 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -7.138 -3.455 -19.566 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -7.606 -4.118 -21.119 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -6.586 -1.275 -20.921 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -5.458 -2.617 -20.947 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -5.853 -1.759 -23.163 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -6.427 -3.353 -23.048 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -7.519 -2.053 -23.022 1.00 0.00 H new ATOM 186 N ASP A 10 -9.103 -5.037 -18.185 1.00 0.00 N ATOM 187 CA ASP A 10 -8.817 -6.447 -18.425 1.00 0.00 C ATOM 188 C ASP A 10 -10.066 -7.298 -18.216 1.00 0.00 C ATOM 189 O ASP A 10 -10.425 -8.112 -19.066 1.00 0.00 O ATOM 190 CB ASP A 10 -7.697 -6.926 -17.501 1.00 0.00 C ATOM 191 CG ASP A 10 -7.188 -8.304 -17.875 1.00 0.00 C ATOM 192 OD1 ASP A 10 -7.665 -8.858 -18.887 1.00 0.00 O ATOM 193 OD2 ASP A 10 -6.313 -8.829 -17.155 1.00 0.00 O ATOM 0 H ASP A 10 -8.456 -4.578 -17.544 1.00 0.00 H new ATOM 0 HA ASP A 10 -8.494 -6.556 -19.460 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -6.872 -6.215 -17.536 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -8.060 -6.942 -16.473 1.00 0.00 H new ATOM 198 N LYS A 11 -10.724 -7.104 -17.077 1.00 0.00 N ATOM 199 CA LYS A 11 -11.932 -7.853 -16.755 1.00 0.00 C ATOM 200 C LYS A 11 -13.072 -7.479 -17.698 1.00 0.00 C ATOM 201 O LYS A 11 -13.651 -8.341 -18.360 1.00 0.00 O ATOM 202 CB LYS A 11 -12.349 -7.589 -15.306 1.00 0.00 C ATOM 203 CG LYS A 11 -11.974 -8.711 -14.352 1.00 0.00 C ATOM 204 CD LYS A 11 -10.634 -8.451 -13.684 1.00 0.00 C ATOM 205 CE LYS A 11 -10.168 -9.656 -12.882 1.00 0.00 C ATOM 206 NZ LYS A 11 -9.203 -10.492 -13.649 1.00 0.00 N ATOM 0 H LYS A 11 -10.440 -6.434 -16.362 1.00 0.00 H new ATOM 0 HA LYS A 11 -11.715 -8.914 -16.878 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -11.885 -6.663 -14.966 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -13.428 -7.437 -15.269 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -12.747 -8.816 -13.591 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -11.933 -9.654 -14.897 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -9.890 -8.207 -14.442 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -10.716 -7.585 -13.027 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -9.701 -9.318 -11.957 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -11.030 -10.261 -12.601 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -9.290 -11.485 -13.351 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -9.410 -10.417 -14.665 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -8.235 -10.159 -13.467 1.00 0.00 H new ATOM 220 N LEU A 12 -13.387 -6.190 -17.755 1.00 0.00 N ATOM 221 CA LEU A 12 -14.457 -5.702 -18.619 1.00 0.00 C ATOM 222 C LEU A 12 -14.310 -6.255 -20.033 1.00 0.00 C ATOM 223 O LEU A 12 -15.290 -6.667 -20.654 1.00 0.00 O ATOM 224 CB LEU A 12 -14.453 -4.173 -18.655 1.00 0.00 C ATOM 225 CG LEU A 12 -15.360 -3.523 -19.701 1.00 0.00 C ATOM 226 CD1 LEU A 12 -16.520 -2.806 -19.029 1.00 0.00 C ATOM 227 CD2 LEU A 12 -14.566 -2.560 -20.571 1.00 0.00 C ATOM 0 H LEU A 12 -12.917 -5.464 -17.214 1.00 0.00 H new ATOM 0 HA LEU A 12 -15.406 -6.047 -18.210 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -14.745 -3.806 -17.671 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -13.431 -3.836 -18.830 1.00 0.00 H new ATOM 0 HG LEU A 12 -15.766 -4.307 -20.340 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -17.155 -2.350 -19.789 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -17.104 -3.522 -18.450 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -16.134 -2.032 -18.366 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -15.227 -2.107 -21.309 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -14.131 -1.780 -19.946 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -13.770 -3.102 -21.081 1.00 0.00 H new ATOM 239 N ALA A 13 -13.079 -6.264 -20.535 1.00 0.00 N ATOM 240 CA ALA A 13 -12.804 -6.771 -21.873 1.00 0.00 C ATOM 241 C ALA A 13 -12.990 -8.283 -21.937 1.00 0.00 C ATOM 242 O ALA A 13 -13.508 -8.814 -22.920 1.00 0.00 O ATOM 243 CB ALA A 13 -11.393 -6.393 -22.301 1.00 0.00 C ATOM 0 H ALA A 13 -12.257 -5.926 -20.035 1.00 0.00 H new ATOM 0 HA ALA A 13 -13.516 -6.314 -22.561 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -11.201 -6.778 -23.302 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -11.292 -5.308 -22.304 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -10.674 -6.822 -21.603 1.00 0.00 H new ATOM 249 N TYR A 14 -12.565 -8.972 -20.884 1.00 0.00 N ATOM 250 CA TYR A 14 -12.682 -10.424 -20.822 1.00 0.00 C ATOM 251 C TYR A 14 -14.118 -10.842 -20.521 1.00 0.00 C ATOM 252 O TYR A 14 -14.474 -12.015 -20.640 1.00 0.00 O ATOM 253 CB TYR A 14 -11.741 -10.987 -19.756 1.00 0.00 C ATOM 254 CG TYR A 14 -11.741 -12.498 -19.686 1.00 0.00 C ATOM 255 CD1 TYR A 14 -11.457 -13.265 -20.809 1.00 0.00 C ATOM 256 CD2 TYR A 14 -12.025 -13.157 -18.496 1.00 0.00 C ATOM 257 CE1 TYR A 14 -11.456 -14.645 -20.749 1.00 0.00 C ATOM 258 CE2 TYR A 14 -12.025 -14.537 -18.427 1.00 0.00 C ATOM 259 CZ TYR A 14 -11.741 -15.277 -19.556 1.00 0.00 C ATOM 260 OH TYR A 14 -11.740 -16.651 -19.493 1.00 0.00 O ATOM 0 H TYR A 14 -12.136 -8.548 -20.061 1.00 0.00 H new ATOM 0 HA TYR A 14 -12.401 -10.828 -21.795 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -10.727 -10.641 -19.959 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -12.026 -10.586 -18.783 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -11.233 -12.774 -21.745 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -12.249 -12.581 -17.610 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -11.233 -15.226 -21.631 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -12.246 -15.034 -17.494 1.00 0.00 H new ATOM 0 HH TYR A 14 -11.959 -16.937 -18.582 1.00 0.00 H new ATOM 270 N PHE A 15 -14.940 -9.873 -20.132 1.00 0.00 N ATOM 271 CA PHE A 15 -16.338 -10.138 -19.814 1.00 0.00 C ATOM 272 C PHE A 15 -17.248 -9.710 -20.961 1.00 0.00 C ATOM 273 O PHE A 15 -17.085 -8.629 -21.527 1.00 0.00 O ATOM 274 CB PHE A 15 -16.739 -9.408 -18.530 1.00 0.00 C ATOM 275 CG PHE A 15 -16.061 -9.940 -17.300 1.00 0.00 C ATOM 276 CD1 PHE A 15 -15.919 -11.305 -17.107 1.00 0.00 C ATOM 277 CD2 PHE A 15 -15.566 -9.076 -16.337 1.00 0.00 C ATOM 278 CE1 PHE A 15 -15.296 -11.798 -15.977 1.00 0.00 C ATOM 279 CE2 PHE A 15 -14.941 -9.564 -15.205 1.00 0.00 C ATOM 280 CZ PHE A 15 -14.806 -10.926 -15.024 1.00 0.00 C ATOM 0 H PHE A 15 -14.662 -8.897 -20.029 1.00 0.00 H new ATOM 0 HA PHE A 15 -16.453 -11.212 -19.664 1.00 0.00 H new ATOM 0 HB2 PHE A 15 -16.504 -8.349 -18.635 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -17.819 -9.483 -18.401 1.00 0.00 H new ATOM 0 HD1 PHE A 15 -16.300 -11.991 -17.849 1.00 0.00 H new ATOM 0 HD2 PHE A 15 -15.670 -8.010 -16.472 1.00 0.00 H new ATOM 0 HE1 PHE A 15 -15.192 -12.864 -15.839 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -14.558 -8.880 -14.462 1.00 0.00 H new ATOM 0 HZ PHE A 15 -14.319 -11.309 -14.140 1.00 0.00 H new ATOM 290 N ARG A 16 -18.206 -10.567 -21.300 1.00 0.00 N ATOM 291 CA ARG A 16 -19.142 -10.279 -22.381 1.00 0.00 C ATOM 292 C ARG A 16 -19.796 -8.915 -22.184 1.00 0.00 C ATOM 293 O ARG A 16 -19.610 -8.269 -21.153 1.00 0.00 O ATOM 294 CB ARG A 16 -20.216 -11.366 -22.457 1.00 0.00 C ATOM 295 CG ARG A 16 -20.770 -11.577 -23.856 1.00 0.00 C ATOM 296 CD ARG A 16 -21.001 -13.051 -24.148 1.00 0.00 C ATOM 297 NE ARG A 16 -19.760 -13.745 -24.479 1.00 0.00 N ATOM 298 CZ ARG A 16 -19.716 -14.963 -25.006 1.00 0.00 C ATOM 299 NH1 ARG A 16 -20.840 -15.620 -25.259 1.00 0.00 N ATOM 300 NH2 ARG A 16 -18.547 -15.528 -25.280 1.00 0.00 N ATOM 0 H ARG A 16 -18.354 -11.466 -20.842 1.00 0.00 H new ATOM 0 HA ARG A 16 -18.584 -10.263 -23.317 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -19.797 -12.305 -22.096 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -21.035 -11.104 -21.787 1.00 0.00 H new ATOM 0 HG2 ARG A 16 -21.708 -11.033 -23.963 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -20.077 -11.164 -24.589 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -21.461 -13.525 -23.280 1.00 0.00 H new ATOM 0 HD3 ARG A 16 -21.704 -13.151 -24.975 1.00 0.00 H new ATOM 0 HE ARG A 16 -18.878 -13.268 -24.295 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -21.741 -15.190 -25.049 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -20.804 -16.556 -25.664 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -17.680 -15.027 -25.086 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -18.515 -16.464 -25.685 1.00 0.00 H new ATOM 314 N ILE A 17 -20.562 -8.484 -23.181 1.00 0.00 N ATOM 315 CA ILE A 17 -21.244 -7.197 -23.117 1.00 0.00 C ATOM 316 C ILE A 17 -22.030 -7.055 -21.818 1.00 0.00 C ATOM 317 O ILE A 17 -22.286 -5.944 -21.352 1.00 0.00 O ATOM 318 CB ILE A 17 -22.204 -7.009 -24.307 1.00 0.00 C ATOM 319 CG1 ILE A 17 -21.483 -7.306 -25.623 1.00 0.00 C ATOM 320 CG2 ILE A 17 -22.770 -5.597 -24.313 1.00 0.00 C ATOM 321 CD1 ILE A 17 -21.784 -6.304 -26.716 1.00 0.00 C ATOM 0 H ILE A 17 -20.726 -9.006 -24.042 1.00 0.00 H new ATOM 0 HA ILE A 17 -20.472 -6.429 -23.158 1.00 0.00 H new ATOM 0 HB ILE A 17 -23.032 -7.710 -24.202 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -20.408 -7.324 -25.443 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -21.765 -8.301 -25.966 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -23.446 -5.480 -25.160 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -23.315 -5.420 -23.386 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -21.955 -4.879 -24.398 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -21.239 -6.577 -27.620 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -22.854 -6.303 -26.924 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -21.476 -5.310 -26.393 1.00 0.00 H new ATOM 333 N LYS A 18 -22.408 -8.187 -21.235 1.00 0.00 N ATOM 334 CA LYS A 18 -23.162 -8.191 -19.986 1.00 0.00 C ATOM 335 C LYS A 18 -22.535 -7.243 -18.969 1.00 0.00 C ATOM 336 O LYS A 18 -23.217 -6.397 -18.393 1.00 0.00 O ATOM 337 CB LYS A 18 -23.225 -9.607 -19.409 1.00 0.00 C ATOM 338 CG LYS A 18 -24.636 -10.072 -19.093 1.00 0.00 C ATOM 339 CD LYS A 18 -25.209 -9.339 -17.892 1.00 0.00 C ATOM 340 CE LYS A 18 -26.370 -8.440 -18.289 1.00 0.00 C ATOM 341 NZ LYS A 18 -27.538 -9.225 -18.774 1.00 0.00 N ATOM 0 H LYS A 18 -22.205 -9.115 -21.607 1.00 0.00 H new ATOM 0 HA LYS A 18 -24.174 -7.848 -20.200 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -22.773 -10.300 -20.119 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -22.626 -9.647 -18.499 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -25.277 -9.909 -19.960 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -24.631 -11.144 -18.898 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -25.545 -10.063 -17.149 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -24.428 -8.741 -17.423 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -26.669 -7.834 -17.434 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -26.046 -7.751 -19.069 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -28.402 -8.654 -18.681 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -27.396 -9.478 -19.773 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -27.633 -10.092 -18.207 1.00 0.00 H new ATOM 355 N GLU A 19 -21.231 -7.390 -18.755 1.00 0.00 N ATOM 356 CA GLU A 19 -20.512 -6.546 -17.808 1.00 0.00 C ATOM 357 C GLU A 19 -20.690 -5.070 -18.152 1.00 0.00 C ATOM 358 O GLU A 19 -21.110 -4.272 -17.313 1.00 0.00 O ATOM 359 CB GLU A 19 -19.025 -6.904 -17.798 1.00 0.00 C ATOM 360 CG GLU A 19 -18.180 -5.970 -16.948 1.00 0.00 C ATOM 361 CD GLU A 19 -18.733 -5.796 -15.547 1.00 0.00 C ATOM 362 OE1 GLU A 19 -19.419 -6.720 -15.060 1.00 0.00 O ATOM 363 OE2 GLU A 19 -18.481 -4.736 -14.937 1.00 0.00 O ATOM 0 H GLU A 19 -20.651 -8.086 -19.225 1.00 0.00 H new ATOM 0 HA GLU A 19 -20.926 -6.722 -16.815 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -18.908 -7.923 -17.429 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -18.650 -6.890 -18.821 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -17.164 -6.359 -16.888 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -18.120 -4.996 -17.434 1.00 0.00 H new ATOM 370 N LEU A 20 -20.366 -4.714 -19.390 1.00 0.00 N ATOM 371 CA LEU A 20 -20.488 -3.334 -19.846 1.00 0.00 C ATOM 372 C LEU A 20 -21.933 -2.855 -19.752 1.00 0.00 C ATOM 373 O LEU A 20 -22.194 -1.674 -19.522 1.00 0.00 O ATOM 374 CB LEU A 20 -19.990 -3.206 -21.286 1.00 0.00 C ATOM 375 CG LEU A 20 -18.567 -3.700 -21.550 1.00 0.00 C ATOM 376 CD1 LEU A 20 -18.578 -4.860 -22.533 1.00 0.00 C ATOM 377 CD2 LEU A 20 -17.696 -2.565 -22.072 1.00 0.00 C ATOM 0 H LEU A 20 -20.017 -5.362 -20.096 1.00 0.00 H new ATOM 0 HA LEU A 20 -19.874 -2.708 -19.198 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -20.671 -3.757 -21.935 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -20.049 -2.158 -21.578 1.00 0.00 H new ATOM 0 HG LEU A 20 -18.145 -4.052 -20.609 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -17.557 -5.198 -22.708 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -19.166 -5.680 -22.121 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -19.019 -4.534 -23.475 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -16.687 -2.935 -22.254 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -18.116 -2.182 -23.002 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -17.661 -1.764 -21.333 1.00 0.00 H new ATOM 389 N LYS A 21 -22.870 -3.781 -19.929 1.00 0.00 N ATOM 390 CA LYS A 21 -24.290 -3.456 -19.861 1.00 0.00 C ATOM 391 C LYS A 21 -24.659 -2.914 -18.483 1.00 0.00 C ATOM 392 O LYS A 21 -25.326 -1.886 -18.368 1.00 0.00 O ATOM 393 CB LYS A 21 -25.133 -4.693 -20.176 1.00 0.00 C ATOM 394 CG LYS A 21 -26.583 -4.375 -20.500 1.00 0.00 C ATOM 395 CD LYS A 21 -26.962 -4.857 -21.891 1.00 0.00 C ATOM 396 CE LYS A 21 -28.095 -4.028 -22.478 1.00 0.00 C ATOM 397 NZ LYS A 21 -27.605 -2.738 -23.038 1.00 0.00 N ATOM 0 H LYS A 21 -22.671 -4.763 -20.121 1.00 0.00 H new ATOM 0 HA LYS A 21 -24.496 -2.685 -20.603 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -24.688 -5.220 -21.020 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -25.100 -5.371 -19.323 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -27.233 -4.844 -19.762 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -26.745 -3.299 -20.430 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -26.092 -4.802 -22.546 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -27.261 -5.904 -21.846 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -28.594 -4.598 -23.262 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -28.838 -3.830 -21.706 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -28.406 -2.202 -23.428 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -27.151 -2.183 -22.285 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -26.915 -2.927 -23.793 1.00 0.00 H new ATOM 411 N ASP A 22 -24.220 -3.612 -17.442 1.00 0.00 N ATOM 412 CA ASP A 22 -24.501 -3.199 -16.072 1.00 0.00 C ATOM 413 C ASP A 22 -23.834 -1.863 -15.758 1.00 0.00 C ATOM 414 O ASP A 22 -24.432 -0.994 -15.122 1.00 0.00 O ATOM 415 CB ASP A 22 -24.022 -4.266 -15.086 1.00 0.00 C ATOM 416 CG ASP A 22 -25.148 -4.809 -14.228 1.00 0.00 C ATOM 417 OD1 ASP A 22 -25.494 -4.158 -13.221 1.00 0.00 O ATOM 418 OD2 ASP A 22 -25.683 -5.886 -14.565 1.00 0.00 O ATOM 0 H ASP A 22 -23.668 -4.466 -17.520 1.00 0.00 H new ATOM 0 HA ASP A 22 -25.580 -3.079 -15.970 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -23.562 -5.086 -15.638 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -23.251 -3.842 -14.443 1.00 0.00 H new ATOM 423 N ILE A 23 -22.594 -1.708 -16.208 1.00 0.00 N ATOM 424 CA ILE A 23 -21.846 -0.478 -15.975 1.00 0.00 C ATOM 425 C ILE A 23 -22.517 0.710 -16.656 1.00 0.00 C ATOM 426 O ILE A 23 -22.866 1.696 -16.007 1.00 0.00 O ATOM 427 CB ILE A 23 -20.397 -0.596 -16.483 1.00 0.00 C ATOM 428 CG1 ILE A 23 -19.675 -1.740 -15.768 1.00 0.00 C ATOM 429 CG2 ILE A 23 -19.655 0.717 -16.277 1.00 0.00 C ATOM 430 CD1 ILE A 23 -19.675 -1.607 -14.261 1.00 0.00 C ATOM 0 H ILE A 23 -22.086 -2.418 -16.736 1.00 0.00 H new ATOM 0 HA ILE A 23 -21.832 -0.316 -14.897 1.00 0.00 H new ATOM 0 HB ILE A 23 -20.418 -0.815 -17.551 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -20.147 -2.684 -16.041 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -18.645 -1.785 -16.121 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -18.632 0.618 -16.641 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -20.161 1.511 -16.827 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -19.640 0.964 -15.215 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -19.146 -2.452 -13.821 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -19.177 -0.680 -13.978 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -20.702 -1.593 -13.897 1.00 0.00 H new ATOM 442 N LEU A 24 -22.695 0.609 -17.969 1.00 0.00 N ATOM 443 CA LEU A 24 -23.326 1.675 -18.740 1.00 0.00 C ATOM 444 C LEU A 24 -24.739 1.948 -18.235 1.00 0.00 C ATOM 445 O LEU A 24 -25.218 3.081 -18.283 1.00 0.00 O ATOM 446 CB LEU A 24 -23.365 1.303 -20.223 1.00 0.00 C ATOM 447 CG LEU A 24 -24.753 1.240 -20.863 1.00 0.00 C ATOM 448 CD1 LEU A 24 -24.665 1.512 -22.357 1.00 0.00 C ATOM 449 CD2 LEU A 24 -25.399 -0.112 -20.602 1.00 0.00 C ATOM 0 H LEU A 24 -22.411 -0.200 -18.522 1.00 0.00 H new ATOM 0 HA LEU A 24 -22.734 2.581 -18.614 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -22.765 2.027 -20.775 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -22.886 0.332 -20.346 1.00 0.00 H new ATOM 0 HG LEU A 24 -25.376 2.011 -20.411 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -25.662 1.463 -22.795 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -24.244 2.504 -22.522 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -24.025 0.764 -22.826 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -26.386 -0.139 -21.064 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -24.777 -0.900 -21.027 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -25.497 -0.267 -19.528 1.00 0.00 H new ATOM 461 N ASN A 25 -25.401 0.903 -17.749 1.00 0.00 N ATOM 462 CA ASN A 25 -26.760 1.031 -17.233 1.00 0.00 C ATOM 463 C ASN A 25 -26.795 1.952 -16.017 1.00 0.00 C ATOM 464 O ASN A 25 -27.677 2.801 -15.896 1.00 0.00 O ATOM 465 CB ASN A 25 -27.318 -0.344 -16.862 1.00 0.00 C ATOM 466 CG ASN A 25 -28.217 -0.293 -15.642 1.00 0.00 C ATOM 467 OD1 ASN A 25 -27.618 -0.407 -14.462 1.00 0.00 O flip ATOM 468 ND2 ASN A 25 -29.434 -0.152 -15.759 1.00 0.00 N flip ATOM 0 H ASN A 25 -25.019 -0.042 -17.701 1.00 0.00 H new ATOM 0 HA ASN A 25 -27.380 1.468 -18.016 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -27.878 -0.746 -17.706 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -26.492 -1.029 -16.673 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -29.851 -0.068 -16.686 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -30.026 -0.119 -14.929 1.00 0.00 H new ATOM 475 N GLN A 26 -25.829 1.777 -15.121 1.00 0.00 N ATOM 476 CA GLN A 26 -25.751 2.592 -13.914 1.00 0.00 C ATOM 477 C GLN A 26 -25.347 4.023 -14.250 1.00 0.00 C ATOM 478 O GLN A 26 -25.798 4.974 -13.609 1.00 0.00 O ATOM 479 CB GLN A 26 -24.751 1.985 -12.928 1.00 0.00 C ATOM 480 CG GLN A 26 -25.304 0.801 -12.152 1.00 0.00 C ATOM 481 CD GLN A 26 -24.228 0.041 -11.402 1.00 0.00 C ATOM 482 OE1 GLN A 26 -23.199 -0.392 -12.120 1.00 0.00 O flip ATOM 483 NE2 GLN A 26 -24.322 -0.156 -10.190 1.00 0.00 N flip ATOM 0 H GLN A 26 -25.090 1.079 -15.208 1.00 0.00 H new ATOM 0 HA GLN A 26 -26.739 2.611 -13.453 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -23.862 1.668 -13.474 1.00 0.00 H new ATOM 0 HB3 GLN A 26 -24.435 2.755 -12.224 1.00 0.00 H new ATOM 0 HG2 GLN A 26 -26.054 1.154 -11.445 1.00 0.00 H new ATOM 0 HG3 GLN A 26 -25.809 0.124 -12.841 1.00 0.00 H new ATOM 0 HE21 GLN A 26 -25.131 0.195 -9.677 1.00 0.00 H new ATOM 0 HE22 GLN A 26 -23.591 -0.670 -9.699 1.00 0.00 H new ATOM 492 N LEU A 27 -24.494 4.171 -15.258 1.00 0.00 N ATOM 493 CA LEU A 27 -24.029 5.488 -15.679 1.00 0.00 C ATOM 494 C LEU A 27 -25.166 6.296 -16.296 1.00 0.00 C ATOM 495 O LEU A 27 -25.088 7.520 -16.398 1.00 0.00 O ATOM 496 CB LEU A 27 -22.884 5.349 -16.684 1.00 0.00 C ATOM 497 CG LEU A 27 -23.191 5.784 -18.117 1.00 0.00 C ATOM 498 CD1 LEU A 27 -23.022 7.288 -18.265 1.00 0.00 C ATOM 499 CD2 LEU A 27 -22.297 5.046 -19.102 1.00 0.00 C ATOM 0 H LEU A 27 -24.111 3.396 -15.799 1.00 0.00 H new ATOM 0 HA LEU A 27 -23.669 6.017 -14.797 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -22.037 5.932 -16.322 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -22.568 4.306 -16.702 1.00 0.00 H new ATOM 0 HG LEU A 27 -24.228 5.531 -18.339 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -23.245 7.580 -19.291 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -23.704 7.799 -17.586 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -21.996 7.564 -18.024 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -22.530 5.368 -20.117 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -21.253 5.267 -18.882 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -22.467 3.973 -19.014 1.00 0.00 H new ATOM 511 N GLY A 28 -26.224 5.602 -16.705 1.00 0.00 N ATOM 512 CA GLY A 28 -27.363 6.272 -17.305 1.00 0.00 C ATOM 513 C GLY A 28 -27.470 6.012 -18.795 1.00 0.00 C ATOM 514 O GLY A 28 -28.332 6.575 -19.470 1.00 0.00 O ATOM 0 H GLY A 28 -26.313 4.589 -16.632 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -28.277 5.938 -16.814 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -27.282 7.345 -17.131 1.00 0.00 H new ATOM 518 N LEU A 29 -26.593 5.158 -19.309 1.00 0.00 N ATOM 519 CA LEU A 29 -26.591 4.825 -20.729 1.00 0.00 C ATOM 520 C LEU A 29 -26.349 6.068 -21.580 1.00 0.00 C ATOM 521 O LEU A 29 -27.177 6.978 -21.643 1.00 0.00 O ATOM 522 CB LEU A 29 -27.918 4.174 -21.123 1.00 0.00 C ATOM 523 CG LEU A 29 -28.101 2.716 -20.702 1.00 0.00 C ATOM 524 CD1 LEU A 29 -29.401 2.542 -19.931 1.00 0.00 C ATOM 525 CD2 LEU A 29 -28.073 1.802 -21.918 1.00 0.00 C ATOM 0 H LEU A 29 -25.874 4.683 -18.764 1.00 0.00 H new ATOM 0 HA LEU A 29 -25.780 4.120 -20.910 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -28.729 4.760 -20.692 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -28.022 4.234 -22.206 1.00 0.00 H new ATOM 0 HG LEU A 29 -27.275 2.441 -20.047 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -29.514 1.498 -19.640 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -29.381 3.168 -19.039 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -30.240 2.836 -20.562 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -28.205 0.768 -21.599 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -28.879 2.077 -22.599 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -27.116 1.905 -22.429 1.00 0.00 H new ATOM 537 N PRO A 30 -25.189 6.110 -22.252 1.00 0.00 N ATOM 538 CA PRO A 30 -24.813 7.235 -23.113 1.00 0.00 C ATOM 539 C PRO A 30 -25.662 7.306 -24.378 1.00 0.00 C ATOM 540 O PRO A 30 -26.674 6.615 -24.499 1.00 0.00 O ATOM 541 CB PRO A 30 -23.353 6.940 -23.464 1.00 0.00 C ATOM 542 CG PRO A 30 -23.223 5.462 -23.332 1.00 0.00 C ATOM 543 CD PRO A 30 -24.156 5.061 -22.223 1.00 0.00 C ATOM 0 HA PRO A 30 -24.961 8.195 -22.618 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -23.115 7.270 -24.475 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -22.671 7.459 -22.790 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -23.487 4.962 -24.264 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -22.196 5.180 -23.099 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -24.582 4.072 -22.394 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -23.645 5.026 -21.261 1.00 0.00 H new ATOM 551 N LYS A 31 -25.243 8.145 -25.320 1.00 0.00 N ATOM 552 CA LYS A 31 -25.963 8.305 -26.577 1.00 0.00 C ATOM 553 C LYS A 31 -25.819 7.061 -27.449 1.00 0.00 C ATOM 554 O LYS A 31 -26.575 6.870 -28.402 1.00 0.00 O ATOM 555 CB LYS A 31 -25.446 9.532 -27.332 1.00 0.00 C ATOM 556 CG LYS A 31 -25.833 10.851 -26.686 1.00 0.00 C ATOM 557 CD LYS A 31 -24.651 11.802 -26.607 1.00 0.00 C ATOM 558 CE LYS A 31 -24.067 11.851 -25.204 1.00 0.00 C ATOM 559 NZ LYS A 31 -22.578 11.863 -25.222 1.00 0.00 N ATOM 0 H LYS A 31 -24.408 8.725 -25.236 1.00 0.00 H new ATOM 0 HA LYS A 31 -27.019 8.446 -26.346 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -24.360 9.475 -27.400 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -25.831 9.510 -28.352 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -26.637 11.315 -27.258 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -26.220 10.666 -25.684 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -23.881 11.487 -27.312 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -24.967 12.802 -26.906 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -24.431 12.741 -24.690 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -24.416 10.989 -24.635 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -22.219 11.897 -24.246 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -22.230 11.002 -25.689 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -22.244 12.699 -25.743 1.00 0.00 H new ATOM 573 N GLN A 32 -24.847 6.219 -27.114 1.00 0.00 N ATOM 574 CA GLN A 32 -24.606 4.994 -27.867 1.00 0.00 C ATOM 575 C GLN A 32 -24.583 3.782 -26.941 1.00 0.00 C ATOM 576 O GLN A 32 -24.849 3.896 -25.745 1.00 0.00 O ATOM 577 CB GLN A 32 -23.286 5.091 -28.632 1.00 0.00 C ATOM 578 CG GLN A 32 -23.335 6.049 -29.811 1.00 0.00 C ATOM 579 CD GLN A 32 -22.224 7.081 -29.772 1.00 0.00 C ATOM 580 OE1 GLN A 32 -21.523 7.292 -30.762 1.00 0.00 O ATOM 581 NE2 GLN A 32 -22.058 7.729 -28.625 1.00 0.00 N ATOM 0 H GLN A 32 -24.214 6.362 -26.327 1.00 0.00 H new ATOM 0 HA GLN A 32 -25.421 4.869 -28.579 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -22.501 5.411 -27.947 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -23.010 4.100 -28.991 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -23.266 5.481 -30.739 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -24.299 6.558 -29.820 1.00 0.00 H new ATOM 0 HE21 GLN A 32 -22.662 7.522 -27.830 1.00 0.00 H new ATOM 0 HE22 GLN A 32 -21.326 8.434 -28.539 1.00 0.00 H new ATOM 590 N GLY A 33 -24.263 2.620 -27.503 1.00 0.00 N ATOM 591 CA GLY A 33 -24.212 1.403 -26.713 1.00 0.00 C ATOM 592 C GLY A 33 -23.321 0.346 -27.335 1.00 0.00 C ATOM 593 O GLY A 33 -23.429 -0.837 -27.010 1.00 0.00 O ATOM 0 H GLY A 33 -24.038 2.500 -28.491 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -23.848 1.638 -25.713 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -25.220 1.004 -26.600 1.00 0.00 H new ATOM 597 N LYS A 34 -22.440 0.771 -28.234 1.00 0.00 N ATOM 598 CA LYS A 34 -21.527 -0.147 -28.904 1.00 0.00 C ATOM 599 C LYS A 34 -20.346 -0.494 -28.003 1.00 0.00 C ATOM 600 O LYS A 34 -19.941 0.303 -27.157 1.00 0.00 O ATOM 601 CB LYS A 34 -21.021 0.467 -30.211 1.00 0.00 C ATOM 602 CG LYS A 34 -20.708 1.949 -30.106 1.00 0.00 C ATOM 603 CD LYS A 34 -19.925 2.441 -31.311 1.00 0.00 C ATOM 604 CE LYS A 34 -20.566 3.676 -31.926 1.00 0.00 C ATOM 605 NZ LYS A 34 -20.477 3.666 -33.412 1.00 0.00 N ATOM 0 H LYS A 34 -22.339 1.746 -28.516 1.00 0.00 H new ATOM 0 HA LYS A 34 -22.073 -1.064 -29.128 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -20.123 -0.064 -30.528 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -21.771 0.317 -30.987 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -21.637 2.513 -30.020 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -20.136 2.137 -29.198 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -18.902 2.671 -31.012 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -19.869 1.649 -32.058 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -21.612 3.730 -31.625 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -20.077 4.570 -31.539 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -20.925 4.524 -33.792 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -19.478 3.640 -33.700 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -20.966 2.827 -33.783 1.00 0.00 H new ATOM 619 N LYS A 35 -19.795 -1.689 -28.191 1.00 0.00 N ATOM 620 CA LYS A 35 -18.658 -2.142 -27.398 1.00 0.00 C ATOM 621 C LYS A 35 -17.573 -1.072 -27.343 1.00 0.00 C ATOM 622 O LYS A 35 -16.823 -0.985 -26.372 1.00 0.00 O ATOM 623 CB LYS A 35 -18.086 -3.435 -27.981 1.00 0.00 C ATOM 624 CG LYS A 35 -18.522 -4.684 -27.235 1.00 0.00 C ATOM 625 CD LYS A 35 -17.950 -4.721 -25.828 1.00 0.00 C ATOM 626 CE LYS A 35 -16.598 -5.417 -25.793 1.00 0.00 C ATOM 627 NZ LYS A 35 -16.716 -6.873 -26.082 1.00 0.00 N ATOM 0 H LYS A 35 -20.118 -2.362 -28.886 1.00 0.00 H new ATOM 0 HA LYS A 35 -19.007 -2.333 -26.383 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -18.392 -3.520 -29.024 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -16.998 -3.378 -27.971 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -19.610 -4.719 -27.187 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -18.198 -5.568 -27.784 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -17.847 -3.704 -25.450 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -18.644 -5.239 -25.166 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -15.933 -4.955 -26.522 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -16.143 -5.277 -24.813 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -15.896 -7.374 -25.683 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -17.589 -7.242 -25.654 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -16.745 -7.021 -27.111 1.00 0.00 H new ATOM 641 N GLN A 36 -17.496 -0.259 -28.392 1.00 0.00 N ATOM 642 CA GLN A 36 -16.502 0.806 -28.462 1.00 0.00 C ATOM 643 C GLN A 36 -16.833 1.925 -27.480 1.00 0.00 C ATOM 644 O GLN A 36 -15.955 2.429 -26.779 1.00 0.00 O ATOM 645 CB GLN A 36 -16.423 1.366 -29.883 1.00 0.00 C ATOM 646 CG GLN A 36 -15.232 0.850 -30.675 1.00 0.00 C ATOM 647 CD GLN A 36 -13.906 1.261 -30.067 1.00 0.00 C ATOM 648 OE1 GLN A 36 -13.405 0.455 -29.139 1.00 0.00 O flip ATOM 649 NE2 GLN A 36 -13.337 2.292 -30.428 1.00 0.00 N flip ATOM 0 H GLN A 36 -18.110 -0.317 -29.205 1.00 0.00 H new ATOM 0 HA GLN A 36 -15.534 0.384 -28.191 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -17.340 1.113 -30.416 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -16.372 2.454 -29.834 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -15.281 -0.238 -30.730 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -15.290 1.224 -31.697 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -13.758 2.883 -31.145 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -12.445 2.555 -30.010 1.00 0.00 H new ATOM 658 N ASP A 37 -18.104 2.308 -27.434 1.00 0.00 N ATOM 659 CA ASP A 37 -18.551 3.368 -26.537 1.00 0.00 C ATOM 660 C ASP A 37 -18.415 2.938 -25.079 1.00 0.00 C ATOM 661 O ASP A 37 -17.932 3.699 -24.239 1.00 0.00 O ATOM 662 CB ASP A 37 -20.003 3.741 -26.838 1.00 0.00 C ATOM 663 CG ASP A 37 -20.137 5.146 -27.393 1.00 0.00 C ATOM 664 OD1 ASP A 37 -19.867 5.335 -28.597 1.00 0.00 O ATOM 665 OD2 ASP A 37 -20.510 6.055 -26.622 1.00 0.00 O ATOM 0 H ASP A 37 -18.843 1.901 -28.007 1.00 0.00 H new ATOM 0 HA ASP A 37 -17.919 4.241 -26.701 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -20.417 3.030 -27.553 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -20.593 3.656 -25.926 1.00 0.00 H new ATOM 670 N LEU A 38 -18.844 1.716 -24.785 1.00 0.00 N ATOM 671 CA LEU A 38 -18.771 1.185 -23.428 1.00 0.00 C ATOM 672 C LEU A 38 -17.325 1.119 -22.946 1.00 0.00 C ATOM 673 O LEU A 38 -16.972 1.717 -21.929 1.00 0.00 O ATOM 674 CB LEU A 38 -19.405 -0.205 -23.369 1.00 0.00 C ATOM 675 CG LEU A 38 -20.882 -0.287 -23.755 1.00 0.00 C ATOM 676 CD1 LEU A 38 -21.354 -1.733 -23.760 1.00 0.00 C ATOM 677 CD2 LEU A 38 -21.729 0.549 -22.806 1.00 0.00 C ATOM 0 H LEU A 38 -19.246 1.074 -25.468 1.00 0.00 H new ATOM 0 HA LEU A 38 -19.323 1.857 -22.771 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -18.841 -0.867 -24.026 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -19.293 -0.590 -22.356 1.00 0.00 H new ATOM 0 HG LEU A 38 -20.997 0.114 -24.762 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -22.408 -1.771 -24.037 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -20.769 -2.304 -24.480 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -21.225 -2.161 -22.766 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -22.777 0.479 -23.096 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -21.608 0.178 -21.788 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -21.409 1.590 -22.853 1.00 0.00 H new ATOM 689 N ILE A 39 -16.494 0.391 -23.684 1.00 0.00 N ATOM 690 CA ILE A 39 -15.086 0.249 -23.334 1.00 0.00 C ATOM 691 C ILE A 39 -14.437 1.610 -23.106 1.00 0.00 C ATOM 692 O ILE A 39 -13.846 1.860 -22.056 1.00 0.00 O ATOM 693 CB ILE A 39 -14.307 -0.502 -24.429 1.00 0.00 C ATOM 694 CG1 ILE A 39 -14.287 -2.003 -24.132 1.00 0.00 C ATOM 695 CG2 ILE A 39 -12.889 0.041 -24.537 1.00 0.00 C ATOM 696 CD1 ILE A 39 -15.589 -2.701 -24.458 1.00 0.00 C ATOM 0 H ILE A 39 -16.771 -0.110 -24.528 1.00 0.00 H new ATOM 0 HA ILE A 39 -15.047 -0.329 -22.411 1.00 0.00 H new ATOM 0 HB ILE A 39 -14.809 -0.346 -25.384 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -13.483 -2.467 -24.702 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -14.058 -2.153 -23.077 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -12.351 -0.500 -25.315 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -12.923 1.101 -24.789 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -12.376 -0.089 -23.584 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -15.502 -3.762 -24.222 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -16.394 -2.263 -23.868 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -15.810 -2.582 -25.519 1.00 0.00 H new ATOM 708 N ASP A 40 -14.553 2.488 -24.097 1.00 0.00 N ATOM 709 CA ASP A 40 -13.980 3.826 -24.004 1.00 0.00 C ATOM 710 C ASP A 40 -14.599 4.603 -22.847 1.00 0.00 C ATOM 711 O ASP A 40 -13.950 5.456 -22.241 1.00 0.00 O ATOM 712 CB ASP A 40 -14.190 4.585 -25.315 1.00 0.00 C ATOM 713 CG ASP A 40 -13.018 5.484 -25.657 1.00 0.00 C ATOM 714 OD1 ASP A 40 -11.904 4.956 -25.860 1.00 0.00 O ATOM 715 OD2 ASP A 40 -13.215 6.715 -25.723 1.00 0.00 O ATOM 0 H ASP A 40 -15.038 2.297 -24.974 1.00 0.00 H new ATOM 0 HA ASP A 40 -12.911 3.725 -23.819 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -14.345 3.871 -26.124 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -15.096 5.186 -25.242 1.00 0.00 H new ATOM 720 N ARG A 41 -15.858 4.303 -22.546 1.00 0.00 N ATOM 721 CA ARG A 41 -16.566 4.975 -21.462 1.00 0.00 C ATOM 722 C ARG A 41 -15.996 4.569 -20.106 1.00 0.00 C ATOM 723 O ARG A 41 -15.642 5.419 -19.290 1.00 0.00 O ATOM 724 CB ARG A 41 -18.059 4.648 -21.519 1.00 0.00 C ATOM 725 CG ARG A 41 -18.872 5.649 -22.323 1.00 0.00 C ATOM 726 CD ARG A 41 -19.104 6.933 -21.542 1.00 0.00 C ATOM 727 NE ARG A 41 -18.210 8.005 -21.973 1.00 0.00 N ATOM 728 CZ ARG A 41 -18.308 9.259 -21.547 1.00 0.00 C ATOM 729 NH1 ARG A 41 -19.255 9.598 -20.684 1.00 0.00 N ATOM 730 NH2 ARG A 41 -17.457 10.178 -21.985 1.00 0.00 N ATOM 0 H ARG A 41 -16.409 3.599 -23.037 1.00 0.00 H new ATOM 0 HA ARG A 41 -16.432 6.050 -21.586 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -18.189 3.656 -21.952 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -18.452 4.606 -20.503 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -18.353 5.877 -23.254 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -19.831 5.207 -22.593 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -20.139 7.252 -21.667 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -18.956 6.743 -20.479 1.00 0.00 H new ATOM 0 HE ARG A 41 -17.470 7.778 -22.637 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -19.911 8.895 -20.345 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -19.327 10.562 -20.359 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -16.727 9.922 -22.649 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -17.533 11.141 -21.657 1.00 0.00 H new ATOM 744 N VAL A 42 -15.912 3.263 -19.873 1.00 0.00 N ATOM 745 CA VAL A 42 -15.385 2.743 -18.617 1.00 0.00 C ATOM 746 C VAL A 42 -14.009 3.326 -18.315 1.00 0.00 C ATOM 747 O VAL A 42 -13.789 3.908 -17.251 1.00 0.00 O ATOM 748 CB VAL A 42 -15.284 1.206 -18.644 1.00 0.00 C ATOM 749 CG1 VAL A 42 -14.476 0.703 -17.458 1.00 0.00 C ATOM 750 CG2 VAL A 42 -16.671 0.582 -18.657 1.00 0.00 C ATOM 0 H VAL A 42 -16.202 2.546 -20.538 1.00 0.00 H new ATOM 0 HA VAL A 42 -16.083 3.040 -17.834 1.00 0.00 H new ATOM 0 HB VAL A 42 -14.768 0.909 -19.557 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -14.416 -0.385 -17.494 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -13.471 1.124 -17.498 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -14.961 1.009 -16.531 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -16.581 -0.504 -18.676 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -17.215 0.885 -17.762 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -17.212 0.917 -19.542 1.00 0.00 H new ATOM 760 N LEU A 43 -13.086 3.168 -19.256 1.00 0.00 N ATOM 761 CA LEU A 43 -11.730 3.680 -19.092 1.00 0.00 C ATOM 762 C LEU A 43 -11.738 5.193 -18.898 1.00 0.00 C ATOM 763 O LEU A 43 -10.936 5.736 -18.140 1.00 0.00 O ATOM 764 CB LEU A 43 -10.875 3.314 -20.306 1.00 0.00 C ATOM 765 CG LEU A 43 -10.959 1.861 -20.774 1.00 0.00 C ATOM 766 CD1 LEU A 43 -9.734 1.493 -21.596 1.00 0.00 C ATOM 767 CD2 LEU A 43 -11.105 0.925 -19.583 1.00 0.00 C ATOM 0 H LEU A 43 -13.251 2.689 -20.141 1.00 0.00 H new ATOM 0 HA LEU A 43 -11.300 3.221 -18.202 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -11.164 3.959 -21.136 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -9.834 3.540 -20.073 1.00 0.00 H new ATOM 0 HG LEU A 43 -11.841 1.753 -21.406 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -9.812 0.455 -21.920 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -9.673 2.142 -22.469 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -8.838 1.617 -20.989 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -11.163 -0.105 -19.935 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -10.243 1.036 -18.925 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -12.014 1.173 -19.035 1.00 0.00 H new ATOM 779 N ALA A 44 -12.653 5.867 -19.588 1.00 0.00 N ATOM 780 CA ALA A 44 -12.769 7.316 -19.488 1.00 0.00 C ATOM 781 C ALA A 44 -13.149 7.741 -18.074 1.00 0.00 C ATOM 782 O ALA A 44 -12.759 8.814 -17.611 1.00 0.00 O ATOM 783 CB ALA A 44 -13.791 7.834 -20.490 1.00 0.00 C ATOM 0 H ALA A 44 -13.324 5.432 -20.222 1.00 0.00 H new ATOM 0 HA ALA A 44 -11.796 7.750 -19.720 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -13.868 8.918 -20.404 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -13.476 7.571 -21.500 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -14.762 7.384 -20.284 1.00 0.00 H new ATOM 789 N LEU A 45 -13.912 6.894 -17.392 1.00 0.00 N ATOM 790 CA LEU A 45 -14.346 7.182 -16.029 1.00 0.00 C ATOM 791 C LEU A 45 -13.203 6.981 -15.040 1.00 0.00 C ATOM 792 O LEU A 45 -12.919 7.852 -14.217 1.00 0.00 O ATOM 793 CB LEU A 45 -15.528 6.289 -15.650 1.00 0.00 C ATOM 794 CG LEU A 45 -16.721 6.312 -16.606 1.00 0.00 C ATOM 795 CD1 LEU A 45 -17.374 4.941 -16.679 1.00 0.00 C ATOM 796 CD2 LEU A 45 -17.733 7.363 -16.171 1.00 0.00 C ATOM 0 H LEU A 45 -14.243 6.002 -17.760 1.00 0.00 H new ATOM 0 HA LEU A 45 -14.659 8.225 -15.986 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -15.171 5.262 -15.571 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -15.876 6.582 -14.660 1.00 0.00 H new ATOM 0 HG LEU A 45 -16.359 6.573 -17.601 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -18.221 4.977 -17.364 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -16.648 4.211 -17.038 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -17.722 4.650 -15.688 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -18.575 7.365 -16.863 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -18.089 7.132 -15.167 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -17.260 8.345 -16.171 1.00 0.00 H new ATOM 808 N LEU A 46 -12.549 5.827 -15.126 1.00 0.00 N ATOM 809 CA LEU A 46 -11.435 5.511 -14.240 1.00 0.00 C ATOM 810 C LEU A 46 -10.198 6.325 -14.608 1.00 0.00 C ATOM 811 O LEU A 46 -9.223 6.368 -13.858 1.00 0.00 O ATOM 812 CB LEU A 46 -11.113 4.017 -14.305 1.00 0.00 C ATOM 813 CG LEU A 46 -12.310 3.080 -14.467 1.00 0.00 C ATOM 814 CD1 LEU A 46 -11.880 1.631 -14.299 1.00 0.00 C ATOM 815 CD2 LEU A 46 -13.403 3.433 -13.469 1.00 0.00 C ATOM 0 H LEU A 46 -12.772 5.095 -15.801 1.00 0.00 H new ATOM 0 HA LEU A 46 -11.729 5.769 -13.223 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -10.430 3.849 -15.137 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -10.581 3.740 -13.395 1.00 0.00 H new ATOM 0 HG LEU A 46 -12.711 3.204 -15.473 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -12.745 0.979 -14.418 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -11.133 1.383 -15.053 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -11.453 1.491 -13.306 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -14.247 2.756 -13.599 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -13.014 3.338 -12.455 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -13.732 4.459 -13.637 1.00 0.00 H new ATOM 827 N THR A 47 -10.247 6.973 -15.768 1.00 0.00 N ATOM 828 CA THR A 47 -9.132 7.788 -16.235 1.00 0.00 C ATOM 829 C THR A 47 -9.454 9.274 -16.130 1.00 0.00 C ATOM 830 O THR A 47 -8.929 9.973 -15.264 1.00 0.00 O ATOM 831 CB THR A 47 -8.766 7.455 -17.694 1.00 0.00 C ATOM 832 OG1 THR A 47 -8.383 6.080 -17.802 1.00 0.00 O ATOM 833 CG2 THR A 47 -7.632 8.343 -18.184 1.00 0.00 C ATOM 0 H THR A 47 -11.047 6.949 -16.401 1.00 0.00 H new ATOM 0 HA THR A 47 -8.282 7.558 -15.593 1.00 0.00 H new ATOM 0 HB THR A 47 -9.643 7.637 -18.315 1.00 0.00 H new ATOM 0 HG1 THR A 47 -9.184 5.525 -17.907 1.00 0.00 H new ATOM 0 HG21 THR A 47 -7.391 8.089 -19.216 1.00 0.00 H new ATOM 0 HG22 THR A 47 -7.938 9.388 -18.129 1.00 0.00 H new ATOM 0 HG23 THR A 47 -6.753 8.189 -17.558 1.00 0.00 H new ATOM 841 N ASP A 48 -10.321 9.750 -17.017 1.00 0.00 N ATOM 842 CA ASP A 48 -10.715 11.154 -17.023 1.00 0.00 C ATOM 843 C ASP A 48 -11.471 11.512 -15.747 1.00 0.00 C ATOM 844 O ASP A 48 -11.660 12.687 -15.436 1.00 0.00 O ATOM 845 CB ASP A 48 -11.581 11.458 -18.246 1.00 0.00 C ATOM 846 CG ASP A 48 -10.873 12.345 -19.251 1.00 0.00 C ATOM 847 OD1 ASP A 48 -10.203 13.309 -18.824 1.00 0.00 O ATOM 848 OD2 ASP A 48 -10.988 12.076 -20.465 1.00 0.00 O ATOM 0 H ASP A 48 -10.764 9.184 -17.741 1.00 0.00 H new ATOM 0 HA ASP A 48 -9.810 11.759 -17.069 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -11.865 10.523 -18.728 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -12.502 11.943 -17.924 1.00 0.00 H new ATOM 853 N GLU A 49 -11.902 10.489 -15.015 1.00 0.00 N ATOM 854 CA GLU A 49 -12.640 10.697 -13.774 1.00 0.00 C ATOM 855 C GLU A 49 -12.031 9.882 -12.636 1.00 0.00 C ATOM 856 O GLU A 49 -12.711 9.546 -11.668 1.00 0.00 O ATOM 857 CB GLU A 49 -14.110 10.315 -13.959 1.00 0.00 C ATOM 858 CG GLU A 49 -15.054 11.506 -13.948 1.00 0.00 C ATOM 859 CD GLU A 49 -16.265 11.299 -14.836 1.00 0.00 C ATOM 860 OE1 GLU A 49 -16.082 10.884 -16.000 1.00 0.00 O ATOM 861 OE2 GLU A 49 -17.395 11.551 -14.368 1.00 0.00 O ATOM 0 H GLU A 49 -11.753 9.510 -15.259 1.00 0.00 H new ATOM 0 HA GLU A 49 -12.576 11.754 -13.516 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -14.222 9.782 -14.903 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -14.400 9.625 -13.167 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -15.385 11.693 -12.926 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -14.515 12.395 -14.276 1.00 0.00 H new ATOM 868 N GLN A 50 -10.745 9.569 -12.763 1.00 0.00 N ATOM 869 CA GLN A 50 -10.045 8.793 -11.746 1.00 0.00 C ATOM 870 C GLN A 50 -10.229 9.413 -10.365 1.00 0.00 C ATOM 871 O GLN A 50 -10.098 8.735 -9.347 1.00 0.00 O ATOM 872 CB GLN A 50 -8.556 8.699 -12.082 1.00 0.00 C ATOM 873 CG GLN A 50 -7.785 9.976 -11.790 1.00 0.00 C ATOM 874 CD GLN A 50 -7.700 10.895 -12.992 1.00 0.00 C ATOM 875 OE1 GLN A 50 -8.715 11.733 -13.170 1.00 0.00 O flip ATOM 876 NE2 GLN A 50 -6.733 10.853 -13.753 1.00 0.00 N flip ATOM 0 H GLN A 50 -10.168 9.840 -13.559 1.00 0.00 H new ATOM 0 HA GLN A 50 -10.471 7.790 -11.733 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -8.115 7.880 -11.514 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -8.445 8.451 -13.138 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -8.265 10.505 -10.966 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -6.778 9.720 -11.461 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -5.975 10.193 -13.578 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -6.690 11.478 -14.558 1.00 0.00 H new ATOM 885 N GLY A 51 -10.534 10.707 -10.339 1.00 0.00 N ATOM 886 CA GLY A 51 -10.730 11.397 -9.077 1.00 0.00 C ATOM 887 C GLY A 51 -9.424 11.840 -8.449 1.00 0.00 C ATOM 888 O GLY A 51 -9.172 11.573 -7.274 1.00 0.00 O ATOM 0 H GLY A 51 -10.649 11.289 -11.169 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -11.366 12.268 -9.238 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -11.258 10.740 -8.385 1.00 0.00 H new ATOM 892 N GLN A 52 -8.591 12.516 -9.233 1.00 0.00 N ATOM 893 CA GLN A 52 -7.302 12.994 -8.746 1.00 0.00 C ATOM 894 C GLN A 52 -7.203 14.511 -8.869 1.00 0.00 C ATOM 895 O GLN A 52 -6.231 15.118 -8.419 1.00 0.00 O ATOM 896 CB GLN A 52 -6.163 12.332 -9.523 1.00 0.00 C ATOM 897 CG GLN A 52 -5.378 11.319 -8.705 1.00 0.00 C ATOM 898 CD GLN A 52 -6.274 10.414 -7.882 1.00 0.00 C ATOM 899 OE1 GLN A 52 -6.548 10.690 -6.713 1.00 0.00 O ATOM 900 NE2 GLN A 52 -6.736 9.327 -8.488 1.00 0.00 N ATOM 0 H GLN A 52 -8.785 12.745 -10.208 1.00 0.00 H new ATOM 0 HA GLN A 52 -7.217 12.727 -7.693 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -6.574 11.836 -10.403 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -5.482 13.104 -9.881 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -4.769 10.711 -9.374 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -4.692 11.846 -8.042 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -6.483 9.138 -9.458 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -7.344 8.681 -7.984 1.00 0.00 H new ATOM 909 N ARG A 53 -8.215 15.118 -9.481 1.00 0.00 N ATOM 910 CA ARG A 53 -8.240 16.564 -9.664 1.00 0.00 C ATOM 911 C ARG A 53 -9.457 17.178 -8.978 1.00 0.00 C ATOM 912 O ARG A 53 -9.539 18.395 -8.807 1.00 0.00 O ATOM 913 CB ARG A 53 -8.252 16.911 -11.153 1.00 0.00 C ATOM 914 CG ARG A 53 -9.529 16.497 -11.865 1.00 0.00 C ATOM 915 CD ARG A 53 -10.085 17.628 -12.715 1.00 0.00 C ATOM 916 NE ARG A 53 -10.464 18.785 -11.908 1.00 0.00 N ATOM 917 CZ ARG A 53 -9.748 19.902 -11.845 1.00 0.00 C ATOM 918 NH1 ARG A 53 -8.624 20.014 -12.538 1.00 0.00 N ATOM 919 NH2 ARG A 53 -10.158 20.912 -11.087 1.00 0.00 N ATOM 0 H ARG A 53 -9.028 14.631 -9.858 1.00 0.00 H new ATOM 0 HA ARG A 53 -7.340 16.978 -9.209 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -8.114 17.986 -11.268 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -7.403 16.428 -11.637 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -9.331 15.630 -12.496 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -10.274 16.193 -11.130 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -9.339 17.928 -13.451 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -10.954 17.272 -13.268 1.00 0.00 H new ATOM 0 HE ARG A 53 -11.325 18.732 -11.363 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -8.306 19.241 -13.122 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -8.077 20.873 -12.487 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -11.023 20.830 -10.553 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -9.608 21.770 -11.039 1.00 0.00 H new ATOM 933 N HIS A 54 -10.401 16.327 -8.587 1.00 0.00 N ATOM 934 CA HIS A 54 -11.615 16.786 -7.920 1.00 0.00 C ATOM 935 C HIS A 54 -12.521 15.609 -7.572 1.00 0.00 C ATOM 936 O HIS A 54 -12.134 14.449 -7.721 1.00 0.00 O ATOM 937 CB HIS A 54 -12.366 17.778 -8.808 1.00 0.00 C ATOM 938 CG HIS A 54 -12.944 18.937 -8.055 1.00 0.00 C ATOM 939 ND1 HIS A 54 -14.287 19.250 -8.070 1.00 0.00 N ATOM 940 CD2 HIS A 54 -12.354 19.859 -7.259 1.00 0.00 C ATOM 941 CE1 HIS A 54 -14.497 20.315 -7.318 1.00 0.00 C ATOM 942 NE2 HIS A 54 -13.340 20.704 -6.814 1.00 0.00 N ATOM 0 H HIS A 54 -10.349 15.317 -8.720 1.00 0.00 H new ATOM 0 HA HIS A 54 -11.326 17.285 -6.995 1.00 0.00 H new ATOM 0 HB2 HIS A 54 -11.687 18.155 -9.573 1.00 0.00 H new ATOM 0 HB3 HIS A 54 -13.170 17.254 -9.325 1.00 0.00 H new ATOM 0 HD2 HIS A 54 -11.303 19.919 -7.019 1.00 0.00 H new ATOM 0 HE1 HIS A 54 -15.453 20.788 -7.145 1.00 0.00 H new ATOM 0 HE2 HIS A 54 -13.202 21.503 -6.195 1.00 0.00 H new ATOM 950 N HIS A 55 -13.729 15.915 -7.108 1.00 0.00 N ATOM 951 CA HIS A 55 -14.690 14.882 -6.739 1.00 0.00 C ATOM 952 C HIS A 55 -16.116 15.333 -7.041 1.00 0.00 C ATOM 953 O HIS A 55 -16.362 16.510 -7.302 1.00 0.00 O ATOM 954 CB HIS A 55 -14.556 14.537 -5.255 1.00 0.00 C ATOM 955 CG HIS A 55 -14.940 15.661 -4.342 1.00 0.00 C ATOM 956 ND1 HIS A 55 -14.259 16.859 -4.295 1.00 0.00 N ATOM 957 CD2 HIS A 55 -15.942 15.764 -3.439 1.00 0.00 C ATOM 958 CE1 HIS A 55 -14.825 17.650 -3.402 1.00 0.00 C ATOM 959 NE2 HIS A 55 -15.849 17.009 -2.867 1.00 0.00 N ATOM 0 H HIS A 55 -14.065 16.869 -6.979 1.00 0.00 H new ATOM 0 HA HIS A 55 -14.475 13.993 -7.332 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -15.180 13.671 -5.034 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -13.525 14.248 -5.049 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -16.678 15.008 -3.210 1.00 0.00 H new ATOM 0 HE1 HIS A 55 -14.505 18.651 -3.152 1.00 0.00 H new ATOM 0 HE2 HIS A 55 -16.469 17.379 -2.147 1.00 0.00 H new ATOM 967 N GLY A 56 -17.051 14.389 -7.005 1.00 0.00 N ATOM 968 CA GLY A 56 -18.440 14.710 -7.278 1.00 0.00 C ATOM 969 C GLY A 56 -18.938 14.082 -8.564 1.00 0.00 C ATOM 970 O GLY A 56 -19.554 14.753 -9.392 1.00 0.00 O ATOM 0 H GLY A 56 -16.872 13.408 -6.792 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -19.058 14.369 -6.448 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -18.555 15.792 -7.338 1.00 0.00 H new ATOM 974 N TRP A 57 -18.669 12.792 -8.734 1.00 0.00 N ATOM 975 CA TRP A 57 -19.093 12.074 -9.930 1.00 0.00 C ATOM 976 C TRP A 57 -20.089 10.974 -9.581 1.00 0.00 C ATOM 977 O TRP A 57 -21.285 11.102 -9.838 1.00 0.00 O ATOM 978 CB TRP A 57 -17.881 11.474 -10.646 1.00 0.00 C ATOM 979 CG TRP A 57 -16.572 11.890 -10.047 1.00 0.00 C ATOM 980 CD1 TRP A 57 -15.872 13.031 -10.318 1.00 0.00 C ATOM 981 CD2 TRP A 57 -15.804 11.167 -9.079 1.00 0.00 C ATOM 982 NE1 TRP A 57 -14.716 13.062 -9.576 1.00 0.00 N ATOM 983 CE2 TRP A 57 -14.652 11.930 -8.807 1.00 0.00 C ATOM 984 CE3 TRP A 57 -15.979 9.951 -8.413 1.00 0.00 C ATOM 985 CZ2 TRP A 57 -13.681 11.514 -7.900 1.00 0.00 C ATOM 986 CZ3 TRP A 57 -15.015 9.540 -7.513 1.00 0.00 C ATOM 987 CH2 TRP A 57 -13.878 10.319 -7.262 1.00 0.00 C ATOM 0 H TRP A 57 -18.159 12.222 -8.059 1.00 0.00 H new ATOM 0 HA TRP A 57 -19.584 12.784 -10.595 1.00 0.00 H new ATOM 0 HB2 TRP A 57 -17.955 10.387 -10.621 1.00 0.00 H new ATOM 0 HB3 TRP A 57 -17.903 11.771 -11.694 1.00 0.00 H new ATOM 0 HD1 TRP A 57 -16.182 13.797 -11.014 1.00 0.00 H new ATOM 0 HE1 TRP A 57 -14.019 13.807 -9.595 1.00 0.00 H new ATOM 0 HE3 TRP A 57 -16.852 9.343 -8.599 1.00 0.00 H new ATOM 0 HZ2 TRP A 57 -12.803 12.113 -7.707 1.00 0.00 H new ATOM 0 HZ3 TRP A 57 -15.140 8.601 -6.994 1.00 0.00 H new ATOM 0 HH2 TRP A 57 -13.143 9.970 -6.552 1.00 0.00 H new ATOM 998 N GLY A 58 -19.588 9.892 -8.993 1.00 0.00 N ATOM 999 CA GLY A 58 -20.448 8.786 -8.618 1.00 0.00 C ATOM 1000 C GLY A 58 -21.151 9.020 -7.295 1.00 0.00 C ATOM 1001 O GLY A 58 -21.801 8.121 -6.762 1.00 0.00 O ATOM 0 H GLY A 58 -18.601 9.762 -8.770 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -21.192 8.628 -9.398 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -19.855 7.874 -8.554 1.00 0.00 H new ATOM 1005 N ARG A 59 -21.020 10.231 -6.764 1.00 0.00 N ATOM 1006 CA ARG A 59 -21.645 10.580 -5.494 1.00 0.00 C ATOM 1007 C ARG A 59 -23.034 11.172 -5.716 1.00 0.00 C ATOM 1008 O ARG A 59 -23.583 11.841 -4.841 1.00 0.00 O ATOM 1009 CB ARG A 59 -20.772 11.574 -4.727 1.00 0.00 C ATOM 1010 CG ARG A 59 -20.429 11.122 -3.317 1.00 0.00 C ATOM 1011 CD ARG A 59 -21.609 11.295 -2.374 1.00 0.00 C ATOM 1012 NE ARG A 59 -22.419 10.083 -2.282 1.00 0.00 N ATOM 1013 CZ ARG A 59 -23.552 10.007 -1.594 1.00 0.00 C ATOM 1014 NH1 ARG A 59 -24.008 11.067 -0.941 1.00 0.00 N ATOM 1015 NH2 ARG A 59 -24.233 8.868 -1.559 1.00 0.00 N ATOM 0 H ARG A 59 -20.487 10.987 -7.194 1.00 0.00 H new ATOM 0 HA ARG A 59 -21.747 9.668 -4.906 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -19.848 11.737 -5.282 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -21.287 12.533 -4.677 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -20.125 10.075 -3.333 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -19.579 11.695 -2.947 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -21.244 11.563 -1.382 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -22.231 12.121 -2.719 1.00 0.00 H new ATOM 0 HE ARG A 59 -22.097 9.249 -2.773 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -23.488 11.944 -0.966 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -24.879 11.005 -0.413 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -23.886 8.051 -2.061 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -25.103 8.810 -1.030 1.00 0.00 H new ATOM 1029 N LYS A 60 -23.596 10.923 -6.894 1.00 0.00 N ATOM 1030 CA LYS A 60 -24.920 11.430 -7.233 1.00 0.00 C ATOM 1031 C LYS A 60 -25.681 10.431 -8.099 1.00 0.00 C ATOM 1032 O LYS A 60 -26.649 10.787 -8.768 1.00 0.00 O ATOM 1033 CB LYS A 60 -24.804 12.770 -7.964 1.00 0.00 C ATOM 1034 CG LYS A 60 -24.767 13.970 -7.033 1.00 0.00 C ATOM 1035 CD LYS A 60 -25.208 15.239 -7.743 1.00 0.00 C ATOM 1036 CE LYS A 60 -24.410 16.446 -7.272 1.00 0.00 C ATOM 1037 NZ LYS A 60 -25.130 17.723 -7.534 1.00 0.00 N ATOM 0 H LYS A 60 -23.154 10.373 -7.630 1.00 0.00 H new ATOM 0 HA LYS A 60 -25.474 11.575 -6.305 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -23.900 12.765 -8.573 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -25.647 12.876 -8.647 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -25.415 13.787 -6.176 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -23.756 14.101 -6.646 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -25.085 15.117 -8.819 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -26.269 15.409 -7.561 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -24.209 16.355 -6.205 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -23.445 16.463 -7.778 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -24.554 18.521 -7.199 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -25.299 17.823 -8.555 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -26.040 17.718 -7.031 1.00 0.00 H new ATOM 1051 N ASN A 61 -25.235 9.179 -8.079 1.00 0.00 N ATOM 1052 CA ASN A 61 -25.875 8.128 -8.862 1.00 0.00 C ATOM 1053 C ASN A 61 -25.181 6.787 -8.642 1.00 0.00 C ATOM 1054 O ASN A 61 -25.393 6.126 -7.625 1.00 0.00 O ATOM 1055 CB ASN A 61 -25.855 8.487 -10.349 1.00 0.00 C ATOM 1056 CG ASN A 61 -24.632 9.298 -10.732 1.00 0.00 C ATOM 1057 OD1 ASN A 61 -23.510 9.021 -10.078 1.00 0.00 O flip ATOM 1058 ND2 ASN A 61 -24.696 10.163 -11.606 1.00 0.00 N flip ATOM 0 H ASN A 61 -24.434 8.868 -7.530 1.00 0.00 H new ATOM 0 HA ASN A 61 -26.910 8.041 -8.530 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -25.881 7.572 -10.941 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -26.754 9.052 -10.596 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -25.580 10.342 -12.083 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -23.865 10.700 -11.853 1.00 0.00 H new ATOM 1065 N SER A 62 -24.351 6.392 -9.602 1.00 0.00 N ATOM 1066 CA SER A 62 -23.628 5.129 -9.515 1.00 0.00 C ATOM 1067 C SER A 62 -22.380 5.156 -10.393 1.00 0.00 C ATOM 1068 O SER A 62 -21.842 4.110 -10.760 1.00 0.00 O ATOM 1069 CB SER A 62 -24.533 3.968 -9.933 1.00 0.00 C ATOM 1070 OG SER A 62 -25.418 3.610 -8.886 1.00 0.00 O ATOM 0 H SER A 62 -24.163 6.928 -10.449 1.00 0.00 H new ATOM 0 HA SER A 62 -23.320 4.986 -8.479 1.00 0.00 H new ATOM 0 HB2 SER A 62 -25.105 4.249 -10.817 1.00 0.00 H new ATOM 0 HB3 SER A 62 -23.923 3.108 -10.208 1.00 0.00 H new ATOM 0 HG SER A 62 -25.468 4.341 -8.235 1.00 0.00 H new ATOM 1076 N LEU A 63 -21.924 6.358 -10.725 1.00 0.00 N ATOM 1077 CA LEU A 63 -20.739 6.524 -11.559 1.00 0.00 C ATOM 1078 C LEU A 63 -19.491 6.708 -10.702 1.00 0.00 C ATOM 1079 O LEU A 63 -18.831 7.747 -10.760 1.00 0.00 O ATOM 1080 CB LEU A 63 -20.912 7.723 -12.493 1.00 0.00 C ATOM 1081 CG LEU A 63 -21.639 7.450 -13.810 1.00 0.00 C ATOM 1082 CD1 LEU A 63 -22.890 8.308 -13.917 1.00 0.00 C ATOM 1083 CD2 LEU A 63 -20.714 7.701 -14.992 1.00 0.00 C ATOM 0 H LEU A 63 -22.357 7.233 -10.429 1.00 0.00 H new ATOM 0 HA LEU A 63 -20.617 5.621 -12.157 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -21.455 8.501 -11.956 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -19.925 8.124 -12.723 1.00 0.00 H new ATOM 0 HG LEU A 63 -21.940 6.402 -13.827 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -23.394 8.100 -14.861 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -23.561 8.078 -13.089 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -22.613 9.362 -13.878 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -21.248 7.502 -15.921 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -20.382 8.739 -14.980 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -19.848 7.042 -14.923 1.00 0.00 H new ATOM 1095 N THR A 64 -19.169 5.692 -9.908 1.00 0.00 N ATOM 1096 CA THR A 64 -18.000 5.740 -9.039 1.00 0.00 C ATOM 1097 C THR A 64 -17.158 4.477 -9.179 1.00 0.00 C ATOM 1098 O THR A 64 -17.647 3.439 -9.627 1.00 0.00 O ATOM 1099 CB THR A 64 -18.403 5.914 -7.563 1.00 0.00 C ATOM 1100 OG1 THR A 64 -19.830 5.889 -7.438 1.00 0.00 O ATOM 1101 CG2 THR A 64 -17.864 7.223 -7.005 1.00 0.00 C ATOM 0 H THR A 64 -19.702 4.825 -9.849 1.00 0.00 H new ATOM 0 HA THR A 64 -17.411 6.602 -9.351 1.00 0.00 H new ATOM 0 HB THR A 64 -17.974 5.090 -6.993 1.00 0.00 H new ATOM 0 HG1 THR A 64 -20.078 5.999 -6.496 1.00 0.00 H new ATOM 0 HG21 THR A 64 -18.162 7.324 -5.961 1.00 0.00 H new ATOM 0 HG22 THR A 64 -16.776 7.228 -7.074 1.00 0.00 H new ATOM 0 HG23 THR A 64 -18.268 8.057 -7.579 1.00 0.00 H new ATOM 1109 N LYS A 65 -15.891 4.570 -8.791 1.00 0.00 N ATOM 1110 CA LYS A 65 -14.980 3.434 -8.871 1.00 0.00 C ATOM 1111 C LYS A 65 -15.562 2.220 -8.154 1.00 0.00 C ATOM 1112 O LYS A 65 -15.358 1.082 -8.577 1.00 0.00 O ATOM 1113 CB LYS A 65 -13.624 3.798 -8.263 1.00 0.00 C ATOM 1114 CG LYS A 65 -13.011 5.056 -8.852 1.00 0.00 C ATOM 1115 CD LYS A 65 -11.595 5.276 -8.347 1.00 0.00 C ATOM 1116 CE LYS A 65 -11.531 6.419 -7.345 1.00 0.00 C ATOM 1117 NZ LYS A 65 -10.185 6.534 -6.719 1.00 0.00 N ATOM 0 H LYS A 65 -15.471 5.421 -8.418 1.00 0.00 H new ATOM 0 HA LYS A 65 -14.843 3.182 -9.923 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -13.741 3.930 -7.187 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -12.935 2.966 -8.408 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -13.003 4.983 -9.940 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -13.628 5.917 -8.595 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -11.228 4.362 -7.881 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -10.937 5.492 -9.189 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -11.780 7.355 -7.845 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -12.280 6.264 -6.569 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -10.183 7.324 -6.043 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -9.958 5.650 -6.220 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -9.473 6.708 -7.457 1.00 0.00 H new ATOM 1131 N GLU A 66 -16.286 2.470 -7.068 1.00 0.00 N ATOM 1132 CA GLU A 66 -16.897 1.396 -6.293 1.00 0.00 C ATOM 1133 C GLU A 66 -17.941 0.653 -7.122 1.00 0.00 C ATOM 1134 O GLU A 66 -18.043 -0.571 -7.060 1.00 0.00 O ATOM 1135 CB GLU A 66 -17.542 1.955 -5.024 1.00 0.00 C ATOM 1136 CG GLU A 66 -16.822 1.553 -3.747 1.00 0.00 C ATOM 1137 CD GLU A 66 -17.631 1.855 -2.501 1.00 0.00 C ATOM 1138 OE1 GLU A 66 -18.877 1.797 -2.575 1.00 0.00 O ATOM 1139 OE2 GLU A 66 -17.020 2.150 -1.453 1.00 0.00 O ATOM 0 H GLU A 66 -16.464 3.406 -6.705 1.00 0.00 H new ATOM 0 HA GLU A 66 -16.112 0.693 -6.013 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -17.569 3.043 -5.089 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -18.576 1.613 -4.971 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -16.598 0.487 -3.781 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -15.868 2.077 -3.692 1.00 0.00 H new ATOM 1146 N ALA A 67 -18.716 1.405 -7.898 1.00 0.00 N ATOM 1147 CA ALA A 67 -19.752 0.819 -8.740 1.00 0.00 C ATOM 1148 C ALA A 67 -19.142 -0.056 -9.830 1.00 0.00 C ATOM 1149 O ALA A 67 -19.506 -1.222 -9.980 1.00 0.00 O ATOM 1150 CB ALA A 67 -20.611 1.913 -9.357 1.00 0.00 C ATOM 0 H ALA A 67 -18.646 2.421 -7.961 1.00 0.00 H new ATOM 0 HA ALA A 67 -20.382 0.188 -8.114 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -21.381 1.462 -9.983 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -21.083 2.495 -8.565 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -19.986 2.567 -9.965 1.00 0.00 H new ATOM 1156 N VAL A 68 -18.213 0.515 -10.591 1.00 0.00 N ATOM 1157 CA VAL A 68 -17.553 -0.213 -11.668 1.00 0.00 C ATOM 1158 C VAL A 68 -16.884 -1.479 -11.145 1.00 0.00 C ATOM 1159 O VAL A 68 -17.004 -2.549 -11.741 1.00 0.00 O ATOM 1160 CB VAL A 68 -16.497 0.660 -12.371 1.00 0.00 C ATOM 1161 CG1 VAL A 68 -15.777 -0.136 -13.448 1.00 0.00 C ATOM 1162 CG2 VAL A 68 -17.142 1.906 -12.958 1.00 0.00 C ATOM 0 H VAL A 68 -17.901 1.480 -10.481 1.00 0.00 H new ATOM 0 HA VAL A 68 -18.326 -0.484 -12.387 1.00 0.00 H new ATOM 0 HB VAL A 68 -15.760 0.974 -11.632 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -15.035 0.497 -13.934 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -15.281 -0.995 -12.995 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -16.498 -0.482 -14.188 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -16.381 2.512 -13.451 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -17.901 1.615 -13.684 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -17.606 2.486 -12.160 1.00 0.00 H new ATOM 1172 N ALA A 69 -16.178 -1.350 -10.026 1.00 0.00 N ATOM 1173 CA ALA A 69 -15.492 -2.485 -9.421 1.00 0.00 C ATOM 1174 C ALA A 69 -16.487 -3.479 -8.832 1.00 0.00 C ATOM 1175 O ALA A 69 -16.210 -4.676 -8.750 1.00 0.00 O ATOM 1176 CB ALA A 69 -14.525 -2.005 -8.348 1.00 0.00 C ATOM 0 H ALA A 69 -16.066 -0.471 -9.521 1.00 0.00 H new ATOM 0 HA ALA A 69 -14.929 -2.996 -10.202 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -14.019 -2.862 -7.904 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -13.786 -1.340 -8.795 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -15.076 -1.469 -7.575 1.00 0.00 H new ATOM 1182 N LYS A 70 -17.647 -2.976 -8.423 1.00 0.00 N ATOM 1183 CA LYS A 70 -18.685 -3.819 -7.842 1.00 0.00 C ATOM 1184 C LYS A 70 -19.198 -4.830 -8.862 1.00 0.00 C ATOM 1185 O LYS A 70 -19.267 -6.027 -8.583 1.00 0.00 O ATOM 1186 CB LYS A 70 -19.843 -2.959 -7.332 1.00 0.00 C ATOM 1187 CG LYS A 70 -21.051 -3.767 -6.889 1.00 0.00 C ATOM 1188 CD LYS A 70 -21.853 -3.033 -5.828 1.00 0.00 C ATOM 1189 CE LYS A 70 -23.025 -2.278 -6.437 1.00 0.00 C ATOM 1190 NZ LYS A 70 -23.469 -1.150 -5.572 1.00 0.00 N ATOM 0 H LYS A 70 -17.892 -1.988 -8.483 1.00 0.00 H new ATOM 0 HA LYS A 70 -18.250 -4.364 -7.004 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -19.494 -2.354 -6.495 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -20.147 -2.269 -8.119 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -21.687 -3.974 -7.750 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -20.722 -4.730 -6.497 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -22.222 -3.746 -5.091 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -21.205 -2.335 -5.299 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -22.740 -1.894 -7.416 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -23.857 -2.965 -6.594 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -24.269 -0.661 -6.022 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -23.765 -1.519 -4.646 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -22.683 -0.481 -5.443 1.00 0.00 H new ATOM 1204 N ILE A 71 -19.557 -4.341 -10.044 1.00 0.00 N ATOM 1205 CA ILE A 71 -20.062 -5.202 -11.106 1.00 0.00 C ATOM 1206 C ILE A 71 -18.968 -6.126 -11.631 1.00 0.00 C ATOM 1207 O ILE A 71 -19.151 -7.341 -11.709 1.00 0.00 O ATOM 1208 CB ILE A 71 -20.629 -4.379 -12.278 1.00 0.00 C ATOM 1209 CG1 ILE A 71 -21.475 -3.218 -11.751 1.00 0.00 C ATOM 1210 CG2 ILE A 71 -21.451 -5.266 -13.199 1.00 0.00 C ATOM 1211 CD1 ILE A 71 -22.571 -3.651 -10.802 1.00 0.00 C ATOM 0 H ILE A 71 -19.507 -3.352 -10.290 1.00 0.00 H new ATOM 0 HA ILE A 71 -20.863 -5.800 -10.672 1.00 0.00 H new ATOM 0 HB ILE A 71 -19.798 -3.968 -12.850 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -20.825 -2.507 -11.242 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -21.923 -2.693 -12.595 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -21.845 -4.670 -14.022 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -20.820 -6.061 -13.596 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -22.278 -5.704 -12.640 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -23.130 -2.777 -10.469 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -23.244 -4.339 -11.313 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -22.129 -4.150 -9.939 1.00 0.00 H new ATOM 1223 N VAL A 72 -17.829 -5.542 -11.989 1.00 0.00 N ATOM 1224 CA VAL A 72 -16.703 -6.313 -12.504 1.00 0.00 C ATOM 1225 C VAL A 72 -16.326 -7.440 -11.549 1.00 0.00 C ATOM 1226 O VAL A 72 -16.010 -8.550 -11.976 1.00 0.00 O ATOM 1227 CB VAL A 72 -15.471 -5.419 -12.737 1.00 0.00 C ATOM 1228 CG1 VAL A 72 -14.269 -6.260 -13.138 1.00 0.00 C ATOM 1229 CG2 VAL A 72 -15.770 -4.365 -13.793 1.00 0.00 C ATOM 0 H VAL A 72 -17.661 -4.537 -11.932 1.00 0.00 H new ATOM 0 HA VAL A 72 -17.020 -6.738 -13.456 1.00 0.00 H new ATOM 0 HB VAL A 72 -15.232 -4.909 -11.804 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -13.408 -5.611 -13.298 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -14.043 -6.973 -12.345 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -14.493 -6.799 -14.058 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -14.889 -3.742 -13.945 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -16.035 -4.854 -14.730 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -16.601 -3.743 -13.461 1.00 0.00 H new ATOM 1239 N ASP A 73 -16.362 -7.147 -10.253 1.00 0.00 N ATOM 1240 CA ASP A 73 -16.025 -8.136 -9.236 1.00 0.00 C ATOM 1241 C ASP A 73 -17.057 -9.259 -9.208 1.00 0.00 C ATOM 1242 O ASP A 73 -16.705 -10.438 -9.161 1.00 0.00 O ATOM 1243 CB ASP A 73 -15.936 -7.474 -7.860 1.00 0.00 C ATOM 1244 CG ASP A 73 -14.613 -6.767 -7.643 1.00 0.00 C ATOM 1245 OD1 ASP A 73 -13.950 -6.427 -8.645 1.00 0.00 O ATOM 1246 OD2 ASP A 73 -14.240 -6.553 -6.470 1.00 0.00 O ATOM 0 H ASP A 73 -16.621 -6.233 -9.883 1.00 0.00 H new ATOM 0 HA ASP A 73 -15.055 -8.564 -9.488 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -16.750 -6.757 -7.751 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -16.072 -8.230 -7.087 1.00 0.00 H new ATOM 1251 N ASP A 74 -18.331 -8.886 -9.237 1.00 0.00 N ATOM 1252 CA ASP A 74 -19.415 -9.862 -9.215 1.00 0.00 C ATOM 1253 C ASP A 74 -19.303 -10.825 -10.393 1.00 0.00 C ATOM 1254 O ASP A 74 -19.542 -12.025 -10.254 1.00 0.00 O ATOM 1255 CB ASP A 74 -20.769 -9.152 -9.248 1.00 0.00 C ATOM 1256 CG ASP A 74 -21.254 -8.767 -7.864 1.00 0.00 C ATOM 1257 OD1 ASP A 74 -20.415 -8.363 -7.033 1.00 0.00 O ATOM 1258 OD2 ASP A 74 -22.473 -8.871 -7.612 1.00 0.00 O ATOM 0 H ASP A 74 -18.639 -7.914 -9.276 1.00 0.00 H new ATOM 0 HA ASP A 74 -19.336 -10.435 -8.291 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -20.692 -8.257 -9.865 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -21.506 -9.802 -9.720 1.00 0.00 H new ATOM 1263 N THR A 75 -18.938 -10.291 -11.555 1.00 0.00 N ATOM 1264 CA THR A 75 -18.796 -11.102 -12.758 1.00 0.00 C ATOM 1265 C THR A 75 -17.620 -12.064 -12.637 1.00 0.00 C ATOM 1266 O THR A 75 -17.733 -13.243 -12.972 1.00 0.00 O ATOM 1267 CB THR A 75 -18.600 -10.223 -14.007 1.00 0.00 C ATOM 1268 OG1 THR A 75 -18.793 -8.845 -13.673 1.00 0.00 O ATOM 1269 CG2 THR A 75 -19.570 -10.624 -15.108 1.00 0.00 C ATOM 0 H THR A 75 -18.735 -9.300 -11.688 1.00 0.00 H new ATOM 0 HA THR A 75 -19.718 -11.673 -12.866 1.00 0.00 H new ATOM 0 HB THR A 75 -17.582 -10.368 -14.370 1.00 0.00 H new ATOM 0 HG1 THR A 75 -19.161 -8.369 -14.447 1.00 0.00 H new ATOM 0 HG21 THR A 75 -19.413 -9.989 -15.980 1.00 0.00 H new ATOM 0 HG22 THR A 75 -19.400 -11.665 -15.381 1.00 0.00 H new ATOM 0 HG23 THR A 75 -20.593 -10.505 -14.752 1.00 0.00 H new ATOM 1277 N TYR A 76 -16.492 -11.554 -12.155 1.00 0.00 N ATOM 1278 CA TYR A 76 -15.294 -12.369 -11.991 1.00 0.00 C ATOM 1279 C TYR A 76 -15.515 -13.460 -10.949 1.00 0.00 C ATOM 1280 O TYR A 76 -14.939 -14.544 -11.037 1.00 0.00 O ATOM 1281 CB TYR A 76 -14.108 -11.493 -11.585 1.00 0.00 C ATOM 1282 CG TYR A 76 -12.772 -12.191 -11.701 1.00 0.00 C ATOM 1283 CD1 TYR A 76 -12.398 -12.828 -12.878 1.00 0.00 C ATOM 1284 CD2 TYR A 76 -11.883 -12.214 -10.633 1.00 0.00 C ATOM 1285 CE1 TYR A 76 -11.179 -13.468 -12.988 1.00 0.00 C ATOM 1286 CE2 TYR A 76 -10.661 -12.850 -10.735 1.00 0.00 C ATOM 1287 CZ TYR A 76 -10.313 -13.476 -11.914 1.00 0.00 C ATOM 1288 OH TYR A 76 -9.098 -14.111 -12.019 1.00 0.00 O ATOM 0 H TYR A 76 -16.382 -10.580 -11.871 1.00 0.00 H new ATOM 0 HA TYR A 76 -15.076 -12.845 -12.947 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -14.097 -10.599 -12.209 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -14.247 -11.162 -10.556 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -13.072 -12.823 -13.722 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -12.152 -11.726 -9.708 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -10.905 -13.960 -13.910 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -9.981 -12.857 -9.896 1.00 0.00 H new ATOM 0 HH TYR A 76 -9.075 -14.876 -11.407 1.00 0.00 H new ATOM 1298 N ARG A 77 -16.355 -13.165 -9.962 1.00 0.00 N ATOM 1299 CA ARG A 77 -16.654 -14.120 -8.902 1.00 0.00 C ATOM 1300 C ARG A 77 -17.554 -15.240 -9.415 1.00 0.00 C ATOM 1301 O ARG A 77 -17.307 -16.418 -9.158 1.00 0.00 O ATOM 1302 CB ARG A 77 -17.324 -13.412 -7.723 1.00 0.00 C ATOM 1303 CG ARG A 77 -16.569 -13.562 -6.412 1.00 0.00 C ATOM 1304 CD ARG A 77 -15.990 -12.235 -5.948 1.00 0.00 C ATOM 1305 NE ARG A 77 -15.031 -11.692 -6.906 1.00 0.00 N ATOM 1306 CZ ARG A 77 -14.349 -10.569 -6.708 1.00 0.00 C ATOM 1307 NH1 ARG A 77 -14.521 -9.874 -5.591 1.00 0.00 N ATOM 1308 NH2 ARG A 77 -13.494 -10.138 -7.627 1.00 0.00 N ATOM 0 H ARG A 77 -16.840 -12.272 -9.875 1.00 0.00 H new ATOM 0 HA ARG A 77 -15.714 -14.559 -8.568 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -17.423 -12.352 -7.956 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -18.332 -13.807 -7.599 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -17.239 -13.955 -5.648 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -15.765 -14.288 -6.535 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -16.798 -11.519 -5.799 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -15.502 -12.370 -4.983 1.00 0.00 H new ATOM 0 HE ARG A 77 -14.876 -12.203 -7.775 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -15.178 -10.202 -4.883 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -13.997 -9.012 -5.441 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -13.359 -10.669 -8.487 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -12.972 -9.276 -7.473 1.00 0.00 H new ATOM 1322 N LYS A 78 -18.600 -14.864 -10.143 1.00 0.00 N ATOM 1323 CA LYS A 78 -19.538 -15.834 -10.695 1.00 0.00 C ATOM 1324 C LYS A 78 -18.865 -16.698 -11.757 1.00 0.00 C ATOM 1325 O LYS A 78 -19.130 -17.896 -11.855 1.00 0.00 O ATOM 1326 CB LYS A 78 -20.750 -15.119 -11.296 1.00 0.00 C ATOM 1327 CG LYS A 78 -21.752 -16.059 -11.943 1.00 0.00 C ATOM 1328 CD LYS A 78 -21.605 -16.076 -13.455 1.00 0.00 C ATOM 1329 CE LYS A 78 -22.716 -15.287 -14.131 1.00 0.00 C ATOM 1330 NZ LYS A 78 -23.695 -16.180 -14.811 1.00 0.00 N ATOM 0 H LYS A 78 -18.820 -13.893 -10.365 1.00 0.00 H new ATOM 0 HA LYS A 78 -19.872 -16.481 -9.884 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -21.251 -14.551 -10.513 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -20.405 -14.401 -12.040 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -21.612 -17.067 -11.552 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -22.764 -15.752 -11.678 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -20.638 -15.656 -13.733 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -21.620 -17.106 -13.812 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -23.233 -14.679 -13.389 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -22.283 -14.601 -14.859 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -24.436 -15.605 -15.259 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -23.206 -16.742 -15.537 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -24.127 -16.818 -14.112 1.00 0.00 H new ATOM 1344 N MET A 79 -17.994 -16.082 -12.549 1.00 0.00 N ATOM 1345 CA MET A 79 -17.281 -16.796 -13.602 1.00 0.00 C ATOM 1346 C MET A 79 -16.143 -17.629 -13.021 1.00 0.00 C ATOM 1347 O MET A 79 -15.938 -18.776 -13.415 1.00 0.00 O ATOM 1348 CB MET A 79 -16.732 -15.810 -14.635 1.00 0.00 C ATOM 1349 CG MET A 79 -15.840 -16.459 -15.681 1.00 0.00 C ATOM 1350 SD MET A 79 -16.447 -16.212 -17.361 1.00 0.00 S ATOM 1351 CE MET A 79 -15.882 -14.543 -17.682 1.00 0.00 C ATOM 0 H MET A 79 -17.765 -15.090 -12.482 1.00 0.00 H new ATOM 0 HA MET A 79 -17.986 -17.468 -14.091 1.00 0.00 H new ATOM 0 HB2 MET A 79 -17.566 -15.319 -15.135 1.00 0.00 H new ATOM 0 HB3 MET A 79 -16.167 -15.033 -14.119 1.00 0.00 H new ATOM 0 HG2 MET A 79 -14.833 -16.050 -15.599 1.00 0.00 H new ATOM 0 HG3 MET A 79 -15.767 -17.528 -15.478 1.00 0.00 H new ATOM 0 HE1 MET A 79 -15.804 -14.386 -18.758 1.00 0.00 H new ATOM 0 HE2 MET A 79 -16.593 -13.831 -17.262 1.00 0.00 H new ATOM 0 HE3 MET A 79 -14.905 -14.395 -17.222 1.00 0.00 H new ATOM 1361 N GLN A 80 -15.407 -17.043 -12.082 1.00 0.00 N ATOM 1362 CA GLN A 80 -14.289 -17.731 -11.448 1.00 0.00 C ATOM 1363 C GLN A 80 -14.387 -17.643 -9.929 1.00 0.00 C ATOM 1364 O GLN A 80 -13.593 -16.956 -9.285 1.00 0.00 O ATOM 1365 CB GLN A 80 -12.962 -17.136 -11.921 1.00 0.00 C ATOM 1366 CG GLN A 80 -11.797 -18.111 -11.847 1.00 0.00 C ATOM 1367 CD GLN A 80 -12.002 -19.332 -12.722 1.00 0.00 C ATOM 1368 OE1 GLN A 80 -12.105 -20.455 -12.227 1.00 0.00 O ATOM 1369 NE2 GLN A 80 -12.061 -19.119 -14.032 1.00 0.00 N ATOM 0 H GLN A 80 -15.565 -16.094 -11.744 1.00 0.00 H new ATOM 0 HA GLN A 80 -14.331 -18.781 -11.736 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -13.073 -16.793 -12.950 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -12.730 -16.259 -11.316 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -10.882 -17.602 -12.149 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -11.659 -18.428 -10.813 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -11.971 -18.172 -14.399 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -12.196 -19.903 -14.671 1.00 0.00 H new ATOM 1378 N ILE A 81 -15.364 -18.342 -9.362 1.00 0.00 N ATOM 1379 CA ILE A 81 -15.565 -18.343 -7.918 1.00 0.00 C ATOM 1380 C ILE A 81 -14.264 -18.648 -7.183 1.00 0.00 C ATOM 1381 O ILE A 81 -14.045 -18.176 -6.068 1.00 0.00 O ATOM 1382 CB ILE A 81 -16.632 -19.371 -7.498 1.00 0.00 C ATOM 1383 CG1 ILE A 81 -17.957 -19.082 -8.207 1.00 0.00 C ATOM 1384 CG2 ILE A 81 -16.818 -19.354 -5.988 1.00 0.00 C ATOM 1385 CD1 ILE A 81 -19.041 -20.090 -7.897 1.00 0.00 C ATOM 0 H ILE A 81 -16.029 -18.915 -9.881 1.00 0.00 H new ATOM 0 HA ILE A 81 -15.908 -17.345 -7.646 1.00 0.00 H new ATOM 0 HB ILE A 81 -16.294 -20.365 -7.792 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -18.303 -18.089 -7.921 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -17.787 -19.063 -9.283 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -17.575 -20.086 -5.706 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -15.874 -19.603 -5.502 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -17.138 -18.361 -5.672 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -19.951 -19.822 -8.434 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -18.715 -21.082 -8.208 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -19.239 -20.093 -6.825 1.00 0.00 H new ATOM 1397 N GLN A 82 -13.404 -19.439 -7.816 1.00 0.00 N ATOM 1398 CA GLN A 82 -12.124 -19.807 -7.222 1.00 0.00 C ATOM 1399 C GLN A 82 -11.017 -18.868 -7.692 1.00 0.00 C ATOM 1400 O GLN A 82 -10.384 -19.105 -8.721 1.00 0.00 O ATOM 1401 CB GLN A 82 -11.769 -21.251 -7.578 1.00 0.00 C ATOM 1402 CG GLN A 82 -10.402 -21.683 -7.073 1.00 0.00 C ATOM 1403 CD GLN A 82 -10.361 -21.846 -5.566 1.00 0.00 C ATOM 1404 OE1 GLN A 82 -10.348 -20.728 -4.850 1.00 0.00 O flip ATOM 1405 NE2 GLN A 82 -10.340 -22.965 -5.051 1.00 0.00 N flip ATOM 0 H GLN A 82 -13.570 -19.837 -8.740 1.00 0.00 H new ATOM 0 HA GLN A 82 -12.215 -19.719 -6.139 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -12.527 -21.916 -7.163 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -11.801 -21.368 -8.661 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -10.126 -22.626 -7.544 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -9.658 -20.946 -7.375 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -10.351 -23.798 -5.640 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -10.311 -23.059 -4.036 1.00 0.00 H new ATOM 1414 N CYS A 83 -10.790 -17.803 -6.931 1.00 0.00 N ATOM 1415 CA CYS A 83 -9.759 -16.828 -7.270 1.00 0.00 C ATOM 1416 C CYS A 83 -9.637 -15.766 -6.182 1.00 0.00 C ATOM 1417 O CYS A 83 -8.689 -15.774 -5.397 1.00 0.00 O ATOM 1418 CB CYS A 83 -10.076 -16.166 -8.612 1.00 0.00 C ATOM 1419 SG CYS A 83 -8.962 -16.647 -9.952 1.00 0.00 S ATOM 0 H CYS A 83 -11.305 -17.593 -6.076 1.00 0.00 H new ATOM 0 HA CYS A 83 -8.807 -17.354 -7.348 1.00 0.00 H new ATOM 0 HB2 CYS A 83 -11.098 -16.416 -8.896 1.00 0.00 H new ATOM 0 HB3 CYS A 83 -10.035 -15.084 -8.490 1.00 0.00 H new ATOM 0 HG CYS A 83 -9.001 -17.937 -10.106 1.00 0.00 H new ATOM 1425 N ALA A 84 -10.601 -14.853 -6.143 1.00 0.00 N ATOM 1426 CA ALA A 84 -10.602 -13.784 -5.151 1.00 0.00 C ATOM 1427 C ALA A 84 -9.378 -12.889 -5.308 1.00 0.00 C ATOM 1428 O ALA A 84 -8.420 -12.964 -4.538 1.00 0.00 O ATOM 1429 CB ALA A 84 -10.655 -14.368 -3.747 1.00 0.00 C ATOM 0 H ALA A 84 -11.392 -14.832 -6.787 1.00 0.00 H new ATOM 0 HA ALA A 84 -11.490 -13.172 -5.312 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -10.655 -13.559 -3.016 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -11.563 -14.960 -3.633 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -9.785 -15.004 -3.584 1.00 0.00 H new ATOM 1435 N PRO A 85 -9.407 -12.020 -6.330 1.00 0.00 N ATOM 1436 CA PRO A 85 -8.307 -11.093 -6.612 1.00 0.00 C ATOM 1437 C PRO A 85 -8.185 -9.999 -5.556 1.00 0.00 C ATOM 1438 O PRO A 85 -7.222 -9.232 -5.552 1.00 0.00 O ATOM 1439 CB PRO A 85 -8.689 -10.490 -7.966 1.00 0.00 C ATOM 1440 CG PRO A 85 -10.173 -10.613 -8.029 1.00 0.00 C ATOM 1441 CD PRO A 85 -10.516 -11.875 -7.287 1.00 0.00 C ATOM 0 HA PRO A 85 -7.340 -11.596 -6.612 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -8.374 -9.449 -8.039 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -8.212 -11.025 -8.787 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -10.656 -9.749 -7.573 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -10.517 -10.662 -9.062 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -11.477 -11.794 -6.779 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -10.582 -12.731 -7.959 1.00 0.00 H new ATOM 1449 N ASP A 86 -9.167 -9.933 -4.663 1.00 0.00 N ATOM 1450 CA ASP A 86 -9.169 -8.934 -3.602 1.00 0.00 C ATOM 1451 C ASP A 86 -9.082 -7.525 -4.181 1.00 0.00 C ATOM 1452 O ASP A 86 -8.344 -6.679 -3.675 1.00 0.00 O ATOM 1453 CB ASP A 86 -8.003 -9.176 -2.641 1.00 0.00 C ATOM 1454 CG ASP A 86 -8.126 -8.366 -1.366 1.00 0.00 C ATOM 1455 OD1 ASP A 86 -9.243 -7.895 -1.068 1.00 0.00 O ATOM 1456 OD2 ASP A 86 -7.104 -8.202 -0.666 1.00 0.00 O ATOM 0 H ASP A 86 -9.972 -10.560 -4.653 1.00 0.00 H new ATOM 0 HA ASP A 86 -10.107 -9.025 -3.054 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -7.956 -10.236 -2.391 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -7.067 -8.924 -3.139 1.00 0.00 H new ATOM 1461 N LEU A 87 -9.839 -7.281 -5.245 1.00 0.00 N ATOM 1462 CA LEU A 87 -9.847 -5.975 -5.895 1.00 0.00 C ATOM 1463 C LEU A 87 -8.475 -5.647 -6.475 1.00 0.00 C ATOM 1464 O LEU A 87 -8.039 -4.496 -6.452 1.00 0.00 O ATOM 1465 CB LEU A 87 -10.265 -4.891 -4.900 1.00 0.00 C ATOM 1466 CG LEU A 87 -11.413 -5.252 -3.957 1.00 0.00 C ATOM 1467 CD1 LEU A 87 -10.909 -5.386 -2.529 1.00 0.00 C ATOM 1468 CD2 LEU A 87 -12.519 -4.210 -4.039 1.00 0.00 C ATOM 0 H LEU A 87 -10.455 -7.970 -5.676 1.00 0.00 H new ATOM 0 HA LEU A 87 -10.568 -6.007 -6.712 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -9.397 -4.625 -4.297 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -10.549 -4.001 -5.461 1.00 0.00 H new ATOM 0 HG LEU A 87 -11.823 -6.213 -4.267 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -11.740 -5.643 -1.872 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -10.153 -6.170 -2.482 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -10.472 -4.441 -2.207 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -13.328 -4.484 -3.361 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -12.122 -3.235 -3.756 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -12.901 -4.164 -5.059 1.00 0.00 H new ATOM 1480 N ALA A 88 -7.799 -6.666 -6.996 1.00 0.00 N ATOM 1481 CA ALA A 88 -6.479 -6.485 -7.586 1.00 0.00 C ATOM 1482 C ALA A 88 -5.514 -5.851 -6.590 1.00 0.00 C ATOM 1483 O ALA A 88 -4.538 -5.208 -6.977 1.00 0.00 O ATOM 1484 CB ALA A 88 -6.575 -5.635 -8.845 1.00 0.00 C ATOM 0 H ALA A 88 -8.144 -7.625 -7.021 1.00 0.00 H new ATOM 0 HA ALA A 88 -6.090 -7.468 -7.853 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -5.581 -5.508 -9.275 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -7.223 -6.129 -9.569 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -6.989 -4.658 -8.594 1.00 0.00 H new ATOM 1490 N THR A 89 -5.794 -6.036 -5.303 1.00 0.00 N ATOM 1491 CA THR A 89 -4.952 -5.480 -4.251 1.00 0.00 C ATOM 1492 C THR A 89 -4.982 -3.956 -4.270 1.00 0.00 C ATOM 1493 O THR A 89 -4.384 -3.325 -5.141 1.00 0.00 O ATOM 1494 CB THR A 89 -3.493 -5.955 -4.389 1.00 0.00 C ATOM 1495 OG1 THR A 89 -3.435 -7.129 -5.207 1.00 0.00 O ATOM 1496 CG2 THR A 89 -2.889 -6.252 -3.025 1.00 0.00 C ATOM 0 H THR A 89 -6.597 -6.566 -4.965 1.00 0.00 H new ATOM 0 HA THR A 89 -5.355 -5.837 -3.303 1.00 0.00 H new ATOM 0 HB THR A 89 -2.918 -5.157 -4.858 1.00 0.00 H new ATOM 0 HG1 THR A 89 -2.504 -7.423 -5.291 1.00 0.00 H new ATOM 0 HG21 THR A 89 -1.859 -6.586 -3.148 1.00 0.00 H new ATOM 0 HG22 THR A 89 -2.908 -5.349 -2.414 1.00 0.00 H new ATOM 0 HG23 THR A 89 -3.467 -7.034 -2.533 1.00 0.00 H new ATOM 1504 N ARG A 90 -5.682 -3.371 -3.303 1.00 0.00 N ATOM 1505 CA ARG A 90 -5.790 -1.920 -3.209 1.00 0.00 C ATOM 1506 C ARG A 90 -4.726 -1.355 -2.274 1.00 0.00 C ATOM 1507 O ARG A 90 -4.872 -0.254 -1.744 1.00 0.00 O ATOM 1508 CB ARG A 90 -7.182 -1.522 -2.714 1.00 0.00 C ATOM 1509 CG ARG A 90 -8.183 -1.287 -3.834 1.00 0.00 C ATOM 1510 CD ARG A 90 -9.560 -0.947 -3.288 1.00 0.00 C ATOM 1511 NE ARG A 90 -10.580 -0.948 -4.334 1.00 0.00 N ATOM 1512 CZ ARG A 90 -11.877 -0.788 -4.096 1.00 0.00 C ATOM 1513 NH1 ARG A 90 -12.310 -0.615 -2.856 1.00 0.00 N ATOM 1514 NH2 ARG A 90 -12.743 -0.801 -5.101 1.00 0.00 N ATOM 0 H ARG A 90 -6.182 -3.879 -2.574 1.00 0.00 H new ATOM 0 HA ARG A 90 -5.633 -1.504 -4.204 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -7.562 -2.304 -2.057 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -7.100 -0.615 -2.115 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -7.833 -0.476 -4.472 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -8.248 -2.178 -4.458 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -9.832 -1.667 -2.516 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -9.529 0.033 -2.813 1.00 0.00 H new ATOM 0 HE ARG A 90 -10.280 -1.079 -5.300 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -11.647 -0.604 -2.081 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -13.307 -0.492 -2.676 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -12.413 -0.934 -6.057 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -13.739 -0.678 -4.918 1.00 0.00 H new ATOM 1528 N SER A 91 -3.654 -2.117 -2.076 1.00 0.00 N ATOM 1529 CA SER A 91 -2.567 -1.694 -1.201 1.00 0.00 C ATOM 1530 C SER A 91 -1.878 -0.450 -1.754 1.00 0.00 C ATOM 1531 O SER A 91 -1.290 0.332 -1.007 1.00 0.00 O ATOM 1532 CB SER A 91 -1.549 -2.824 -1.036 1.00 0.00 C ATOM 1533 OG SER A 91 -0.466 -2.418 -0.217 1.00 0.00 O ATOM 0 H SER A 91 -3.516 -3.030 -2.510 1.00 0.00 H new ATOM 0 HA SER A 91 -2.991 -1.451 -0.227 1.00 0.00 H new ATOM 0 HB2 SER A 91 -2.035 -3.695 -0.596 1.00 0.00 H new ATOM 0 HB3 SER A 91 -1.176 -3.127 -2.014 1.00 0.00 H new ATOM 0 HG SER A 91 0.170 -3.158 -0.125 1.00 0.00 H new ATOM 1539 N HIS A 92 -1.954 -0.274 -3.070 1.00 0.00 N ATOM 1540 CA HIS A 92 -1.338 0.875 -3.724 1.00 0.00 C ATOM 1541 C HIS A 92 -1.902 2.181 -3.173 1.00 0.00 C ATOM 1542 O HIS A 92 -1.243 2.875 -2.399 1.00 0.00 O ATOM 1543 CB HIS A 92 -1.561 0.807 -5.236 1.00 0.00 C ATOM 1544 CG HIS A 92 -0.933 -0.391 -5.880 1.00 0.00 C ATOM 1545 ND1 HIS A 92 0.052 -1.142 -5.274 1.00 0.00 N ATOM 1546 CD2 HIS A 92 -1.156 -0.967 -7.085 1.00 0.00 C ATOM 1547 CE1 HIS A 92 0.409 -2.127 -6.079 1.00 0.00 C ATOM 1548 NE2 HIS A 92 -0.310 -2.044 -7.184 1.00 0.00 N ATOM 0 H HIS A 92 -2.436 -0.912 -3.704 1.00 0.00 H new ATOM 0 HA HIS A 92 -0.268 0.848 -3.520 1.00 0.00 H new ATOM 0 HB2 HIS A 92 -2.632 0.798 -5.437 1.00 0.00 H new ATOM 0 HB3 HIS A 92 -1.158 1.710 -5.696 1.00 0.00 H new ATOM 0 HD2 HIS A 92 -1.867 -0.640 -7.830 1.00 0.00 H new ATOM 0 HE1 HIS A 92 1.161 -2.873 -5.869 1.00 0.00 H new ATOM 0 HE2 HIS A 92 -0.247 -2.677 -7.981 1.00 0.00 H new ATOM 1556 N SER A 93 -3.124 2.510 -3.579 1.00 0.00 N ATOM 1557 CA SER A 93 -3.775 3.735 -3.129 1.00 0.00 C ATOM 1558 C SER A 93 -5.167 3.867 -3.740 1.00 0.00 C ATOM 1559 O SER A 93 -5.318 4.306 -4.879 1.00 0.00 O ATOM 1560 CB SER A 93 -2.926 4.953 -3.499 1.00 0.00 C ATOM 1561 OG SER A 93 -2.140 5.379 -2.399 1.00 0.00 O ATOM 0 H SER A 93 -3.683 1.946 -4.219 1.00 0.00 H new ATOM 0 HA SER A 93 -3.876 3.686 -2.045 1.00 0.00 H new ATOM 0 HB2 SER A 93 -2.278 4.707 -4.340 1.00 0.00 H new ATOM 0 HB3 SER A 93 -3.574 5.767 -3.824 1.00 0.00 H new ATOM 0 HG SER A 93 -1.598 4.630 -2.075 1.00 0.00 H new ATOM 1567 N GLY A 94 -6.182 3.482 -2.973 1.00 0.00 N ATOM 1568 CA GLY A 94 -7.548 3.564 -3.455 1.00 0.00 C ATOM 1569 C GLY A 94 -8.443 4.363 -2.528 1.00 0.00 C ATOM 1570 O GLY A 94 -9.281 5.142 -2.982 1.00 0.00 O ATOM 0 H GLY A 94 -6.083 3.115 -2.027 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -7.554 4.021 -4.444 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -7.952 2.558 -3.567 1.00 0.00 H new ATOM 1574 N SER A 95 -8.266 4.169 -1.225 1.00 0.00 N ATOM 1575 CA SER A 95 -9.068 4.874 -0.231 1.00 0.00 C ATOM 1576 C SER A 95 -10.508 4.369 -0.237 1.00 0.00 C ATOM 1577 O SER A 95 -11.386 4.957 0.394 1.00 0.00 O ATOM 1578 CB SER A 95 -9.043 6.380 -0.500 1.00 0.00 C ATOM 1579 OG SER A 95 -7.813 6.773 -1.084 1.00 0.00 O ATOM 0 H SER A 95 -7.575 3.530 -0.833 1.00 0.00 H new ATOM 0 HA SER A 95 -8.637 4.680 0.751 1.00 0.00 H new ATOM 0 HB2 SER A 95 -9.866 6.648 -1.163 1.00 0.00 H new ATOM 0 HB3 SER A 95 -9.196 6.922 0.433 1.00 0.00 H new ATOM 0 HG SER A 95 -7.823 7.739 -1.248 1.00 0.00 H new ATOM 1585 N ASP A 96 -10.741 3.276 -0.955 1.00 0.00 N ATOM 1586 CA ASP A 96 -12.074 2.690 -1.044 1.00 0.00 C ATOM 1587 C ASP A 96 -12.119 1.336 -0.344 1.00 0.00 C ATOM 1588 O ASP A 96 -13.172 0.703 -0.260 1.00 0.00 O ATOM 1589 CB ASP A 96 -12.490 2.535 -2.508 1.00 0.00 C ATOM 1590 CG ASP A 96 -12.768 3.868 -3.175 1.00 0.00 C ATOM 1591 OD1 ASP A 96 -12.999 4.857 -2.449 1.00 0.00 O ATOM 1592 OD2 ASP A 96 -12.754 3.922 -4.423 1.00 0.00 O ATOM 0 H ASP A 96 -10.025 2.778 -1.484 1.00 0.00 H new ATOM 0 HA ASP A 96 -12.773 3.361 -0.545 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -11.702 2.016 -3.054 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -13.381 1.910 -2.565 1.00 0.00 H new ATOM 1597 N PHE A 97 -10.970 0.896 0.158 1.00 0.00 N ATOM 1598 CA PHE A 97 -10.878 -0.385 0.850 1.00 0.00 C ATOM 1599 C PHE A 97 -11.399 -0.269 2.279 1.00 0.00 C ATOM 1600 O PHE A 97 -11.634 -1.275 2.949 1.00 0.00 O ATOM 1601 CB PHE A 97 -9.430 -0.880 0.860 1.00 0.00 C ATOM 1602 CG PHE A 97 -8.460 0.118 1.424 1.00 0.00 C ATOM 1603 CD1 PHE A 97 -8.331 0.282 2.793 1.00 0.00 C ATOM 1604 CD2 PHE A 97 -7.675 0.891 0.584 1.00 0.00 C ATOM 1605 CE1 PHE A 97 -7.439 1.201 3.314 1.00 0.00 C ATOM 1606 CE2 PHE A 97 -6.781 1.811 1.099 1.00 0.00 C ATOM 1607 CZ PHE A 97 -6.662 1.965 2.466 1.00 0.00 C ATOM 0 H PHE A 97 -10.089 1.407 0.099 1.00 0.00 H new ATOM 0 HA PHE A 97 -11.497 -1.105 0.314 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -9.373 -1.800 1.442 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -9.132 -1.129 -0.159 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -8.934 -0.315 3.461 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -7.763 0.773 -0.486 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -7.350 1.321 4.384 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -6.176 2.409 0.433 1.00 0.00 H new ATOM 0 HZ PHE A 97 -5.963 2.681 2.871 1.00 0.00 H new ATOM 1617 N SER A 98 -11.575 0.965 2.740 1.00 0.00 N ATOM 1618 CA SER A 98 -12.063 1.213 4.092 1.00 0.00 C ATOM 1619 C SER A 98 -12.485 2.670 4.258 1.00 0.00 C ATOM 1620 O SER A 98 -12.176 3.307 5.264 1.00 0.00 O ATOM 1621 CB SER A 98 -10.985 0.863 5.119 1.00 0.00 C ATOM 1622 OG SER A 98 -10.958 -0.530 5.376 1.00 0.00 O ATOM 0 H SER A 98 -11.387 1.808 2.198 1.00 0.00 H new ATOM 0 HA SER A 98 -12.933 0.579 4.259 1.00 0.00 H new ATOM 0 HB2 SER A 98 -10.011 1.187 4.753 1.00 0.00 H new ATOM 0 HB3 SER A 98 -11.173 1.403 6.047 1.00 0.00 H new ATOM 0 HG SER A 98 -11.417 -1.005 4.652 1.00 0.00 H new ATOM 1628 N PHE A 99 -13.195 3.191 3.262 1.00 0.00 N ATOM 1629 CA PHE A 99 -13.660 4.573 3.295 1.00 0.00 C ATOM 1630 C PHE A 99 -14.795 4.740 4.301 1.00 0.00 C ATOM 1631 O PHE A 99 -15.966 4.797 3.926 1.00 0.00 O ATOM 1632 CB PHE A 99 -14.125 5.010 1.905 1.00 0.00 C ATOM 1633 CG PHE A 99 -14.045 6.494 1.686 1.00 0.00 C ATOM 1634 CD1 PHE A 99 -12.833 7.158 1.788 1.00 0.00 C ATOM 1635 CD2 PHE A 99 -15.181 7.224 1.377 1.00 0.00 C ATOM 1636 CE1 PHE A 99 -12.757 8.523 1.587 1.00 0.00 C ATOM 1637 CE2 PHE A 99 -15.111 8.590 1.174 1.00 0.00 C ATOM 1638 CZ PHE A 99 -13.897 9.240 1.278 1.00 0.00 C ATOM 0 H PHE A 99 -13.461 2.677 2.422 1.00 0.00 H new ATOM 0 HA PHE A 99 -12.827 5.204 3.606 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -13.518 4.506 1.152 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -15.154 4.684 1.755 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -11.938 6.603 2.027 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -16.133 6.720 1.294 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -11.807 9.029 1.671 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -16.004 9.148 0.934 1.00 0.00 H new ATOM 0 HZ PHE A 99 -13.839 10.307 1.118 1.00 0.00 H new ATOM 1648 N ARG A 100 -14.439 4.818 5.579 1.00 0.00 N ATOM 1649 CA ARG A 100 -15.427 4.977 6.639 1.00 0.00 C ATOM 1650 C ARG A 100 -14.868 5.819 7.782 1.00 0.00 C ATOM 1651 O ARG A 100 -14.265 5.307 8.725 1.00 0.00 O ATOM 1652 CB ARG A 100 -15.866 3.610 7.166 1.00 0.00 C ATOM 1653 CG ARG A 100 -16.549 2.744 6.120 1.00 0.00 C ATOM 1654 CD ARG A 100 -17.007 1.418 6.707 1.00 0.00 C ATOM 1655 NE ARG A 100 -18.398 1.124 6.373 1.00 0.00 N ATOM 1656 CZ ARG A 100 -19.435 1.674 6.994 1.00 0.00 C ATOM 1657 NH1 ARG A 100 -19.240 2.543 7.976 1.00 0.00 N ATOM 1658 NH2 ARG A 100 -20.672 1.355 6.633 1.00 0.00 N ATOM 0 H ARG A 100 -13.474 4.774 5.905 1.00 0.00 H new ATOM 0 HA ARG A 100 -16.292 5.492 6.220 1.00 0.00 H new ATOM 0 HB2 ARG A 100 -14.994 3.081 7.550 1.00 0.00 H new ATOM 0 HB3 ARG A 100 -16.546 3.755 8.005 1.00 0.00 H new ATOM 0 HG2 ARG A 100 -17.407 3.277 5.709 1.00 0.00 H new ATOM 0 HG3 ARG A 100 -15.862 2.560 5.294 1.00 0.00 H new ATOM 0 HD2 ARG A 100 -16.368 0.617 6.336 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -16.891 1.442 7.791 1.00 0.00 H new ATOM 0 HE ARG A 100 -18.583 0.460 5.621 1.00 0.00 H new ATOM 0 HH11 ARG A 100 -18.291 2.791 8.257 1.00 0.00 H new ATOM 0 HH12 ARG A 100 -20.039 2.964 8.451 1.00 0.00 H new ATOM 0 HH21 ARG A 100 -20.827 0.687 5.878 1.00 0.00 H new ATOM 0 HH22 ARG A 100 -21.468 1.778 7.111 1.00 0.00 H new ATOM 1672 N PRO A 101 -15.071 7.142 7.697 1.00 0.00 N ATOM 1673 CA PRO A 101 -14.595 8.083 8.715 1.00 0.00 C ATOM 1674 C PRO A 101 -15.358 7.952 10.028 1.00 0.00 C ATOM 1675 O PRO A 101 -16.154 7.029 10.204 1.00 0.00 O ATOM 1676 CB PRO A 101 -14.853 9.452 8.081 1.00 0.00 C ATOM 1677 CG PRO A 101 -15.967 9.221 7.120 1.00 0.00 C ATOM 1678 CD PRO A 101 -15.781 7.822 6.600 1.00 0.00 C ATOM 0 HA PRO A 101 -13.551 7.908 8.975 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -15.127 10.191 8.834 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -13.964 9.827 7.574 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -16.934 9.330 7.610 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -15.938 9.947 6.307 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -16.736 7.344 6.382 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -15.201 7.810 5.677 1.00 0.00 H new ATOM 1686 N ILE A 102 -15.111 8.879 10.947 1.00 0.00 N ATOM 1687 CA ILE A 102 -15.777 8.867 12.243 1.00 0.00 C ATOM 1688 C ILE A 102 -16.627 10.118 12.436 1.00 0.00 C ATOM 1689 O ILE A 102 -16.742 10.636 13.546 1.00 0.00 O ATOM 1690 CB ILE A 102 -14.761 8.767 13.397 1.00 0.00 C ATOM 1691 CG1 ILE A 102 -13.542 7.950 12.963 1.00 0.00 C ATOM 1692 CG2 ILE A 102 -15.413 8.147 14.624 1.00 0.00 C ATOM 1693 CD1 ILE A 102 -12.788 7.331 14.119 1.00 0.00 C ATOM 0 H ILE A 102 -14.454 9.648 10.818 1.00 0.00 H new ATOM 0 HA ILE A 102 -16.421 7.987 12.259 1.00 0.00 H new ATOM 0 HB ILE A 102 -14.427 9.772 13.656 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -13.867 7.160 12.286 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -12.865 8.593 12.401 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -14.683 8.083 15.431 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -16.252 8.766 14.942 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -15.772 7.147 14.379 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -11.937 6.767 13.738 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -12.433 8.118 14.785 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -13.450 6.662 14.669 1.00 0.00 H new ATOM 1705 N GLU A 103 -17.223 10.595 11.348 1.00 0.00 N ATOM 1706 CA GLU A 103 -18.065 11.785 11.399 1.00 0.00 C ATOM 1707 C GLU A 103 -17.253 13.008 11.815 1.00 0.00 C ATOM 1708 O GLU A 103 -17.794 13.965 12.368 1.00 0.00 O ATOM 1709 CB GLU A 103 -19.226 11.574 12.373 1.00 0.00 C ATOM 1710 CG GLU A 103 -20.582 11.942 11.793 1.00 0.00 C ATOM 1711 CD GLU A 103 -21.211 13.133 12.489 1.00 0.00 C ATOM 1712 OE1 GLU A 103 -21.913 12.925 13.501 1.00 0.00 O ATOM 1713 OE2 GLU A 103 -21.001 14.272 12.022 1.00 0.00 O ATOM 0 H GLU A 103 -17.139 10.177 10.422 1.00 0.00 H new ATOM 0 HA GLU A 103 -18.466 11.959 10.400 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -19.244 10.529 12.683 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -19.050 12.169 13.269 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -20.471 12.163 10.732 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -21.251 11.085 11.872 1.00 0.00 H new ATOM 1720 N GLU A 104 -15.952 12.968 11.545 1.00 0.00 N ATOM 1721 CA GLU A 104 -15.066 14.072 11.893 1.00 0.00 C ATOM 1722 C GLU A 104 -15.221 14.452 13.362 1.00 0.00 C ATOM 1723 O GLU A 104 -15.271 15.633 13.707 1.00 0.00 O ATOM 1724 CB GLU A 104 -15.355 15.286 11.007 1.00 0.00 C ATOM 1725 CG GLU A 104 -14.204 16.275 10.934 1.00 0.00 C ATOM 1726 CD GLU A 104 -14.433 17.362 9.902 1.00 0.00 C ATOM 1727 OE1 GLU A 104 -15.607 17.715 9.664 1.00 0.00 O ATOM 1728 OE2 GLU A 104 -13.439 17.858 9.332 1.00 0.00 O ATOM 0 H GLU A 104 -15.489 12.183 11.087 1.00 0.00 H new ATOM 0 HA GLU A 104 -14.039 13.746 11.727 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -15.592 14.942 10.000 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -16.240 15.798 11.385 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -14.061 16.733 11.913 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -13.285 15.740 10.695 1.00 0.00 H new ATOM 1735 N ALA A 105 -15.297 13.443 14.223 1.00 0.00 N ATOM 1736 CA ALA A 105 -15.445 13.671 15.656 1.00 0.00 C ATOM 1737 C ALA A 105 -14.088 13.852 16.326 1.00 0.00 C ATOM 1738 O ALA A 105 -13.982 13.827 17.553 1.00 0.00 O ATOM 1739 CB ALA A 105 -16.204 12.519 16.297 1.00 0.00 C ATOM 0 H ALA A 105 -15.259 12.460 13.954 1.00 0.00 H new ATOM 0 HA ALA A 105 -16.015 14.590 15.796 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -16.307 12.702 17.367 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -17.193 12.439 15.845 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -15.656 11.590 16.139 1.00 0.00 H new TER 1745 ALA A 105