USER MOD reduce.3.24.130724 H: found=0, std=0, add=900, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 900 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 75 GLN : amide:sc= -0.299 K(o=0.042,f=-0.52) USER MOD Set 1.2: A 93 ASN : amide:sc= 0.341 K(o=0.042,f=-1.6) USER MOD Set 2.1: A 53 LYS NZ :NH3+ 169:sc= 0.0108 (180deg=0) USER MOD Set 2.2: A 63 THR OG1 : rot 180:sc= 0.00916 USER MOD Set 3.1: A 9 SER OG : rot 131:sc= 0.927 USER MOD Set 3.2: A 42 SER OG : rot -7:sc= 1.17 USER MOD Set 4.1: A 30 GLN : amide:sc= 0 X(o=-1.7,f=-1.7) USER MOD Set 4.2: A 32 ASN : amide:sc= -1.71 X(o=-1.7,f=-1.3) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 50:sc= 0.187 USER MOD Single : A 11 LYS NZ :NH3+ 145:sc= 0.0137 (180deg=0) USER MOD Single : A 12 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 THR OG1 : rot 180:sc= 0.049 USER MOD Single : A 18 HIS : no HD1:sc= -0.49 X(o=-0.49,f=-0.056) USER MOD Single : A 20 LYS NZ :NH3+ -146:sc= -0.423 (180deg=-1.45!) USER MOD Single : A 33 GLN : amide:sc= -0.262 X(o=-0.26,f=-0.029) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 ASN : amide:sc= -1.35 K(o=-1.3,f=-0.45) USER MOD Single : A 44 THR OG1 : rot -123:sc= 0.668 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 60 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 61 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 65 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 67 HIS : no HD1:sc= -0.18 K(o=-0.18,f=-0.88) USER MOD Single : A 68 TYR OH : rot 84:sc= 0.0772 USER MOD Single : A 69 GLN : amide:sc= -0.651 K(o=-0.65,f=-2.1) USER MOD Single : A 73 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 MET CE :methyl 141:sc= -1.28 (180deg=-1.75!) USER MOD Single : A 83 LYS NZ :NH3+ 159:sc= 0.216 (180deg=-0.108) USER MOD Single : A 89 LYS NZ :NH3+ -149:sc= 0 (180deg=-0.898) USER MOD Single : A 91 ASN : amide:sc= -0.848 K(o=-0.85,f=-3.4!) USER MOD Single : A 100 ASN : amide:sc= -1.86! K(o=-1.9!,f=-0.86) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 LYS NZ :NH3+ 158:sc= -0.78 (180deg=-1.53) USER MOD Single : A 104 TYR OH : rot 180:sc= 0 USER MOD Single : A 106 LYS NZ :NH3+ 174:sc= -1.03 (180deg=-1.06) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot 180:sc=-0.00732 USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 18.461 14.229 10.594 1.00 0.00 N ATOM 2 CA GLY A 1 19.926 14.136 10.837 1.00 0.00 C ATOM 3 C GLY A 1 20.693 13.692 9.606 1.00 0.00 C ATOM 4 O GLY A 1 21.237 14.517 8.874 1.00 0.00 O ATOM 0 H1 GLY A 1 17.983 14.536 11.465 1.00 0.00 H new ATOM 0 H2 GLY A 1 18.278 14.919 9.837 1.00 0.00 H new ATOM 0 H3 GLY A 1 18.097 13.298 10.309 1.00 0.00 H new ATOM 0 HA2 GLY A 1 20.299 15.107 11.163 1.00 0.00 H new ATOM 0 HA3 GLY A 1 20.112 13.434 11.650 1.00 0.00 H new ATOM 10 N SER A 2 20.736 12.383 9.379 1.00 0.00 N ATOM 11 CA SER A 2 21.440 11.830 8.229 1.00 0.00 C ATOM 12 C SER A 2 20.623 10.723 7.572 1.00 0.00 C ATOM 13 O SER A 2 20.403 10.735 6.361 1.00 0.00 O ATOM 14 CB SER A 2 22.806 11.288 8.654 1.00 0.00 C ATOM 15 OG SER A 2 23.471 10.668 7.566 1.00 0.00 O ATOM 0 H SER A 2 20.291 11.686 9.977 1.00 0.00 H new ATOM 0 HA SER A 2 21.584 12.630 7.503 1.00 0.00 H new ATOM 0 HB2 SER A 2 23.419 12.102 9.042 1.00 0.00 H new ATOM 0 HB3 SER A 2 22.680 10.570 9.464 1.00 0.00 H new ATOM 0 HG SER A 2 24.342 10.332 7.864 1.00 0.00 H new ATOM 21 N SER A 3 20.177 9.765 8.377 1.00 0.00 N ATOM 22 CA SER A 3 19.385 8.649 7.874 1.00 0.00 C ATOM 23 C SER A 3 18.523 8.049 8.980 1.00 0.00 C ATOM 24 O SER A 3 19.018 7.324 9.841 1.00 0.00 O ATOM 25 CB SER A 3 20.298 7.574 7.283 1.00 0.00 C ATOM 26 OG SER A 3 19.569 6.395 6.982 1.00 0.00 O ATOM 0 H SER A 3 20.351 9.739 9.382 1.00 0.00 H new ATOM 0 HA SER A 3 18.727 9.028 7.092 1.00 0.00 H new ATOM 0 HB2 SER A 3 20.773 7.953 6.378 1.00 0.00 H new ATOM 0 HB3 SER A 3 21.096 7.342 7.988 1.00 0.00 H new ATOM 0 HG SER A 3 20.175 5.724 6.604 1.00 0.00 H new ATOM 32 N GLY A 4 17.230 8.359 8.950 1.00 0.00 N ATOM 33 CA GLY A 4 16.321 7.842 9.956 1.00 0.00 C ATOM 34 C GLY A 4 15.682 6.531 9.541 1.00 0.00 C ATOM 35 O GLY A 4 16.024 5.967 8.502 1.00 0.00 O ATOM 0 H GLY A 4 16.797 8.958 8.248 1.00 0.00 H new ATOM 0 HA2 GLY A 4 16.862 7.699 10.891 1.00 0.00 H new ATOM 0 HA3 GLY A 4 15.541 8.578 10.149 1.00 0.00 H new ATOM 39 N SER A 5 14.749 6.047 10.354 1.00 0.00 N ATOM 40 CA SER A 5 14.059 4.794 10.067 1.00 0.00 C ATOM 41 C SER A 5 12.551 4.954 10.231 1.00 0.00 C ATOM 42 O SER A 5 11.775 4.526 9.377 1.00 0.00 O ATOM 43 CB SER A 5 14.571 3.684 10.986 1.00 0.00 C ATOM 44 OG SER A 5 15.963 3.810 11.212 1.00 0.00 O ATOM 0 H SER A 5 14.453 6.503 11.217 1.00 0.00 H new ATOM 0 HA SER A 5 14.266 4.522 9.032 1.00 0.00 H new ATOM 0 HB2 SER A 5 14.040 3.722 11.937 1.00 0.00 H new ATOM 0 HB3 SER A 5 14.358 2.712 10.541 1.00 0.00 H new ATOM 0 HG SER A 5 16.265 3.090 11.804 1.00 0.00 H new ATOM 50 N SER A 6 12.143 5.571 11.335 1.00 0.00 N ATOM 51 CA SER A 6 10.729 5.786 11.611 1.00 0.00 C ATOM 52 C SER A 6 10.321 7.218 11.278 1.00 0.00 C ATOM 53 O SER A 6 10.417 8.112 12.118 1.00 0.00 O ATOM 54 CB SER A 6 10.422 5.485 13.079 1.00 0.00 C ATOM 55 OG SER A 6 11.365 6.106 13.936 1.00 0.00 O ATOM 0 H SER A 6 12.772 5.931 12.053 1.00 0.00 H new ATOM 0 HA SER A 6 10.155 5.107 10.980 1.00 0.00 H new ATOM 0 HB2 SER A 6 9.419 5.835 13.323 1.00 0.00 H new ATOM 0 HB3 SER A 6 10.432 4.407 13.242 1.00 0.00 H new ATOM 0 HG SER A 6 11.455 7.051 13.693 1.00 0.00 H new ATOM 61 N GLY A 7 9.866 7.427 10.047 1.00 0.00 N ATOM 62 CA GLY A 7 9.450 8.751 9.624 1.00 0.00 C ATOM 63 C GLY A 7 8.685 8.729 8.316 1.00 0.00 C ATOM 64 O GLY A 7 7.615 8.126 8.225 1.00 0.00 O ATOM 0 H GLY A 7 9.778 6.702 9.334 1.00 0.00 H new ATOM 0 HA2 GLY A 7 8.826 9.197 10.399 1.00 0.00 H new ATOM 0 HA3 GLY A 7 10.328 9.387 9.517 1.00 0.00 H new ATOM 68 N ILE A 8 9.234 9.387 7.301 1.00 0.00 N ATOM 69 CA ILE A 8 8.596 9.441 5.991 1.00 0.00 C ATOM 70 C ILE A 8 8.427 8.045 5.403 1.00 0.00 C ATOM 71 O ILE A 8 9.403 7.320 5.209 1.00 0.00 O ATOM 72 CB ILE A 8 9.406 10.306 5.006 1.00 0.00 C ATOM 73 CG1 ILE A 8 10.849 9.802 4.915 1.00 0.00 C ATOM 74 CG2 ILE A 8 9.371 11.766 5.430 1.00 0.00 C ATOM 75 CD1 ILE A 8 11.200 9.213 3.565 1.00 0.00 C ATOM 0 H ILE A 8 10.119 9.890 7.360 1.00 0.00 H new ATOM 0 HA ILE A 8 7.614 9.892 6.137 1.00 0.00 H new ATOM 0 HB ILE A 8 8.953 10.226 4.018 1.00 0.00 H new ATOM 0 HG12 ILE A 8 11.528 10.627 5.130 1.00 0.00 H new ATOM 0 HG13 ILE A 8 11.011 9.047 5.685 1.00 0.00 H new ATOM 0 HG21 ILE A 8 9.948 12.364 4.724 1.00 0.00 H new ATOM 0 HG22 ILE A 8 8.339 12.116 5.444 1.00 0.00 H new ATOM 0 HG23 ILE A 8 9.801 11.866 6.426 1.00 0.00 H new ATOM 0 HD11 ILE A 8 12.237 8.877 3.573 1.00 0.00 H new ATOM 0 HD12 ILE A 8 10.546 8.367 3.356 1.00 0.00 H new ATOM 0 HD13 ILE A 8 11.071 9.971 2.793 1.00 0.00 H new ATOM 87 N SER A 9 7.182 7.673 5.121 1.00 0.00 N ATOM 88 CA SER A 9 6.886 6.361 4.554 1.00 0.00 C ATOM 89 C SER A 9 7.332 5.248 5.495 1.00 0.00 C ATOM 90 O SER A 9 8.144 5.468 6.393 1.00 0.00 O ATOM 91 CB SER A 9 7.574 6.202 3.196 1.00 0.00 C ATOM 92 OG SER A 9 6.749 6.681 2.148 1.00 0.00 O ATOM 0 H SER A 9 6.363 8.261 5.276 1.00 0.00 H new ATOM 0 HA SER A 9 5.807 6.287 4.419 1.00 0.00 H new ATOM 0 HB2 SER A 9 8.519 6.746 3.197 1.00 0.00 H new ATOM 0 HB3 SER A 9 7.811 5.152 3.026 1.00 0.00 H new ATOM 0 HG SER A 9 7.267 7.280 1.571 1.00 0.00 H new ATOM 98 N LEU A 10 6.795 4.050 5.284 1.00 0.00 N ATOM 99 CA LEU A 10 7.137 2.902 6.114 1.00 0.00 C ATOM 100 C LEU A 10 8.137 1.996 5.403 1.00 0.00 C ATOM 101 O LEU A 10 7.910 1.575 4.269 1.00 0.00 O ATOM 102 CB LEU A 10 5.877 2.111 6.471 1.00 0.00 C ATOM 103 CG LEU A 10 5.149 2.586 7.729 1.00 0.00 C ATOM 104 CD1 LEU A 10 3.808 1.883 7.868 1.00 0.00 C ATOM 105 CD2 LEU A 10 6.007 2.348 8.962 1.00 0.00 C ATOM 0 H LEU A 10 6.121 3.850 4.545 1.00 0.00 H new ATOM 0 HA LEU A 10 7.597 3.271 7.031 1.00 0.00 H new ATOM 0 HB2 LEU A 10 5.186 2.159 5.630 1.00 0.00 H new ATOM 0 HB3 LEU A 10 6.149 1.063 6.601 1.00 0.00 H new ATOM 0 HG LEU A 10 4.967 3.657 7.637 1.00 0.00 H new ATOM 0 HD11 LEU A 10 3.305 2.234 8.769 1.00 0.00 H new ATOM 0 HD12 LEU A 10 3.190 2.103 6.998 1.00 0.00 H new ATOM 0 HD13 LEU A 10 3.967 0.807 7.937 1.00 0.00 H new ATOM 0 HD21 LEU A 10 5.474 2.692 9.848 1.00 0.00 H new ATOM 0 HD22 LEU A 10 6.220 1.283 9.057 1.00 0.00 H new ATOM 0 HD23 LEU A 10 6.943 2.898 8.866 1.00 0.00 H new ATOM 117 N LYS A 11 9.244 1.702 6.076 1.00 0.00 N ATOM 118 CA LYS A 11 10.279 0.846 5.509 1.00 0.00 C ATOM 119 C LYS A 11 10.249 -0.540 6.145 1.00 0.00 C ATOM 120 O LYS A 11 10.653 -0.715 7.294 1.00 0.00 O ATOM 121 CB LYS A 11 11.658 1.481 5.705 1.00 0.00 C ATOM 122 CG LYS A 11 11.751 2.905 5.183 1.00 0.00 C ATOM 123 CD LYS A 11 12.368 2.952 3.793 1.00 0.00 C ATOM 124 CE LYS A 11 13.801 3.458 3.834 1.00 0.00 C ATOM 125 NZ LYS A 11 14.338 3.721 2.471 1.00 0.00 N ATOM 0 H LYS A 11 9.448 2.044 7.015 1.00 0.00 H new ATOM 0 HA LYS A 11 10.083 0.739 4.442 1.00 0.00 H new ATOM 0 HB2 LYS A 11 11.904 1.475 6.767 1.00 0.00 H new ATOM 0 HB3 LYS A 11 12.406 0.869 5.201 1.00 0.00 H new ATOM 0 HG2 LYS A 11 10.756 3.349 5.155 1.00 0.00 H new ATOM 0 HG3 LYS A 11 12.349 3.506 5.868 1.00 0.00 H new ATOM 0 HD2 LYS A 11 12.346 1.956 3.350 1.00 0.00 H new ATOM 0 HD3 LYS A 11 11.771 3.600 3.151 1.00 0.00 H new ATOM 0 HE2 LYS A 11 13.846 4.373 4.424 1.00 0.00 H new ATOM 0 HE3 LYS A 11 14.431 2.724 4.336 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 14.975 4.543 2.501 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 14.864 2.888 2.138 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 13.551 3.917 1.820 1.00 0.00 H new ATOM 139 N TYR A 12 9.768 -1.522 5.388 1.00 0.00 N ATOM 140 CA TYR A 12 9.685 -2.893 5.879 1.00 0.00 C ATOM 141 C TYR A 12 10.117 -3.883 4.802 1.00 0.00 C ATOM 142 O TYR A 12 9.750 -3.746 3.635 1.00 0.00 O ATOM 143 CB TYR A 12 8.258 -3.206 6.334 1.00 0.00 C ATOM 144 CG TYR A 12 8.020 -2.942 7.804 1.00 0.00 C ATOM 145 CD1 TYR A 12 8.662 -3.697 8.777 1.00 0.00 C ATOM 146 CD2 TYR A 12 7.153 -1.939 8.217 1.00 0.00 C ATOM 147 CE1 TYR A 12 8.448 -3.458 10.122 1.00 0.00 C ATOM 148 CE2 TYR A 12 6.932 -1.694 9.560 1.00 0.00 C ATOM 149 CZ TYR A 12 7.582 -2.457 10.508 1.00 0.00 C ATOM 150 OH TYR A 12 7.366 -2.216 11.845 1.00 0.00 O ATOM 0 H TYR A 12 9.430 -1.394 4.434 1.00 0.00 H new ATOM 0 HA TYR A 12 10.360 -2.991 6.729 1.00 0.00 H new ATOM 0 HB2 TYR A 12 7.559 -2.608 5.748 1.00 0.00 H new ATOM 0 HB3 TYR A 12 8.039 -4.252 6.121 1.00 0.00 H new ATOM 0 HD1 TYR A 12 9.339 -4.483 8.478 1.00 0.00 H new ATOM 0 HD2 TYR A 12 6.643 -1.340 7.477 1.00 0.00 H new ATOM 0 HE1 TYR A 12 8.957 -4.052 10.866 1.00 0.00 H new ATOM 0 HE2 TYR A 12 6.255 -0.910 9.865 1.00 0.00 H new ATOM 0 HH TYR A 12 6.730 -1.477 11.946 1.00 0.00 H new ATOM 160 N THR A 13 10.900 -4.880 5.201 1.00 0.00 N ATOM 161 CA THR A 13 11.384 -5.893 4.271 1.00 0.00 C ATOM 162 C THR A 13 10.446 -7.095 4.239 1.00 0.00 C ATOM 163 O THR A 13 9.605 -7.262 5.122 1.00 0.00 O ATOM 164 CB THR A 13 12.793 -6.343 4.661 1.00 0.00 C ATOM 165 OG1 THR A 13 12.912 -6.456 6.068 1.00 0.00 O ATOM 166 CG2 THR A 13 13.876 -5.400 4.182 1.00 0.00 C ATOM 0 H THR A 13 11.213 -5.008 6.163 1.00 0.00 H new ATOM 0 HA THR A 13 11.414 -5.450 3.275 1.00 0.00 H new ATOM 0 HB THR A 13 12.933 -7.308 4.175 1.00 0.00 H new ATOM 0 HG1 THR A 13 13.819 -6.746 6.297 1.00 0.00 H new ATOM 0 HG21 THR A 13 14.850 -5.778 4.492 1.00 0.00 H new ATOM 0 HG22 THR A 13 13.843 -5.330 3.095 1.00 0.00 H new ATOM 0 HG23 THR A 13 13.716 -4.412 4.614 1.00 0.00 H new ATOM 174 N ALA A 14 10.595 -7.930 3.215 1.00 0.00 N ATOM 175 CA ALA A 14 9.762 -9.116 3.069 1.00 0.00 C ATOM 176 C ALA A 14 9.912 -10.044 4.270 1.00 0.00 C ATOM 177 O ALA A 14 8.977 -10.752 4.641 1.00 0.00 O ATOM 178 CB ALA A 14 10.113 -9.852 1.785 1.00 0.00 C ATOM 0 H ALA A 14 11.285 -7.806 2.475 1.00 0.00 H new ATOM 0 HA ALA A 14 8.722 -8.795 3.019 1.00 0.00 H new ATOM 0 HB1 ALA A 14 9.483 -10.736 1.689 1.00 0.00 H new ATOM 0 HB2 ALA A 14 9.948 -9.194 0.932 1.00 0.00 H new ATOM 0 HB3 ALA A 14 11.160 -10.154 1.813 1.00 0.00 H new ATOM 184 N ALA A 15 11.096 -10.035 4.874 1.00 0.00 N ATOM 185 CA ALA A 15 11.369 -10.874 6.033 1.00 0.00 C ATOM 186 C ALA A 15 10.445 -10.524 7.194 1.00 0.00 C ATOM 187 O ALA A 15 9.866 -11.407 7.828 1.00 0.00 O ATOM 188 CB ALA A 15 12.825 -10.734 6.454 1.00 0.00 C ATOM 0 H ALA A 15 11.882 -9.455 4.579 1.00 0.00 H new ATOM 0 HA ALA A 15 11.181 -11.910 5.753 1.00 0.00 H new ATOM 0 HB1 ALA A 15 13.015 -11.366 7.321 1.00 0.00 H new ATOM 0 HB2 ALA A 15 13.472 -11.040 5.632 1.00 0.00 H new ATOM 0 HB3 ALA A 15 13.031 -9.695 6.710 1.00 0.00 H new ATOM 194 N ARG A 16 10.312 -9.231 7.469 1.00 0.00 N ATOM 195 CA ARG A 16 9.458 -8.764 8.555 1.00 0.00 C ATOM 196 C ARG A 16 8.000 -9.136 8.301 1.00 0.00 C ATOM 197 O ARG A 16 7.353 -9.757 9.143 1.00 0.00 O ATOM 198 CB ARG A 16 9.588 -7.248 8.718 1.00 0.00 C ATOM 199 CG ARG A 16 10.980 -6.798 9.130 1.00 0.00 C ATOM 200 CD ARG A 16 11.435 -7.489 10.405 1.00 0.00 C ATOM 201 NE ARG A 16 12.712 -6.967 10.885 1.00 0.00 N ATOM 202 CZ ARG A 16 12.840 -5.828 11.561 1.00 0.00 C ATOM 203 NH1 ARG A 16 11.773 -5.091 11.842 1.00 0.00 N ATOM 204 NH2 ARG A 16 14.038 -5.426 11.962 1.00 0.00 N ATOM 0 H ARG A 16 10.785 -8.488 6.955 1.00 0.00 H new ATOM 0 HA ARG A 16 9.783 -9.251 9.474 1.00 0.00 H new ATOM 0 HB2 ARG A 16 9.323 -6.766 7.777 1.00 0.00 H new ATOM 0 HB3 ARG A 16 8.870 -6.908 9.464 1.00 0.00 H new ATOM 0 HG2 ARG A 16 11.685 -7.013 8.327 1.00 0.00 H new ATOM 0 HG3 ARG A 16 10.985 -5.718 9.279 1.00 0.00 H new ATOM 0 HD2 ARG A 16 10.677 -7.360 11.178 1.00 0.00 H new ATOM 0 HD3 ARG A 16 11.526 -8.560 10.224 1.00 0.00 H new ATOM 0 HE ARG A 16 13.555 -7.507 10.691 1.00 0.00 H new ATOM 0 HH11 ARG A 16 10.848 -5.397 11.540 1.00 0.00 H new ATOM 0 HH12 ARG A 16 11.878 -4.219 12.361 1.00 0.00 H new ATOM 0 HH21 ARG A 16 14.862 -5.990 11.752 1.00 0.00 H new ATOM 0 HH22 ARG A 16 14.136 -4.553 12.480 1.00 0.00 H new ATOM 218 N LEU A 17 7.491 -8.752 7.135 1.00 0.00 N ATOM 219 CA LEU A 17 6.110 -9.045 6.771 1.00 0.00 C ATOM 220 C LEU A 17 5.857 -10.550 6.760 1.00 0.00 C ATOM 221 O LEU A 17 4.750 -11.006 7.047 1.00 0.00 O ATOM 222 CB LEU A 17 5.785 -8.452 5.399 1.00 0.00 C ATOM 223 CG LEU A 17 5.653 -6.929 5.368 1.00 0.00 C ATOM 224 CD1 LEU A 17 5.435 -6.440 3.945 1.00 0.00 C ATOM 225 CD2 LEU A 17 4.514 -6.476 6.269 1.00 0.00 C ATOM 0 H LEU A 17 8.014 -8.237 6.426 1.00 0.00 H new ATOM 0 HA LEU A 17 5.460 -8.591 7.519 1.00 0.00 H new ATOM 0 HB2 LEU A 17 6.565 -8.748 4.698 1.00 0.00 H new ATOM 0 HB3 LEU A 17 4.853 -8.890 5.042 1.00 0.00 H new ATOM 0 HG LEU A 17 6.581 -6.495 5.740 1.00 0.00 H new ATOM 0 HD11 LEU A 17 5.343 -5.354 3.944 1.00 0.00 H new ATOM 0 HD12 LEU A 17 6.282 -6.734 3.326 1.00 0.00 H new ATOM 0 HD13 LEU A 17 4.523 -6.882 3.544 1.00 0.00 H new ATOM 0 HD21 LEU A 17 4.434 -5.389 6.235 1.00 0.00 H new ATOM 0 HD22 LEU A 17 3.580 -6.920 5.925 1.00 0.00 H new ATOM 0 HD23 LEU A 17 4.712 -6.794 7.293 1.00 0.00 H new ATOM 237 N HIS A 18 6.890 -11.316 6.428 1.00 0.00 N ATOM 238 CA HIS A 18 6.780 -12.770 6.381 1.00 0.00 C ATOM 239 C HIS A 18 6.729 -13.357 7.788 1.00 0.00 C ATOM 240 O HIS A 18 5.987 -14.303 8.051 1.00 0.00 O ATOM 241 CB HIS A 18 7.958 -13.366 5.608 1.00 0.00 C ATOM 242 CG HIS A 18 7.891 -14.855 5.467 1.00 0.00 C ATOM 243 ND1 HIS A 18 8.518 -15.723 6.336 1.00 0.00 N ATOM 244 CD2 HIS A 18 7.265 -15.632 4.550 1.00 0.00 C ATOM 245 CE1 HIS A 18 8.283 -16.967 5.960 1.00 0.00 C ATOM 246 NE2 HIS A 18 7.525 -16.940 4.880 1.00 0.00 N ATOM 0 H HIS A 18 7.813 -10.955 6.187 1.00 0.00 H new ATOM 0 HA HIS A 18 5.853 -13.024 5.868 1.00 0.00 H new ATOM 0 HB2 HIS A 18 7.995 -12.917 4.616 1.00 0.00 H new ATOM 0 HB3 HIS A 18 8.886 -13.099 6.114 1.00 0.00 H new ATOM 0 HD2 HIS A 18 6.672 -15.287 3.716 1.00 0.00 H new ATOM 0 HE1 HIS A 18 8.649 -17.856 6.453 1.00 0.00 H new ATOM 0 HE2 HIS A 18 7.187 -17.758 4.373 1.00 0.00 H new ATOM 255 N GLU A 19 7.524 -12.788 8.689 1.00 0.00 N ATOM 256 CA GLU A 19 7.570 -13.254 10.070 1.00 0.00 C ATOM 257 C GLU A 19 6.325 -12.814 10.833 1.00 0.00 C ATOM 258 O GLU A 19 5.865 -13.506 11.742 1.00 0.00 O ATOM 259 CB GLU A 19 8.824 -12.724 10.767 1.00 0.00 C ATOM 260 CG GLU A 19 10.115 -13.063 10.040 1.00 0.00 C ATOM 261 CD GLU A 19 10.895 -14.171 10.723 1.00 0.00 C ATOM 262 OE1 GLU A 19 10.273 -15.179 11.117 1.00 0.00 O ATOM 263 OE2 GLU A 19 12.128 -14.027 10.863 1.00 0.00 O ATOM 0 H GLU A 19 8.145 -12.004 8.487 1.00 0.00 H new ATOM 0 HA GLU A 19 7.602 -14.343 10.060 1.00 0.00 H new ATOM 0 HB2 GLU A 19 8.745 -11.641 10.864 1.00 0.00 H new ATOM 0 HB3 GLU A 19 8.868 -13.132 11.777 1.00 0.00 H new ATOM 0 HG2 GLU A 19 9.884 -13.363 9.018 1.00 0.00 H new ATOM 0 HG3 GLU A 19 10.738 -12.171 9.977 1.00 0.00 H new ATOM 270 N LYS A 20 5.785 -11.660 10.458 1.00 0.00 N ATOM 271 CA LYS A 20 4.593 -11.126 11.108 1.00 0.00 C ATOM 272 C LYS A 20 3.353 -11.917 10.704 1.00 0.00 C ATOM 273 O LYS A 20 2.408 -12.049 11.482 1.00 0.00 O ATOM 274 CB LYS A 20 4.409 -9.650 10.750 1.00 0.00 C ATOM 275 CG LYS A 20 5.476 -8.744 11.342 1.00 0.00 C ATOM 276 CD LYS A 20 5.384 -7.334 10.779 1.00 0.00 C ATOM 277 CE LYS A 20 5.675 -6.290 11.845 1.00 0.00 C ATOM 278 NZ LYS A 20 4.830 -6.481 13.055 1.00 0.00 N ATOM 0 H LYS A 20 6.153 -11.076 9.707 1.00 0.00 H new ATOM 0 HA LYS A 20 4.726 -11.218 12.186 1.00 0.00 H new ATOM 0 HB2 LYS A 20 4.415 -9.544 9.665 1.00 0.00 H new ATOM 0 HB3 LYS A 20 3.430 -9.320 11.097 1.00 0.00 H new ATOM 0 HG2 LYS A 20 5.367 -8.712 12.426 1.00 0.00 H new ATOM 0 HG3 LYS A 20 6.463 -9.157 11.133 1.00 0.00 H new ATOM 0 HD2 LYS A 20 6.090 -7.223 9.956 1.00 0.00 H new ATOM 0 HD3 LYS A 20 4.388 -7.169 10.369 1.00 0.00 H new ATOM 0 HE2 LYS A 20 6.727 -6.341 12.125 1.00 0.00 H new ATOM 0 HE3 LYS A 20 5.502 -5.295 11.435 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 4.603 -5.555 13.470 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 3.949 -6.967 12.790 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 5.346 -7.055 13.752 1.00 0.00 H new ATOM 292 N GLY A 21 3.363 -12.442 9.482 1.00 0.00 N ATOM 293 CA GLY A 21 2.232 -13.212 8.997 1.00 0.00 C ATOM 294 C GLY A 21 1.621 -12.623 7.740 1.00 0.00 C ATOM 295 O GLY A 21 0.960 -13.326 6.975 1.00 0.00 O ATOM 0 H GLY A 21 4.133 -12.348 8.820 1.00 0.00 H new ATOM 0 HA2 GLY A 21 2.553 -14.234 8.796 1.00 0.00 H new ATOM 0 HA3 GLY A 21 1.472 -13.264 9.776 1.00 0.00 H new ATOM 299 N VAL A 22 1.839 -11.328 7.526 1.00 0.00 N ATOM 300 CA VAL A 22 1.303 -10.645 6.354 1.00 0.00 C ATOM 301 C VAL A 22 1.759 -11.323 5.065 1.00 0.00 C ATOM 302 O VAL A 22 0.950 -11.894 4.334 1.00 0.00 O ATOM 303 CB VAL A 22 1.730 -9.166 6.321 1.00 0.00 C ATOM 304 CG1 VAL A 22 1.007 -8.425 5.207 1.00 0.00 C ATOM 305 CG2 VAL A 22 1.471 -8.505 7.667 1.00 0.00 C ATOM 0 H VAL A 22 2.383 -10.731 8.149 1.00 0.00 H new ATOM 0 HA VAL A 22 0.217 -10.700 6.426 1.00 0.00 H new ATOM 0 HB VAL A 22 2.800 -9.121 6.120 1.00 0.00 H new ATOM 0 HG11 VAL A 22 1.322 -7.382 5.200 1.00 0.00 H new ATOM 0 HG12 VAL A 22 1.249 -8.884 4.248 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -0.069 -8.478 5.373 1.00 0.00 H new ATOM 0 HG21 VAL A 22 1.779 -7.460 7.625 1.00 0.00 H new ATOM 0 HG22 VAL A 22 0.408 -8.561 7.901 1.00 0.00 H new ATOM 0 HG23 VAL A 22 2.040 -9.020 8.441 1.00 0.00 H new ATOM 315 N LEU A 23 3.057 -11.254 4.793 1.00 0.00 N ATOM 316 CA LEU A 23 3.619 -11.861 3.592 1.00 0.00 C ATOM 317 C LEU A 23 3.571 -13.382 3.677 1.00 0.00 C ATOM 318 O LEU A 23 3.834 -13.965 4.729 1.00 0.00 O ATOM 319 CB LEU A 23 5.063 -11.396 3.388 1.00 0.00 C ATOM 320 CG LEU A 23 5.524 -11.336 1.930 1.00 0.00 C ATOM 321 CD1 LEU A 23 4.731 -10.290 1.163 1.00 0.00 C ATOM 322 CD2 LEU A 23 7.014 -11.040 1.855 1.00 0.00 C ATOM 0 H LEU A 23 3.740 -10.784 5.387 1.00 0.00 H new ATOM 0 HA LEU A 23 3.018 -11.544 2.740 1.00 0.00 H new ATOM 0 HB2 LEU A 23 5.176 -10.406 3.830 1.00 0.00 H new ATOM 0 HB3 LEU A 23 5.725 -12.067 3.935 1.00 0.00 H new ATOM 0 HG LEU A 23 5.343 -12.308 1.470 1.00 0.00 H new ATOM 0 HD11 LEU A 23 5.072 -10.261 0.128 1.00 0.00 H new ATOM 0 HD12 LEU A 23 3.672 -10.545 1.189 1.00 0.00 H new ATOM 0 HD13 LEU A 23 4.880 -9.312 1.621 1.00 0.00 H new ATOM 0 HD21 LEU A 23 7.325 -11.001 0.811 1.00 0.00 H new ATOM 0 HD22 LEU A 23 7.219 -10.081 2.331 1.00 0.00 H new ATOM 0 HD23 LEU A 23 7.567 -11.826 2.369 1.00 0.00 H new ATOM 334 N LEU A 24 3.231 -14.022 2.562 1.00 0.00 N ATOM 335 CA LEU A 24 3.147 -15.477 2.510 1.00 0.00 C ATOM 336 C LEU A 24 4.380 -16.069 1.836 1.00 0.00 C ATOM 337 O LEU A 24 5.178 -16.757 2.472 1.00 0.00 O ATOM 338 CB LEU A 24 1.885 -15.910 1.762 1.00 0.00 C ATOM 339 CG LEU A 24 0.576 -15.360 2.329 1.00 0.00 C ATOM 340 CD1 LEU A 24 -0.560 -15.558 1.337 1.00 0.00 C ATOM 341 CD2 LEU A 24 0.249 -16.026 3.656 1.00 0.00 C ATOM 0 H LEU A 24 3.009 -13.555 1.683 1.00 0.00 H new ATOM 0 HA LEU A 24 3.100 -15.850 3.533 1.00 0.00 H new ATOM 0 HB2 LEU A 24 1.972 -15.597 0.722 1.00 0.00 H new ATOM 0 HB3 LEU A 24 1.835 -16.999 1.764 1.00 0.00 H new ATOM 0 HG LEU A 24 0.698 -14.291 2.502 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -1.484 -15.161 1.758 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -0.329 -15.034 0.410 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -0.683 -16.621 1.132 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -0.686 -15.622 4.045 1.00 0.00 H new ATOM 0 HD22 LEU A 24 0.146 -17.101 3.508 1.00 0.00 H new ATOM 0 HD23 LEU A 24 1.052 -15.833 4.368 1.00 0.00 H new ATOM 353 N GLU A 25 4.530 -15.796 0.543 1.00 0.00 N ATOM 354 CA GLU A 25 5.665 -16.301 -0.218 1.00 0.00 C ATOM 355 C GLU A 25 5.879 -15.479 -1.485 1.00 0.00 C ATOM 356 O GLU A 25 5.049 -14.644 -1.842 1.00 0.00 O ATOM 357 CB GLU A 25 5.451 -17.771 -0.579 1.00 0.00 C ATOM 358 CG GLU A 25 5.850 -18.734 0.527 1.00 0.00 C ATOM 359 CD GLU A 25 6.641 -19.920 0.012 1.00 0.00 C ATOM 360 OE1 GLU A 25 7.422 -19.742 -0.946 1.00 0.00 O ATOM 361 OE2 GLU A 25 6.481 -21.028 0.567 1.00 0.00 O ATOM 0 H GLU A 25 3.879 -15.228 0.002 1.00 0.00 H new ATOM 0 HA GLU A 25 6.556 -16.214 0.405 1.00 0.00 H new ATOM 0 HB2 GLU A 25 4.400 -17.927 -0.823 1.00 0.00 H new ATOM 0 HB3 GLU A 25 6.025 -18.003 -1.476 1.00 0.00 H new ATOM 0 HG2 GLU A 25 6.444 -18.202 1.270 1.00 0.00 H new ATOM 0 HG3 GLU A 25 4.953 -19.092 1.032 1.00 0.00 H new ATOM 368 N ILE A 26 6.996 -15.725 -2.162 1.00 0.00 N ATOM 369 CA ILE A 26 7.318 -15.009 -3.390 1.00 0.00 C ATOM 370 C ILE A 26 7.670 -15.977 -4.514 1.00 0.00 C ATOM 371 O ILE A 26 8.526 -16.847 -4.353 1.00 0.00 O ATOM 372 CB ILE A 26 8.493 -14.034 -3.181 1.00 0.00 C ATOM 373 CG1 ILE A 26 8.254 -13.174 -1.939 1.00 0.00 C ATOM 374 CG2 ILE A 26 8.680 -13.159 -4.410 1.00 0.00 C ATOM 375 CD1 ILE A 26 9.447 -12.328 -1.551 1.00 0.00 C ATOM 0 H ILE A 26 7.693 -16.415 -1.881 1.00 0.00 H new ATOM 0 HA ILE A 26 6.430 -14.441 -3.667 1.00 0.00 H new ATOM 0 HB ILE A 26 9.404 -14.613 -3.030 1.00 0.00 H new ATOM 0 HG12 ILE A 26 7.399 -12.522 -2.118 1.00 0.00 H new ATOM 0 HG13 ILE A 26 7.991 -13.822 -1.103 1.00 0.00 H new ATOM 0 HG21 ILE A 26 9.514 -12.476 -4.247 1.00 0.00 H new ATOM 0 HG22 ILE A 26 8.890 -13.787 -5.276 1.00 0.00 H new ATOM 0 HG23 ILE A 26 7.771 -12.585 -4.590 1.00 0.00 H new ATOM 0 HD11 ILE A 26 9.206 -11.745 -0.662 1.00 0.00 H new ATOM 0 HD12 ILE A 26 10.299 -12.975 -1.340 1.00 0.00 H new ATOM 0 HD13 ILE A 26 9.697 -11.654 -2.370 1.00 0.00 H new ATOM 387 N GLU A 27 7.003 -15.823 -5.653 1.00 0.00 N ATOM 388 CA GLU A 27 7.244 -16.685 -6.804 1.00 0.00 C ATOM 389 C GLU A 27 8.460 -16.211 -7.595 1.00 0.00 C ATOM 390 O GLU A 27 8.351 -15.842 -8.764 1.00 0.00 O ATOM 391 CB GLU A 27 6.011 -16.717 -7.710 1.00 0.00 C ATOM 392 CG GLU A 27 4.709 -16.936 -6.957 1.00 0.00 C ATOM 393 CD GLU A 27 4.438 -18.401 -6.675 1.00 0.00 C ATOM 394 OE1 GLU A 27 4.287 -19.174 -7.643 1.00 0.00 O ATOM 395 OE2 GLU A 27 4.378 -18.774 -5.484 1.00 0.00 O ATOM 0 H GLU A 27 6.291 -15.109 -5.804 1.00 0.00 H new ATOM 0 HA GLU A 27 7.443 -17.692 -6.437 1.00 0.00 H new ATOM 0 HB2 GLU A 27 5.950 -15.778 -8.260 1.00 0.00 H new ATOM 0 HB3 GLU A 27 6.133 -17.510 -8.447 1.00 0.00 H new ATOM 0 HG2 GLU A 27 4.742 -16.388 -6.015 1.00 0.00 H new ATOM 0 HG3 GLU A 27 3.884 -16.523 -7.537 1.00 0.00 H new ATOM 402 N ASP A 28 9.622 -16.224 -6.947 1.00 0.00 N ATOM 403 CA ASP A 28 10.859 -15.796 -7.590 1.00 0.00 C ATOM 404 C ASP A 28 12.060 -16.049 -6.685 1.00 0.00 C ATOM 405 O ASP A 28 12.991 -16.762 -7.058 1.00 0.00 O ATOM 406 CB ASP A 28 10.783 -14.312 -7.953 1.00 0.00 C ATOM 407 CG ASP A 28 11.874 -13.897 -8.921 1.00 0.00 C ATOM 408 OD1 ASP A 28 12.152 -14.665 -9.866 1.00 0.00 O ATOM 409 OD2 ASP A 28 12.450 -12.806 -8.734 1.00 0.00 O ATOM 0 H ASP A 28 9.732 -16.526 -5.979 1.00 0.00 H new ATOM 0 HA ASP A 28 10.985 -16.380 -8.502 1.00 0.00 H new ATOM 0 HB2 ASP A 28 9.809 -14.098 -8.394 1.00 0.00 H new ATOM 0 HB3 ASP A 28 10.860 -13.714 -7.045 1.00 0.00 H new ATOM 414 N LEU A 29 12.033 -15.459 -5.495 1.00 0.00 N ATOM 415 CA LEU A 29 13.121 -15.620 -4.537 1.00 0.00 C ATOM 416 C LEU A 29 12.721 -16.567 -3.411 1.00 0.00 C ATOM 417 O LEU A 29 11.593 -17.057 -3.369 1.00 0.00 O ATOM 418 CB LEU A 29 13.524 -14.263 -3.958 1.00 0.00 C ATOM 419 CG LEU A 29 13.750 -13.159 -4.994 1.00 0.00 C ATOM 420 CD1 LEU A 29 14.080 -11.843 -4.306 1.00 0.00 C ATOM 421 CD2 LEU A 29 14.859 -13.552 -5.956 1.00 0.00 C ATOM 0 H LEU A 29 11.270 -14.865 -5.171 1.00 0.00 H new ATOM 0 HA LEU A 29 13.973 -16.051 -5.063 1.00 0.00 H new ATOM 0 HB2 LEU A 29 12.749 -13.936 -3.264 1.00 0.00 H new ATOM 0 HB3 LEU A 29 14.438 -14.389 -3.378 1.00 0.00 H new ATOM 0 HG LEU A 29 12.831 -13.027 -5.565 1.00 0.00 H new ATOM 0 HD11 LEU A 29 14.238 -11.069 -5.057 1.00 0.00 H new ATOM 0 HD12 LEU A 29 13.254 -11.555 -3.656 1.00 0.00 H new ATOM 0 HD13 LEU A 29 14.986 -11.961 -3.711 1.00 0.00 H new ATOM 0 HD21 LEU A 29 15.007 -12.756 -6.686 1.00 0.00 H new ATOM 0 HD22 LEU A 29 15.783 -13.711 -5.400 1.00 0.00 H new ATOM 0 HD23 LEU A 29 14.584 -14.471 -6.473 1.00 0.00 H new ATOM 433 N GLN A 30 13.655 -16.821 -2.499 1.00 0.00 N ATOM 434 CA GLN A 30 13.400 -17.709 -1.371 1.00 0.00 C ATOM 435 C GLN A 30 13.207 -16.913 -0.084 1.00 0.00 C ATOM 436 O GLN A 30 13.453 -15.708 -0.045 1.00 0.00 O ATOM 437 CB GLN A 30 14.553 -18.700 -1.205 1.00 0.00 C ATOM 438 CG GLN A 30 14.430 -19.929 -2.091 1.00 0.00 C ATOM 439 CD GLN A 30 15.704 -20.226 -2.858 1.00 0.00 C ATOM 440 OE1 GLN A 30 16.795 -20.246 -2.288 1.00 0.00 O ATOM 441 NE2 GLN A 30 15.570 -20.460 -4.159 1.00 0.00 N ATOM 0 H GLN A 30 14.594 -16.424 -2.520 1.00 0.00 H new ATOM 0 HA GLN A 30 12.483 -18.261 -1.575 1.00 0.00 H new ATOM 0 HB2 GLN A 30 15.492 -18.193 -1.429 1.00 0.00 H new ATOM 0 HB3 GLN A 30 14.602 -19.017 -0.163 1.00 0.00 H new ATOM 0 HG2 GLN A 30 14.171 -20.791 -1.476 1.00 0.00 H new ATOM 0 HG3 GLN A 30 13.612 -19.783 -2.796 1.00 0.00 H new ATOM 0 HE21 GLN A 30 14.646 -20.433 -4.589 1.00 0.00 H new ATOM 0 HE22 GLN A 30 16.391 -20.667 -4.727 1.00 0.00 H new ATOM 450 N VAL A 31 12.764 -17.595 0.968 1.00 0.00 N ATOM 451 CA VAL A 31 12.536 -16.952 2.257 1.00 0.00 C ATOM 452 C VAL A 31 13.807 -16.287 2.776 1.00 0.00 C ATOM 453 O VAL A 31 13.748 -15.288 3.491 1.00 0.00 O ATOM 454 CB VAL A 31 12.032 -17.959 3.307 1.00 0.00 C ATOM 455 CG1 VAL A 31 11.595 -17.239 4.573 1.00 0.00 C ATOM 456 CG2 VAL A 31 10.894 -18.796 2.741 1.00 0.00 C ATOM 0 H VAL A 31 12.556 -18.593 0.953 1.00 0.00 H new ATOM 0 HA VAL A 31 11.772 -16.191 2.097 1.00 0.00 H new ATOM 0 HB VAL A 31 12.853 -18.629 3.564 1.00 0.00 H new ATOM 0 HG11 VAL A 31 11.242 -17.968 5.303 1.00 0.00 H new ATOM 0 HG12 VAL A 31 12.439 -16.689 4.989 1.00 0.00 H new ATOM 0 HG13 VAL A 31 10.790 -16.543 4.336 1.00 0.00 H new ATOM 0 HG21 VAL A 31 10.551 -19.502 3.497 1.00 0.00 H new ATOM 0 HG22 VAL A 31 10.070 -18.143 2.454 1.00 0.00 H new ATOM 0 HG23 VAL A 31 11.245 -19.343 1.866 1.00 0.00 H new ATOM 466 N ASN A 32 14.955 -16.850 2.414 1.00 0.00 N ATOM 467 CA ASN A 32 16.239 -16.309 2.845 1.00 0.00 C ATOM 468 C ASN A 32 16.539 -14.989 2.141 1.00 0.00 C ATOM 469 O ASN A 32 17.241 -14.133 2.679 1.00 0.00 O ATOM 470 CB ASN A 32 17.358 -17.314 2.569 1.00 0.00 C ATOM 471 CG ASN A 32 17.443 -17.697 1.106 1.00 0.00 C ATOM 472 OD1 ASN A 32 16.937 -18.743 0.695 1.00 0.00 O ATOM 473 ND2 ASN A 32 18.085 -16.852 0.308 1.00 0.00 N ATOM 0 H ASN A 32 15.023 -17.679 1.824 1.00 0.00 H new ATOM 0 HA ASN A 32 16.184 -16.122 3.918 1.00 0.00 H new ATOM 0 HB2 ASN A 32 18.310 -16.889 2.886 1.00 0.00 H new ATOM 0 HB3 ASN A 32 17.193 -18.210 3.167 1.00 0.00 H new ATOM 0 HD21 ASN A 32 18.174 -17.058 -0.687 1.00 0.00 H new ATOM 0 HD22 ASN A 32 18.489 -15.997 0.690 1.00 0.00 H new ATOM 480 N GLN A 33 16.006 -14.832 0.933 1.00 0.00 N ATOM 481 CA GLN A 33 16.219 -13.617 0.154 1.00 0.00 C ATOM 482 C GLN A 33 15.258 -12.506 0.577 1.00 0.00 C ATOM 483 O GLN A 33 15.422 -11.352 0.181 1.00 0.00 O ATOM 484 CB GLN A 33 16.047 -13.911 -1.337 1.00 0.00 C ATOM 485 CG GLN A 33 16.960 -15.012 -1.850 1.00 0.00 C ATOM 486 CD GLN A 33 17.300 -14.851 -3.319 1.00 0.00 C ATOM 487 OE1 GLN A 33 18.044 -13.947 -3.699 1.00 0.00 O ATOM 488 NE2 GLN A 33 16.755 -15.729 -4.152 1.00 0.00 N ATOM 0 H GLN A 33 15.423 -15.531 0.472 1.00 0.00 H new ATOM 0 HA GLN A 33 17.237 -13.275 0.342 1.00 0.00 H new ATOM 0 HB2 GLN A 33 15.011 -14.192 -1.526 1.00 0.00 H new ATOM 0 HB3 GLN A 33 16.238 -12.999 -1.903 1.00 0.00 H new ATOM 0 HG2 GLN A 33 17.881 -15.017 -1.266 1.00 0.00 H new ATOM 0 HG3 GLN A 33 16.480 -15.978 -1.696 1.00 0.00 H new ATOM 0 HE21 GLN A 33 16.144 -16.462 -3.792 1.00 0.00 H new ATOM 0 HE22 GLN A 33 16.947 -15.671 -5.152 1.00 0.00 H new ATOM 497 N PHE A 34 14.256 -12.856 1.381 1.00 0.00 N ATOM 498 CA PHE A 34 13.275 -11.880 1.850 1.00 0.00 C ATOM 499 C PHE A 34 13.958 -10.670 2.480 1.00 0.00 C ATOM 500 O PHE A 34 13.434 -9.557 2.439 1.00 0.00 O ATOM 501 CB PHE A 34 12.326 -12.527 2.862 1.00 0.00 C ATOM 502 CG PHE A 34 11.160 -13.238 2.231 1.00 0.00 C ATOM 503 CD1 PHE A 34 11.304 -13.907 1.025 1.00 0.00 C ATOM 504 CD2 PHE A 34 9.919 -13.240 2.848 1.00 0.00 C ATOM 505 CE1 PHE A 34 10.234 -14.561 0.446 1.00 0.00 C ATOM 506 CE2 PHE A 34 8.844 -13.893 2.274 1.00 0.00 C ATOM 507 CZ PHE A 34 9.002 -14.555 1.071 1.00 0.00 C ATOM 0 H PHE A 34 14.102 -13.806 1.720 1.00 0.00 H new ATOM 0 HA PHE A 34 12.703 -11.539 0.987 1.00 0.00 H new ATOM 0 HB2 PHE A 34 12.887 -13.237 3.470 1.00 0.00 H new ATOM 0 HB3 PHE A 34 11.949 -11.758 3.536 1.00 0.00 H new ATOM 0 HD1 PHE A 34 12.265 -13.917 0.532 1.00 0.00 H new ATOM 0 HD2 PHE A 34 9.790 -12.725 3.789 1.00 0.00 H new ATOM 0 HE1 PHE A 34 10.360 -15.077 -0.495 1.00 0.00 H new ATOM 0 HE2 PHE A 34 7.882 -13.886 2.765 1.00 0.00 H new ATOM 0 HZ PHE A 34 8.164 -15.066 0.621 1.00 0.00 H new ATOM 517 N LYS A 35 15.131 -10.895 3.063 1.00 0.00 N ATOM 518 CA LYS A 35 15.884 -9.821 3.701 1.00 0.00 C ATOM 519 C LYS A 35 16.408 -8.833 2.664 1.00 0.00 C ATOM 520 O LYS A 35 16.550 -7.642 2.942 1.00 0.00 O ATOM 521 CB LYS A 35 17.049 -10.396 4.509 1.00 0.00 C ATOM 522 CG LYS A 35 16.670 -10.786 5.929 1.00 0.00 C ATOM 523 CD LYS A 35 17.719 -10.334 6.932 1.00 0.00 C ATOM 524 CE LYS A 35 17.717 -11.210 8.174 1.00 0.00 C ATOM 525 NZ LYS A 35 17.988 -10.425 9.410 1.00 0.00 N ATOM 0 H LYS A 35 15.580 -11.810 3.107 1.00 0.00 H new ATOM 0 HA LYS A 35 15.211 -9.290 4.374 1.00 0.00 H new ATOM 0 HB2 LYS A 35 17.441 -11.272 3.993 1.00 0.00 H new ATOM 0 HB3 LYS A 35 17.853 -9.661 4.545 1.00 0.00 H new ATOM 0 HG2 LYS A 35 15.707 -10.343 6.184 1.00 0.00 H new ATOM 0 HG3 LYS A 35 16.549 -11.868 5.990 1.00 0.00 H new ATOM 0 HD2 LYS A 35 18.704 -10.363 6.467 1.00 0.00 H new ATOM 0 HD3 LYS A 35 17.530 -9.299 7.216 1.00 0.00 H new ATOM 0 HE2 LYS A 35 16.752 -11.708 8.265 1.00 0.00 H new ATOM 0 HE3 LYS A 35 18.470 -11.991 8.068 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 17.978 -11.060 10.234 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 18.920 -9.970 9.335 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 17.255 -9.696 9.526 1.00 0.00 H new ATOM 539 N ASN A 36 16.695 -9.335 1.466 1.00 0.00 N ATOM 540 CA ASN A 36 17.203 -8.495 0.388 1.00 0.00 C ATOM 541 C ASN A 36 16.103 -7.598 -0.168 1.00 0.00 C ATOM 542 O ASN A 36 16.332 -6.421 -0.450 1.00 0.00 O ATOM 543 CB ASN A 36 17.783 -9.362 -0.732 1.00 0.00 C ATOM 544 CG ASN A 36 18.744 -10.413 -0.212 1.00 0.00 C ATOM 545 OD1 ASN A 36 19.623 -10.119 0.599 1.00 0.00 O ATOM 546 ND2 ASN A 36 18.582 -11.646 -0.676 1.00 0.00 N ATOM 0 H ASN A 36 16.584 -10.318 1.218 1.00 0.00 H new ATOM 0 HA ASN A 36 17.992 -7.863 0.796 1.00 0.00 H new ATOM 0 HB2 ASN A 36 16.969 -9.851 -1.267 1.00 0.00 H new ATOM 0 HB3 ASN A 36 18.300 -8.725 -1.450 1.00 0.00 H new ATOM 0 HD21 ASN A 36 19.199 -12.395 -0.361 1.00 0.00 H new ATOM 0 HD22 ASN A 36 17.840 -11.845 -1.347 1.00 0.00 H new ATOM 553 N VAL A 37 14.908 -8.159 -0.322 1.00 0.00 N ATOM 554 CA VAL A 37 13.773 -7.408 -0.844 1.00 0.00 C ATOM 555 C VAL A 37 13.240 -6.426 0.194 1.00 0.00 C ATOM 556 O VAL A 37 13.186 -6.735 1.384 1.00 0.00 O ATOM 557 CB VAL A 37 12.631 -8.345 -1.280 1.00 0.00 C ATOM 558 CG1 VAL A 37 11.546 -7.564 -2.006 1.00 0.00 C ATOM 559 CG2 VAL A 37 13.166 -9.467 -2.156 1.00 0.00 C ATOM 0 H VAL A 37 14.701 -9.131 -0.093 1.00 0.00 H new ATOM 0 HA VAL A 37 14.132 -6.856 -1.713 1.00 0.00 H new ATOM 0 HB VAL A 37 12.191 -8.790 -0.388 1.00 0.00 H new ATOM 0 HG11 VAL A 37 10.748 -8.243 -2.306 1.00 0.00 H new ATOM 0 HG12 VAL A 37 11.142 -6.800 -1.342 1.00 0.00 H new ATOM 0 HG13 VAL A 37 11.970 -7.089 -2.891 1.00 0.00 H new ATOM 0 HG21 VAL A 37 12.345 -10.119 -2.454 1.00 0.00 H new ATOM 0 HG22 VAL A 37 13.634 -9.043 -3.045 1.00 0.00 H new ATOM 0 HG23 VAL A 37 13.903 -10.044 -1.598 1.00 0.00 H new ATOM 569 N ILE A 38 12.849 -5.243 -0.265 1.00 0.00 N ATOM 570 CA ILE A 38 12.320 -4.215 0.623 1.00 0.00 C ATOM 571 C ILE A 38 11.036 -3.610 0.062 1.00 0.00 C ATOM 572 O ILE A 38 10.945 -3.321 -1.131 1.00 0.00 O ATOM 573 CB ILE A 38 13.351 -3.093 0.858 1.00 0.00 C ATOM 574 CG1 ILE A 38 12.819 -2.081 1.875 1.00 0.00 C ATOM 575 CG2 ILE A 38 13.696 -2.403 -0.454 1.00 0.00 C ATOM 576 CD1 ILE A 38 13.890 -1.179 2.449 1.00 0.00 C ATOM 0 H ILE A 38 12.888 -4.972 -1.248 1.00 0.00 H new ATOM 0 HA ILE A 38 12.100 -4.699 1.575 1.00 0.00 H new ATOM 0 HB ILE A 38 14.260 -3.539 1.261 1.00 0.00 H new ATOM 0 HG12 ILE A 38 12.055 -1.466 1.398 1.00 0.00 H new ATOM 0 HG13 ILE A 38 12.333 -2.618 2.690 1.00 0.00 H new ATOM 0 HG21 ILE A 38 14.425 -1.614 -0.269 1.00 0.00 H new ATOM 0 HG22 ILE A 38 14.117 -3.131 -1.148 1.00 0.00 H new ATOM 0 HG23 ILE A 38 12.794 -1.970 -0.885 1.00 0.00 H new ATOM 0 HD11 ILE A 38 13.440 -0.488 3.162 1.00 0.00 H new ATOM 0 HD12 ILE A 38 14.642 -1.784 2.955 1.00 0.00 H new ATOM 0 HD13 ILE A 38 14.360 -0.614 1.644 1.00 0.00 H new ATOM 588 N PHE A 39 10.049 -3.421 0.931 1.00 0.00 N ATOM 589 CA PHE A 39 8.771 -2.849 0.522 1.00 0.00 C ATOM 590 C PHE A 39 8.608 -1.435 1.071 1.00 0.00 C ATOM 591 O PHE A 39 8.725 -1.209 2.275 1.00 0.00 O ATOM 592 CB PHE A 39 7.617 -3.732 1.002 1.00 0.00 C ATOM 593 CG PHE A 39 7.438 -4.982 0.189 1.00 0.00 C ATOM 594 CD1 PHE A 39 7.271 -4.913 -1.184 1.00 0.00 C ATOM 595 CD2 PHE A 39 7.437 -6.226 0.800 1.00 0.00 C ATOM 596 CE1 PHE A 39 7.106 -6.062 -1.934 1.00 0.00 C ATOM 597 CE2 PHE A 39 7.273 -7.378 0.056 1.00 0.00 C ATOM 598 CZ PHE A 39 7.107 -7.296 -1.314 1.00 0.00 C ATOM 0 H PHE A 39 10.109 -3.655 1.922 1.00 0.00 H new ATOM 0 HA PHE A 39 8.754 -2.801 -0.567 1.00 0.00 H new ATOM 0 HB2 PHE A 39 7.789 -4.007 2.043 1.00 0.00 H new ATOM 0 HB3 PHE A 39 6.693 -3.155 0.974 1.00 0.00 H new ATOM 0 HD1 PHE A 39 7.270 -3.951 -1.674 1.00 0.00 H new ATOM 0 HD2 PHE A 39 7.566 -6.295 1.870 1.00 0.00 H new ATOM 0 HE1 PHE A 39 6.976 -5.995 -3.004 1.00 0.00 H new ATOM 0 HE2 PHE A 39 7.274 -8.342 0.544 1.00 0.00 H new ATOM 0 HZ PHE A 39 6.978 -8.195 -1.898 1.00 0.00 H new ATOM 608 N GLU A 40 8.339 -0.487 0.180 1.00 0.00 N ATOM 609 CA GLU A 40 8.160 0.906 0.574 1.00 0.00 C ATOM 610 C GLU A 40 6.734 1.372 0.296 1.00 0.00 C ATOM 611 O GLU A 40 6.352 1.577 -0.856 1.00 0.00 O ATOM 612 CB GLU A 40 9.155 1.798 -0.168 1.00 0.00 C ATOM 613 CG GLU A 40 9.677 2.955 0.670 1.00 0.00 C ATOM 614 CD GLU A 40 10.737 3.765 -0.050 1.00 0.00 C ATOM 615 OE1 GLU A 40 10.712 3.799 -1.298 1.00 0.00 O ATOM 616 OE2 GLU A 40 11.592 4.365 0.634 1.00 0.00 O ATOM 0 H GLU A 40 8.240 -0.658 -0.821 1.00 0.00 H new ATOM 0 HA GLU A 40 8.344 0.981 1.646 1.00 0.00 H new ATOM 0 HB2 GLU A 40 9.998 1.191 -0.499 1.00 0.00 H new ATOM 0 HB3 GLU A 40 8.677 2.195 -1.063 1.00 0.00 H new ATOM 0 HG2 GLU A 40 8.846 3.608 0.939 1.00 0.00 H new ATOM 0 HG3 GLU A 40 10.091 2.567 1.600 1.00 0.00 H new ATOM 623 N ILE A 41 5.953 1.537 1.358 1.00 0.00 N ATOM 624 CA ILE A 41 4.571 1.979 1.229 1.00 0.00 C ATOM 625 C ILE A 41 4.433 3.455 1.588 1.00 0.00 C ATOM 626 O ILE A 41 4.657 3.849 2.732 1.00 0.00 O ATOM 627 CB ILE A 41 3.629 1.152 2.125 1.00 0.00 C ATOM 628 CG1 ILE A 41 3.865 -0.346 1.913 1.00 0.00 C ATOM 629 CG2 ILE A 41 2.178 1.510 1.840 1.00 0.00 C ATOM 630 CD1 ILE A 41 3.876 -1.143 3.199 1.00 0.00 C ATOM 0 H ILE A 41 6.255 1.371 2.318 1.00 0.00 H new ATOM 0 HA ILE A 41 4.287 1.832 0.187 1.00 0.00 H new ATOM 0 HB ILE A 41 3.845 1.389 3.167 1.00 0.00 H new ATOM 0 HG12 ILE A 41 3.088 -0.739 1.258 1.00 0.00 H new ATOM 0 HG13 ILE A 41 4.816 -0.487 1.399 1.00 0.00 H new ATOM 0 HG21 ILE A 41 1.525 0.918 2.481 1.00 0.00 H new ATOM 0 HG22 ILE A 41 2.019 2.570 2.040 1.00 0.00 H new ATOM 0 HG23 ILE A 41 1.950 1.300 0.795 1.00 0.00 H new ATOM 0 HD11 ILE A 41 4.048 -2.195 2.973 1.00 0.00 H new ATOM 0 HD12 ILE A 41 4.672 -0.776 3.848 1.00 0.00 H new ATOM 0 HD13 ILE A 41 2.916 -1.032 3.704 1.00 0.00 H new ATOM 642 N SER A 42 4.062 4.266 0.603 1.00 0.00 N ATOM 643 CA SER A 42 3.893 5.698 0.816 1.00 0.00 C ATOM 644 C SER A 42 2.422 6.047 1.046 1.00 0.00 C ATOM 645 O SER A 42 1.573 5.765 0.200 1.00 0.00 O ATOM 646 CB SER A 42 4.431 6.478 -0.385 1.00 0.00 C ATOM 647 OG SER A 42 5.840 6.605 -0.321 1.00 0.00 O ATOM 0 H SER A 42 3.873 3.956 -0.350 1.00 0.00 H new ATOM 0 HA SER A 42 4.457 5.977 1.706 1.00 0.00 H new ATOM 0 HB2 SER A 42 4.150 5.970 -1.308 1.00 0.00 H new ATOM 0 HB3 SER A 42 3.975 7.467 -0.414 1.00 0.00 H new ATOM 0 HG SER A 42 6.161 6.256 0.536 1.00 0.00 H new ATOM 653 N PRO A 43 2.096 6.666 2.195 1.00 0.00 N ATOM 654 CA PRO A 43 0.718 7.047 2.520 1.00 0.00 C ATOM 655 C PRO A 43 0.238 8.239 1.699 1.00 0.00 C ATOM 656 O PRO A 43 0.957 9.226 1.540 1.00 0.00 O ATOM 657 CB PRO A 43 0.794 7.416 4.001 1.00 0.00 C ATOM 658 CG PRO A 43 2.199 7.867 4.205 1.00 0.00 C ATOM 659 CD PRO A 43 3.040 7.044 3.266 1.00 0.00 C ATOM 0 HA PRO A 43 0.011 6.247 2.301 1.00 0.00 H new ATOM 0 HB2 PRO A 43 0.084 8.205 4.250 1.00 0.00 H new ATOM 0 HB3 PRO A 43 0.556 6.562 4.635 1.00 0.00 H new ATOM 0 HG2 PRO A 43 2.302 8.931 3.991 1.00 0.00 H new ATOM 0 HG3 PRO A 43 2.510 7.719 5.239 1.00 0.00 H new ATOM 0 HD2 PRO A 43 3.881 7.616 2.875 1.00 0.00 H new ATOM 0 HD3 PRO A 43 3.454 6.167 3.763 1.00 0.00 H new ATOM 667 N THR A 44 -0.981 8.141 1.180 1.00 0.00 N ATOM 668 CA THR A 44 -1.557 9.212 0.375 1.00 0.00 C ATOM 669 C THR A 44 -2.219 10.263 1.261 1.00 0.00 C ATOM 670 O THR A 44 -2.277 10.112 2.481 1.00 0.00 O ATOM 671 CB THR A 44 -2.579 8.643 -0.612 1.00 0.00 C ATOM 672 OG1 THR A 44 -3.563 7.884 0.067 1.00 0.00 O ATOM 673 CG2 THR A 44 -1.960 7.753 -1.667 1.00 0.00 C ATOM 0 H THR A 44 -1.589 7.331 1.302 1.00 0.00 H new ATOM 0 HA THR A 44 -0.750 9.688 -0.182 1.00 0.00 H new ATOM 0 HB THR A 44 -3.019 9.510 -1.104 1.00 0.00 H new ATOM 0 HG1 THR A 44 -3.584 6.975 -0.297 1.00 0.00 H new ATOM 0 HG21 THR A 44 -2.739 7.383 -2.334 1.00 0.00 H new ATOM 0 HG22 THR A 44 -1.231 8.324 -2.242 1.00 0.00 H new ATOM 0 HG23 THR A 44 -1.464 6.910 -1.186 1.00 0.00 H new ATOM 681 N GLU A 45 -2.716 11.326 0.639 1.00 0.00 N ATOM 682 CA GLU A 45 -3.375 12.402 1.371 1.00 0.00 C ATOM 683 C GLU A 45 -4.814 12.029 1.709 1.00 0.00 C ATOM 684 O GLU A 45 -5.350 12.449 2.735 1.00 0.00 O ATOM 685 CB GLU A 45 -3.349 13.694 0.551 1.00 0.00 C ATOM 686 CG GLU A 45 -3.165 14.945 1.394 1.00 0.00 C ATOM 687 CD GLU A 45 -3.181 16.214 0.564 1.00 0.00 C ATOM 688 OE1 GLU A 45 -2.534 16.232 -0.504 1.00 0.00 O ATOM 689 OE2 GLU A 45 -3.841 17.189 0.983 1.00 0.00 O ATOM 0 H GLU A 45 -2.675 11.466 -0.371 1.00 0.00 H new ATOM 0 HA GLU A 45 -2.832 12.560 2.303 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -2.541 13.635 -0.179 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -4.280 13.777 -0.010 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -3.956 14.994 2.142 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -2.220 14.880 1.933 1.00 0.00 H new ATOM 696 N GLU A 46 -5.435 11.237 0.841 1.00 0.00 N ATOM 697 CA GLU A 46 -6.812 10.806 1.048 1.00 0.00 C ATOM 698 C GLU A 46 -6.861 9.496 1.829 1.00 0.00 C ATOM 699 O GLU A 46 -5.825 8.952 2.212 1.00 0.00 O ATOM 700 CB GLU A 46 -7.525 10.639 -0.296 1.00 0.00 C ATOM 701 CG GLU A 46 -8.049 11.943 -0.873 1.00 0.00 C ATOM 702 CD GLU A 46 -6.954 12.788 -1.495 1.00 0.00 C ATOM 703 OE1 GLU A 46 -6.072 12.215 -2.168 1.00 0.00 O ATOM 704 OE2 GLU A 46 -6.979 14.023 -1.310 1.00 0.00 O ATOM 0 H GLU A 46 -5.006 10.881 -0.013 1.00 0.00 H new ATOM 0 HA GLU A 46 -7.323 11.574 1.629 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -6.836 10.187 -1.009 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -8.357 9.946 -0.173 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -8.806 11.724 -1.626 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -8.539 12.514 -0.084 1.00 0.00 H new ATOM 711 N VAL A 47 -8.070 8.995 2.062 1.00 0.00 N ATOM 712 CA VAL A 47 -8.253 7.750 2.796 1.00 0.00 C ATOM 713 C VAL A 47 -8.784 6.647 1.884 1.00 0.00 C ATOM 714 O VAL A 47 -9.441 6.922 0.880 1.00 0.00 O ATOM 715 CB VAL A 47 -9.220 7.936 3.983 1.00 0.00 C ATOM 716 CG1 VAL A 47 -10.595 8.365 3.495 1.00 0.00 C ATOM 717 CG2 VAL A 47 -9.311 6.658 4.806 1.00 0.00 C ATOM 0 H VAL A 47 -8.937 9.433 1.752 1.00 0.00 H new ATOM 0 HA VAL A 47 -7.275 7.459 3.178 1.00 0.00 H new ATOM 0 HB VAL A 47 -8.828 8.726 4.624 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -11.261 8.490 4.349 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -10.512 9.310 2.958 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -10.999 7.603 2.829 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -9.998 6.810 5.639 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -9.676 5.846 4.178 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -8.324 6.403 5.192 1.00 0.00 H new ATOM 727 N GLY A 48 -8.496 5.400 2.241 1.00 0.00 N ATOM 728 CA GLY A 48 -8.953 4.277 1.444 1.00 0.00 C ATOM 729 C GLY A 48 -7.909 3.809 0.449 1.00 0.00 C ATOM 730 O GLY A 48 -7.611 2.617 0.366 1.00 0.00 O ATOM 0 H GLY A 48 -7.955 5.147 3.068 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -9.218 3.451 2.104 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -9.859 4.560 0.909 1.00 0.00 H new ATOM 734 N ASP A 49 -7.352 4.748 -0.309 1.00 0.00 N ATOM 735 CA ASP A 49 -6.337 4.426 -1.304 1.00 0.00 C ATOM 736 C ASP A 49 -4.940 4.483 -0.693 1.00 0.00 C ATOM 737 O ASP A 49 -4.634 5.376 0.097 1.00 0.00 O ATOM 738 CB ASP A 49 -6.430 5.388 -2.490 1.00 0.00 C ATOM 739 CG ASP A 49 -6.380 4.667 -3.823 1.00 0.00 C ATOM 740 OD1 ASP A 49 -5.324 4.083 -4.142 1.00 0.00 O ATOM 741 OD2 ASP A 49 -7.396 4.689 -4.548 1.00 0.00 O ATOM 0 H ASP A 49 -7.587 5.739 -0.253 1.00 0.00 H new ATOM 0 HA ASP A 49 -6.518 3.411 -1.657 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -7.358 5.956 -2.422 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -5.612 6.106 -2.437 1.00 0.00 H new ATOM 746 N PHE A 50 -4.097 3.525 -1.063 1.00 0.00 N ATOM 747 CA PHE A 50 -2.732 3.468 -0.552 1.00 0.00 C ATOM 748 C PHE A 50 -1.726 3.386 -1.695 1.00 0.00 C ATOM 749 O PHE A 50 -2.023 2.848 -2.761 1.00 0.00 O ATOM 750 CB PHE A 50 -2.565 2.264 0.378 1.00 0.00 C ATOM 751 CG PHE A 50 -3.627 2.169 1.435 1.00 0.00 C ATOM 752 CD1 PHE A 50 -3.981 3.281 2.182 1.00 0.00 C ATOM 753 CD2 PHE A 50 -4.272 0.967 1.682 1.00 0.00 C ATOM 754 CE1 PHE A 50 -4.959 3.197 3.155 1.00 0.00 C ATOM 755 CE2 PHE A 50 -5.250 0.876 2.654 1.00 0.00 C ATOM 756 CZ PHE A 50 -5.594 1.993 3.392 1.00 0.00 C ATOM 0 H PHE A 50 -4.335 2.777 -1.715 1.00 0.00 H new ATOM 0 HA PHE A 50 -2.541 4.382 0.010 1.00 0.00 H new ATOM 0 HB2 PHE A 50 -2.574 1.351 -0.218 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -1.589 2.320 0.860 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -3.487 4.224 2.002 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -4.007 0.091 1.108 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -5.227 4.072 3.729 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -5.745 -0.066 2.837 1.00 0.00 H new ATOM 0 HZ PHE A 50 -6.358 1.925 4.153 1.00 0.00 H new ATOM 766 N GLU A 51 -0.532 3.924 -1.464 1.00 0.00 N ATOM 767 CA GLU A 51 0.519 3.912 -2.476 1.00 0.00 C ATOM 768 C GLU A 51 1.631 2.941 -2.092 1.00 0.00 C ATOM 769 O GLU A 51 2.388 3.187 -1.154 1.00 0.00 O ATOM 770 CB GLU A 51 1.096 5.318 -2.659 1.00 0.00 C ATOM 771 CG GLU A 51 1.566 5.602 -4.076 1.00 0.00 C ATOM 772 CD GLU A 51 0.490 6.245 -4.930 1.00 0.00 C ATOM 773 OE1 GLU A 51 0.020 7.342 -4.564 1.00 0.00 O ATOM 774 OE2 GLU A 51 0.118 5.650 -5.964 1.00 0.00 O ATOM 0 H GLU A 51 -0.269 4.373 -0.587 1.00 0.00 H new ATOM 0 HA GLU A 51 0.080 3.581 -3.417 1.00 0.00 H new ATOM 0 HB2 GLU A 51 0.339 6.051 -2.382 1.00 0.00 H new ATOM 0 HB3 GLU A 51 1.933 5.450 -1.974 1.00 0.00 H new ATOM 0 HG2 GLU A 51 2.437 6.257 -4.042 1.00 0.00 H new ATOM 0 HG3 GLU A 51 1.886 4.670 -4.542 1.00 0.00 H new ATOM 781 N VAL A 52 1.722 1.836 -2.826 1.00 0.00 N ATOM 782 CA VAL A 52 2.741 0.827 -2.563 1.00 0.00 C ATOM 783 C VAL A 52 3.766 0.774 -3.691 1.00 0.00 C ATOM 784 O VAL A 52 3.408 0.717 -4.867 1.00 0.00 O ATOM 785 CB VAL A 52 2.118 -0.570 -2.387 1.00 0.00 C ATOM 786 CG1 VAL A 52 3.164 -1.568 -1.916 1.00 0.00 C ATOM 787 CG2 VAL A 52 0.949 -0.514 -1.415 1.00 0.00 C ATOM 0 H VAL A 52 1.103 1.617 -3.607 1.00 0.00 H new ATOM 0 HA VAL A 52 3.237 1.115 -1.636 1.00 0.00 H new ATOM 0 HB VAL A 52 1.742 -0.904 -3.354 1.00 0.00 H new ATOM 0 HG11 VAL A 52 2.704 -2.549 -1.798 1.00 0.00 H new ATOM 0 HG12 VAL A 52 3.966 -1.630 -2.652 1.00 0.00 H new ATOM 0 HG13 VAL A 52 3.574 -1.242 -0.960 1.00 0.00 H new ATOM 0 HG21 VAL A 52 0.521 -1.510 -1.303 1.00 0.00 H new ATOM 0 HG22 VAL A 52 1.298 -0.158 -0.446 1.00 0.00 H new ATOM 0 HG23 VAL A 52 0.189 0.166 -1.799 1.00 0.00 H new ATOM 797 N LYS A 53 5.044 0.794 -3.324 1.00 0.00 N ATOM 798 CA LYS A 53 6.122 0.749 -4.304 1.00 0.00 C ATOM 799 C LYS A 53 7.065 -0.417 -4.021 1.00 0.00 C ATOM 800 O LYS A 53 7.251 -0.812 -2.871 1.00 0.00 O ATOM 801 CB LYS A 53 6.903 2.063 -4.296 1.00 0.00 C ATOM 802 CG LYS A 53 7.878 2.199 -5.454 1.00 0.00 C ATOM 803 CD LYS A 53 8.076 3.654 -5.849 1.00 0.00 C ATOM 804 CE LYS A 53 8.237 3.806 -7.354 1.00 0.00 C ATOM 805 NZ LYS A 53 7.848 5.165 -7.820 1.00 0.00 N ATOM 0 H LYS A 53 5.357 0.841 -2.355 1.00 0.00 H new ATOM 0 HA LYS A 53 5.678 0.605 -5.289 1.00 0.00 H new ATOM 0 HB2 LYS A 53 6.199 2.895 -4.325 1.00 0.00 H new ATOM 0 HB3 LYS A 53 7.452 2.144 -3.358 1.00 0.00 H new ATOM 0 HG2 LYS A 53 8.837 1.763 -5.176 1.00 0.00 H new ATOM 0 HG3 LYS A 53 7.508 1.636 -6.311 1.00 0.00 H new ATOM 0 HD2 LYS A 53 7.223 4.243 -5.512 1.00 0.00 H new ATOM 0 HD3 LYS A 53 8.957 4.052 -5.346 1.00 0.00 H new ATOM 0 HE2 LYS A 53 9.273 3.611 -7.630 1.00 0.00 H new ATOM 0 HE3 LYS A 53 7.626 3.060 -7.862 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 8.144 5.291 -8.809 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 6.816 5.273 -7.751 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 8.312 5.882 -7.226 1.00 0.00 H new ATOM 819 N ALA A 54 7.657 -0.963 -5.079 1.00 0.00 N ATOM 820 CA ALA A 54 8.580 -2.083 -4.945 1.00 0.00 C ATOM 821 C ALA A 54 9.980 -1.699 -5.408 1.00 0.00 C ATOM 822 O ALA A 54 10.187 -1.352 -6.571 1.00 0.00 O ATOM 823 CB ALA A 54 8.072 -3.281 -5.732 1.00 0.00 C ATOM 0 H ALA A 54 7.513 -0.647 -6.038 1.00 0.00 H new ATOM 0 HA ALA A 54 8.636 -2.352 -3.890 1.00 0.00 H new ATOM 0 HB1 ALA A 54 8.771 -4.111 -5.623 1.00 0.00 H new ATOM 0 HB2 ALA A 54 7.094 -3.578 -5.352 1.00 0.00 H new ATOM 0 HB3 ALA A 54 7.986 -3.014 -6.785 1.00 0.00 H new ATOM 829 N LYS A 55 10.940 -1.763 -4.491 1.00 0.00 N ATOM 830 CA LYS A 55 12.322 -1.421 -4.806 1.00 0.00 C ATOM 831 C LYS A 55 12.969 -2.507 -5.660 1.00 0.00 C ATOM 832 O LYS A 55 13.345 -3.565 -5.157 1.00 0.00 O ATOM 833 CB LYS A 55 13.127 -1.222 -3.518 1.00 0.00 C ATOM 834 CG LYS A 55 13.223 0.232 -3.082 1.00 0.00 C ATOM 835 CD LYS A 55 14.414 0.927 -3.722 1.00 0.00 C ATOM 836 CE LYS A 55 14.614 2.324 -3.155 1.00 0.00 C ATOM 837 NZ LYS A 55 15.320 3.217 -4.115 1.00 0.00 N ATOM 0 H LYS A 55 10.786 -2.049 -3.524 1.00 0.00 H new ATOM 0 HA LYS A 55 12.320 -0.490 -5.373 1.00 0.00 H new ATOM 0 HB2 LYS A 55 12.668 -1.803 -2.718 1.00 0.00 H new ATOM 0 HB3 LYS A 55 14.133 -1.617 -3.663 1.00 0.00 H new ATOM 0 HG2 LYS A 55 12.306 0.756 -3.353 1.00 0.00 H new ATOM 0 HG3 LYS A 55 13.311 0.283 -1.997 1.00 0.00 H new ATOM 0 HD2 LYS A 55 15.314 0.334 -3.558 1.00 0.00 H new ATOM 0 HD3 LYS A 55 14.265 0.988 -4.800 1.00 0.00 H new ATOM 0 HE2 LYS A 55 13.645 2.756 -2.903 1.00 0.00 H new ATOM 0 HE3 LYS A 55 15.186 2.262 -2.229 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 15.437 4.159 -3.691 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 16.255 2.819 -4.336 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 14.762 3.297 -4.989 1.00 0.00 H new ATOM 851 N PHE A 56 13.094 -2.237 -6.955 1.00 0.00 N ATOM 852 CA PHE A 56 13.695 -3.191 -7.881 1.00 0.00 C ATOM 853 C PHE A 56 13.796 -2.599 -9.283 1.00 0.00 C ATOM 854 O PHE A 56 14.894 -2.384 -9.799 1.00 0.00 O ATOM 855 CB PHE A 56 12.877 -4.485 -7.913 1.00 0.00 C ATOM 856 CG PHE A 56 13.654 -5.695 -7.480 1.00 0.00 C ATOM 857 CD1 PHE A 56 14.566 -6.292 -8.335 1.00 0.00 C ATOM 858 CD2 PHE A 56 13.470 -6.237 -6.218 1.00 0.00 C ATOM 859 CE1 PHE A 56 15.281 -7.407 -7.940 1.00 0.00 C ATOM 860 CE2 PHE A 56 14.183 -7.351 -5.817 1.00 0.00 C ATOM 861 CZ PHE A 56 15.089 -7.936 -6.678 1.00 0.00 C ATOM 0 H PHE A 56 12.787 -1.366 -7.387 1.00 0.00 H new ATOM 0 HA PHE A 56 14.702 -3.416 -7.531 1.00 0.00 H new ATOM 0 HB2 PHE A 56 12.007 -4.371 -7.267 1.00 0.00 H new ATOM 0 HB3 PHE A 56 12.504 -4.645 -8.925 1.00 0.00 H new ATOM 0 HD1 PHE A 56 14.720 -5.881 -9.322 1.00 0.00 H new ATOM 0 HD2 PHE A 56 12.762 -5.784 -5.540 1.00 0.00 H new ATOM 0 HE1 PHE A 56 15.988 -7.864 -8.616 1.00 0.00 H new ATOM 0 HE2 PHE A 56 14.031 -7.763 -4.830 1.00 0.00 H new ATOM 0 HZ PHE A 56 15.647 -8.806 -6.366 1.00 0.00 H new ATOM 871 N MET A 57 12.646 -2.336 -9.893 1.00 0.00 N ATOM 872 CA MET A 57 12.606 -1.768 -11.236 1.00 0.00 C ATOM 873 C MET A 57 11.533 -0.688 -11.338 1.00 0.00 C ATOM 874 O MET A 57 10.524 -0.860 -12.024 1.00 0.00 O ATOM 875 CB MET A 57 12.344 -2.867 -12.268 1.00 0.00 C ATOM 876 CG MET A 57 13.058 -2.642 -13.591 1.00 0.00 C ATOM 877 SD MET A 57 14.616 -3.543 -13.702 1.00 0.00 S ATOM 878 CE MET A 57 14.833 -3.628 -15.477 1.00 0.00 C ATOM 0 H MET A 57 11.729 -2.507 -9.480 1.00 0.00 H new ATOM 0 HA MET A 57 13.574 -1.311 -11.441 1.00 0.00 H new ATOM 0 HB2 MET A 57 12.658 -3.825 -11.854 1.00 0.00 H new ATOM 0 HB3 MET A 57 11.271 -2.934 -12.450 1.00 0.00 H new ATOM 0 HG2 MET A 57 12.406 -2.950 -14.408 1.00 0.00 H new ATOM 0 HG3 MET A 57 13.249 -1.577 -13.720 1.00 0.00 H new ATOM 0 HE1 MET A 57 15.757 -4.159 -15.706 1.00 0.00 H new ATOM 0 HE2 MET A 57 13.991 -4.158 -15.922 1.00 0.00 H new ATOM 0 HE3 MET A 57 14.883 -2.619 -15.886 1.00 0.00 H new ATOM 888 N GLY A 58 11.757 0.427 -10.649 1.00 0.00 N ATOM 889 CA GLY A 58 10.802 1.519 -10.674 1.00 0.00 C ATOM 890 C GLY A 58 11.374 2.774 -11.304 1.00 0.00 C ATOM 891 O GLY A 58 10.989 3.887 -10.947 1.00 0.00 O ATOM 0 H GLY A 58 12.583 0.593 -10.074 1.00 0.00 H new ATOM 0 HA2 GLY A 58 9.915 1.210 -11.227 1.00 0.00 H new ATOM 0 HA3 GLY A 58 10.481 1.741 -9.656 1.00 0.00 H new ATOM 895 N VAL A 59 12.296 2.594 -12.244 1.00 0.00 N ATOM 896 CA VAL A 59 12.922 3.721 -12.926 1.00 0.00 C ATOM 897 C VAL A 59 12.021 4.266 -14.028 1.00 0.00 C ATOM 898 O VAL A 59 12.044 5.459 -14.329 1.00 0.00 O ATOM 899 CB VAL A 59 14.279 3.325 -13.537 1.00 0.00 C ATOM 900 CG1 VAL A 59 15.005 4.551 -14.066 1.00 0.00 C ATOM 901 CG2 VAL A 59 15.132 2.591 -12.513 1.00 0.00 C ATOM 0 H VAL A 59 12.626 1.679 -12.551 1.00 0.00 H new ATOM 0 HA VAL A 59 13.082 4.495 -12.175 1.00 0.00 H new ATOM 0 HB VAL A 59 14.097 2.651 -14.374 1.00 0.00 H new ATOM 0 HG11 VAL A 59 15.962 4.251 -14.494 1.00 0.00 H new ATOM 0 HG12 VAL A 59 14.398 5.030 -14.834 1.00 0.00 H new ATOM 0 HG13 VAL A 59 15.177 5.253 -13.250 1.00 0.00 H new ATOM 0 HG21 VAL A 59 16.087 2.319 -12.963 1.00 0.00 H new ATOM 0 HG22 VAL A 59 15.307 3.239 -11.654 1.00 0.00 H new ATOM 0 HG23 VAL A 59 14.614 1.689 -12.188 1.00 0.00 H new ATOM 911 N GLN A 60 11.228 3.384 -14.628 1.00 0.00 N ATOM 912 CA GLN A 60 10.318 3.777 -15.697 1.00 0.00 C ATOM 913 C GLN A 60 8.934 3.173 -15.483 1.00 0.00 C ATOM 914 O GLN A 60 8.230 2.855 -16.442 1.00 0.00 O ATOM 915 CB GLN A 60 10.874 3.339 -17.053 1.00 0.00 C ATOM 916 CG GLN A 60 11.295 1.878 -17.096 1.00 0.00 C ATOM 917 CD GLN A 60 10.808 1.167 -18.343 1.00 0.00 C ATOM 918 OE1 GLN A 60 10.117 0.152 -18.262 1.00 0.00 O ATOM 919 NE2 GLN A 60 11.168 1.698 -19.506 1.00 0.00 N ATOM 0 H GLN A 60 11.197 2.392 -14.392 1.00 0.00 H new ATOM 0 HA GLN A 60 10.226 4.863 -15.682 1.00 0.00 H new ATOM 0 HB2 GLN A 60 10.119 3.513 -17.819 1.00 0.00 H new ATOM 0 HB3 GLN A 60 11.732 3.963 -17.303 1.00 0.00 H new ATOM 0 HG2 GLN A 60 12.382 1.816 -17.048 1.00 0.00 H new ATOM 0 HG3 GLN A 60 10.907 1.366 -16.215 1.00 0.00 H new ATOM 0 HE21 GLN A 60 11.742 2.541 -19.526 1.00 0.00 H new ATOM 0 HE22 GLN A 60 10.870 1.263 -20.379 1.00 0.00 H new ATOM 928 N MET A 61 8.551 3.018 -14.221 1.00 0.00 N ATOM 929 CA MET A 61 7.250 2.452 -13.881 1.00 0.00 C ATOM 930 C MET A 61 6.539 3.309 -12.838 1.00 0.00 C ATOM 931 O MET A 61 7.178 4.044 -12.084 1.00 0.00 O ATOM 932 CB MET A 61 7.413 1.023 -13.358 1.00 0.00 C ATOM 933 CG MET A 61 6.093 0.306 -13.128 1.00 0.00 C ATOM 934 SD MET A 61 6.310 -1.449 -12.774 1.00 0.00 S ATOM 935 CE MET A 61 4.705 -2.090 -13.246 1.00 0.00 C ATOM 0 H MET A 61 9.122 3.276 -13.416 1.00 0.00 H new ATOM 0 HA MET A 61 6.642 2.434 -14.786 1.00 0.00 H new ATOM 0 HB2 MET A 61 8.009 0.451 -14.069 1.00 0.00 H new ATOM 0 HB3 MET A 61 7.971 1.049 -12.422 1.00 0.00 H new ATOM 0 HG2 MET A 61 5.567 0.778 -12.298 1.00 0.00 H new ATOM 0 HG3 MET A 61 5.463 0.420 -14.010 1.00 0.00 H new ATOM 0 HE1 MET A 61 4.682 -3.168 -13.084 1.00 0.00 H new ATOM 0 HE2 MET A 61 3.932 -1.616 -12.642 1.00 0.00 H new ATOM 0 HE3 MET A 61 4.524 -1.877 -14.299 1.00 0.00 H new ATOM 945 N GLU A 62 5.215 3.209 -12.801 1.00 0.00 N ATOM 946 CA GLU A 62 4.417 3.976 -11.851 1.00 0.00 C ATOM 947 C GLU A 62 4.243 3.207 -10.544 1.00 0.00 C ATOM 948 O GLU A 62 4.568 2.023 -10.461 1.00 0.00 O ATOM 949 CB GLU A 62 3.048 4.304 -12.453 1.00 0.00 C ATOM 950 CG GLU A 62 2.659 5.767 -12.315 1.00 0.00 C ATOM 951 CD GLU A 62 1.939 6.295 -13.540 1.00 0.00 C ATOM 952 OE1 GLU A 62 2.593 6.451 -14.593 1.00 0.00 O ATOM 953 OE2 GLU A 62 0.720 6.554 -13.448 1.00 0.00 O ATOM 0 H GLU A 62 4.672 2.605 -13.417 1.00 0.00 H new ATOM 0 HA GLU A 62 4.943 4.906 -11.636 1.00 0.00 H new ATOM 0 HB2 GLU A 62 3.051 4.035 -13.509 1.00 0.00 H new ATOM 0 HB3 GLU A 62 2.290 3.688 -11.969 1.00 0.00 H new ATOM 0 HG2 GLU A 62 2.019 5.888 -11.441 1.00 0.00 H new ATOM 0 HG3 GLU A 62 3.555 6.363 -12.139 1.00 0.00 H new ATOM 960 N THR A 63 3.729 3.891 -9.526 1.00 0.00 N ATOM 961 CA THR A 63 3.513 3.272 -8.224 1.00 0.00 C ATOM 962 C THR A 63 2.159 2.572 -8.171 1.00 0.00 C ATOM 963 O THR A 63 1.126 3.172 -8.468 1.00 0.00 O ATOM 964 CB THR A 63 3.598 4.323 -7.116 1.00 0.00 C ATOM 965 OG1 THR A 63 4.487 5.365 -7.480 1.00 0.00 O ATOM 966 CG2 THR A 63 4.068 3.761 -5.792 1.00 0.00 C ATOM 0 H THR A 63 3.455 4.872 -9.578 1.00 0.00 H new ATOM 0 HA THR A 63 4.294 2.527 -8.071 1.00 0.00 H new ATOM 0 HB THR A 63 2.581 4.696 -6.994 1.00 0.00 H new ATOM 0 HG1 THR A 63 4.526 6.028 -6.759 1.00 0.00 H new ATOM 0 HG21 THR A 63 4.106 4.559 -5.051 1.00 0.00 H new ATOM 0 HG22 THR A 63 3.375 2.988 -5.458 1.00 0.00 H new ATOM 0 HG23 THR A 63 5.062 3.330 -5.912 1.00 0.00 H new ATOM 974 N PHE A 64 2.172 1.298 -7.793 1.00 0.00 N ATOM 975 CA PHE A 64 0.945 0.515 -7.702 1.00 0.00 C ATOM 976 C PHE A 64 0.002 1.101 -6.657 1.00 0.00 C ATOM 977 O PHE A 64 0.399 1.346 -5.517 1.00 0.00 O ATOM 978 CB PHE A 64 1.267 -0.941 -7.357 1.00 0.00 C ATOM 979 CG PHE A 64 0.072 -1.848 -7.415 1.00 0.00 C ATOM 980 CD1 PHE A 64 -0.796 -1.806 -8.494 1.00 0.00 C ATOM 981 CD2 PHE A 64 -0.183 -2.746 -6.391 1.00 0.00 C ATOM 982 CE1 PHE A 64 -1.896 -2.640 -8.551 1.00 0.00 C ATOM 983 CE2 PHE A 64 -1.281 -3.583 -6.442 1.00 0.00 C ATOM 984 CZ PHE A 64 -2.139 -3.530 -7.522 1.00 0.00 C ATOM 0 H PHE A 64 3.018 0.786 -7.545 1.00 0.00 H new ATOM 0 HA PHE A 64 0.450 0.549 -8.672 1.00 0.00 H new ATOM 0 HB2 PHE A 64 2.027 -1.310 -8.046 1.00 0.00 H new ATOM 0 HB3 PHE A 64 1.697 -0.983 -6.356 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -0.610 -1.112 -9.301 1.00 0.00 H new ATOM 0 HD2 PHE A 64 0.484 -2.792 -5.543 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -2.565 -2.597 -9.398 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -1.468 -4.278 -5.637 1.00 0.00 H new ATOM 0 HZ PHE A 64 -2.998 -4.183 -7.563 1.00 0.00 H new ATOM 994 N MET A 65 -1.247 1.323 -7.051 1.00 0.00 N ATOM 995 CA MET A 65 -2.246 1.881 -6.148 1.00 0.00 C ATOM 996 C MET A 65 -3.149 0.784 -5.591 1.00 0.00 C ATOM 997 O MET A 65 -4.019 0.267 -6.292 1.00 0.00 O ATOM 998 CB MET A 65 -3.087 2.935 -6.873 1.00 0.00 C ATOM 999 CG MET A 65 -3.031 4.308 -6.224 1.00 0.00 C ATOM 1000 SD MET A 65 -4.089 5.511 -7.052 1.00 0.00 S ATOM 1001 CE MET A 65 -3.213 7.033 -6.698 1.00 0.00 C ATOM 0 H MET A 65 -1.592 1.125 -7.990 1.00 0.00 H new ATOM 0 HA MET A 65 -1.725 2.353 -5.315 1.00 0.00 H new ATOM 0 HB2 MET A 65 -2.744 3.015 -7.904 1.00 0.00 H new ATOM 0 HB3 MET A 65 -4.124 2.600 -6.907 1.00 0.00 H new ATOM 0 HG2 MET A 65 -3.331 4.224 -5.179 1.00 0.00 H new ATOM 0 HG3 MET A 65 -2.002 4.668 -6.232 1.00 0.00 H new ATOM 0 HE1 MET A 65 -3.746 7.872 -7.146 1.00 0.00 H new ATOM 0 HE2 MET A 65 -3.153 7.176 -5.619 1.00 0.00 H new ATOM 0 HE3 MET A 65 -2.207 6.979 -7.114 1.00 0.00 H new ATOM 1011 N LEU A 66 -2.936 0.433 -4.327 1.00 0.00 N ATOM 1012 CA LEU A 66 -3.729 -0.604 -3.677 1.00 0.00 C ATOM 1013 C LEU A 66 -5.039 -0.030 -3.145 1.00 0.00 C ATOM 1014 O LEU A 66 -5.039 0.866 -2.300 1.00 0.00 O ATOM 1015 CB LEU A 66 -2.937 -1.242 -2.535 1.00 0.00 C ATOM 1016 CG LEU A 66 -3.644 -2.397 -1.823 1.00 0.00 C ATOM 1017 CD1 LEU A 66 -3.837 -3.571 -2.772 1.00 0.00 C ATOM 1018 CD2 LEU A 66 -2.855 -2.827 -0.595 1.00 0.00 C ATOM 0 H LEU A 66 -2.221 0.852 -3.732 1.00 0.00 H new ATOM 0 HA LEU A 66 -3.961 -1.369 -4.418 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -1.988 -1.605 -2.930 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -2.703 -0.471 -1.801 1.00 0.00 H new ATOM 0 HG LEU A 66 -4.626 -2.053 -1.499 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -4.341 -4.383 -2.248 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -4.442 -3.256 -3.622 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -2.866 -3.916 -3.126 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -3.372 -3.649 -0.100 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -1.860 -3.153 -0.898 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -2.767 -1.987 0.094 1.00 0.00 H new ATOM 1030 N HIS A 67 -6.154 -0.554 -3.644 1.00 0.00 N ATOM 1031 CA HIS A 67 -7.471 -0.094 -3.219 1.00 0.00 C ATOM 1032 C HIS A 67 -7.928 -0.835 -1.966 1.00 0.00 C ATOM 1033 O HIS A 67 -7.460 -1.937 -1.680 1.00 0.00 O ATOM 1034 CB HIS A 67 -8.490 -0.291 -4.342 1.00 0.00 C ATOM 1035 CG HIS A 67 -8.117 0.400 -5.617 1.00 0.00 C ATOM 1036 ND1 HIS A 67 -7.061 0.000 -6.408 1.00 0.00 N ATOM 1037 CD2 HIS A 67 -8.665 1.472 -6.238 1.00 0.00 C ATOM 1038 CE1 HIS A 67 -6.976 0.796 -7.460 1.00 0.00 C ATOM 1039 NE2 HIS A 67 -7.938 1.696 -7.380 1.00 0.00 N ATOM 0 H HIS A 67 -6.172 -1.297 -4.343 1.00 0.00 H new ATOM 0 HA HIS A 67 -7.399 0.968 -2.985 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -8.603 -1.358 -4.536 1.00 0.00 H new ATOM 0 HB3 HIS A 67 -9.461 0.077 -4.009 1.00 0.00 H new ATOM 0 HD2 HIS A 67 -9.516 2.044 -5.898 1.00 0.00 H new ATOM 0 HE1 HIS A 67 -6.244 0.722 -8.251 1.00 0.00 H new ATOM 0 HE2 HIS A 67 -8.113 2.438 -8.058 1.00 0.00 H new ATOM 1048 N TYR A 68 -8.843 -0.223 -1.223 1.00 0.00 N ATOM 1049 CA TYR A 68 -9.363 -0.826 -0.001 1.00 0.00 C ATOM 1050 C TYR A 68 -10.501 -1.792 -0.313 1.00 0.00 C ATOM 1051 O TYR A 68 -10.569 -2.887 0.246 1.00 0.00 O ATOM 1052 CB TYR A 68 -9.850 0.260 0.961 1.00 0.00 C ATOM 1053 CG TYR A 68 -9.805 -0.154 2.415 1.00 0.00 C ATOM 1054 CD1 TYR A 68 -8.597 -0.451 3.034 1.00 0.00 C ATOM 1055 CD2 TYR A 68 -10.969 -0.247 3.166 1.00 0.00 C ATOM 1056 CE1 TYR A 68 -8.552 -0.830 4.363 1.00 0.00 C ATOM 1057 CE2 TYR A 68 -10.932 -0.625 4.495 1.00 0.00 C ATOM 1058 CZ TYR A 68 -9.721 -0.916 5.088 1.00 0.00 C ATOM 1059 OH TYR A 68 -9.680 -1.292 6.411 1.00 0.00 O ATOM 0 H TYR A 68 -9.240 0.690 -1.445 1.00 0.00 H new ATOM 0 HA TYR A 68 -8.555 -1.385 0.471 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -9.239 1.153 0.827 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -10.873 0.532 0.701 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -7.679 -0.385 2.469 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -11.919 -0.020 2.704 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -7.605 -1.058 4.831 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -11.846 -0.692 5.066 1.00 0.00 H new ATOM 0 HH TYR A 68 -9.485 -0.509 6.968 1.00 0.00 H new ATOM 1069 N GLN A 69 -11.392 -1.380 -1.208 1.00 0.00 N ATOM 1070 CA GLN A 69 -12.528 -2.210 -1.594 1.00 0.00 C ATOM 1071 C GLN A 69 -12.057 -3.531 -2.196 1.00 0.00 C ATOM 1072 O GLN A 69 -12.622 -4.588 -1.918 1.00 0.00 O ATOM 1073 CB GLN A 69 -13.413 -1.467 -2.597 1.00 0.00 C ATOM 1074 CG GLN A 69 -14.421 -0.535 -1.945 1.00 0.00 C ATOM 1075 CD GLN A 69 -15.313 -1.248 -0.949 1.00 0.00 C ATOM 1076 OE1 GLN A 69 -15.415 -2.475 -0.955 1.00 0.00 O ATOM 1077 NE2 GLN A 69 -15.967 -0.480 -0.085 1.00 0.00 N ATOM 0 H GLN A 69 -11.350 -0.477 -1.680 1.00 0.00 H new ATOM 0 HA GLN A 69 -13.109 -2.426 -0.697 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -12.779 -0.890 -3.270 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -13.946 -2.195 -3.208 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -13.890 0.272 -1.440 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -15.039 -0.076 -2.717 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -15.853 0.533 -0.115 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -16.583 -0.903 0.609 1.00 0.00 H new ATOM 1086 N ASP A 70 -11.017 -3.461 -3.022 1.00 0.00 N ATOM 1087 CA ASP A 70 -10.470 -4.651 -3.663 1.00 0.00 C ATOM 1088 C ASP A 70 -9.983 -5.655 -2.622 1.00 0.00 C ATOM 1089 O ASP A 70 -10.123 -6.865 -2.799 1.00 0.00 O ATOM 1090 CB ASP A 70 -9.320 -4.269 -4.597 1.00 0.00 C ATOM 1091 CG ASP A 70 -9.770 -3.365 -5.727 1.00 0.00 C ATOM 1092 OD1 ASP A 70 -10.779 -2.650 -5.550 1.00 0.00 O ATOM 1093 OD2 ASP A 70 -9.112 -3.369 -6.790 1.00 0.00 O ATOM 0 H ASP A 70 -10.537 -2.594 -3.262 1.00 0.00 H new ATOM 0 HA ASP A 70 -11.264 -5.117 -4.247 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -8.540 -3.768 -4.023 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -8.878 -5.174 -5.013 1.00 0.00 H new ATOM 1098 N LEU A 71 -9.409 -5.143 -1.538 1.00 0.00 N ATOM 1099 CA LEU A 71 -8.901 -5.995 -0.469 1.00 0.00 C ATOM 1100 C LEU A 71 -10.042 -6.708 0.248 1.00 0.00 C ATOM 1101 O LEU A 71 -10.020 -7.928 0.410 1.00 0.00 O ATOM 1102 CB LEU A 71 -8.096 -5.164 0.533 1.00 0.00 C ATOM 1103 CG LEU A 71 -6.714 -4.723 0.046 1.00 0.00 C ATOM 1104 CD1 LEU A 71 -5.977 -3.971 1.143 1.00 0.00 C ATOM 1105 CD2 LEU A 71 -5.904 -5.925 -0.418 1.00 0.00 C ATOM 0 H LEU A 71 -9.284 -4.144 -1.377 1.00 0.00 H new ATOM 0 HA LEU A 71 -8.250 -6.747 -0.916 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -8.673 -4.277 0.793 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -7.974 -5.744 1.448 1.00 0.00 H new ATOM 0 HG LEU A 71 -6.845 -4.050 -0.801 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -4.996 -3.665 0.779 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -6.550 -3.088 1.427 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -5.856 -4.620 2.011 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -4.924 -5.593 -0.761 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -5.781 -6.623 0.410 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -6.426 -6.421 -1.236 1.00 0.00 H new ATOM 1117 N LEU A 72 -11.039 -5.940 0.675 1.00 0.00 N ATOM 1118 CA LEU A 72 -12.190 -6.498 1.374 1.00 0.00 C ATOM 1119 C LEU A 72 -12.969 -7.448 0.470 1.00 0.00 C ATOM 1120 O LEU A 72 -13.577 -8.410 0.940 1.00 0.00 O ATOM 1121 CB LEU A 72 -13.107 -5.377 1.867 1.00 0.00 C ATOM 1122 CG LEU A 72 -12.438 -4.345 2.776 1.00 0.00 C ATOM 1123 CD1 LEU A 72 -13.218 -3.039 2.766 1.00 0.00 C ATOM 1124 CD2 LEU A 72 -12.317 -4.884 4.194 1.00 0.00 C ATOM 0 H LEU A 72 -11.073 -4.928 0.549 1.00 0.00 H new ATOM 0 HA LEU A 72 -11.823 -7.062 2.232 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -13.522 -4.861 1.001 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -13.944 -5.823 2.404 1.00 0.00 H new ATOM 0 HG LEU A 72 -11.436 -4.149 2.395 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -12.727 -2.317 3.418 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -13.254 -2.645 1.750 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -14.233 -3.218 3.122 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -11.839 -4.137 4.828 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -13.310 -5.109 4.584 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -11.716 -5.793 4.188 1.00 0.00 H new ATOM 1136 N GLN A 73 -12.947 -7.171 -0.829 1.00 0.00 N ATOM 1137 CA GLN A 73 -13.653 -8.001 -1.799 1.00 0.00 C ATOM 1138 C GLN A 73 -13.139 -9.437 -1.763 1.00 0.00 C ATOM 1139 O GLN A 73 -13.888 -10.382 -2.009 1.00 0.00 O ATOM 1140 CB GLN A 73 -13.494 -7.425 -3.207 1.00 0.00 C ATOM 1141 CG GLN A 73 -14.783 -7.424 -4.013 1.00 0.00 C ATOM 1142 CD GLN A 73 -14.627 -8.085 -5.368 1.00 0.00 C ATOM 1143 OE1 GLN A 73 -14.528 -7.411 -6.394 1.00 0.00 O ATOM 1144 NE2 GLN A 73 -14.603 -9.413 -5.380 1.00 0.00 N ATOM 0 H GLN A 73 -12.449 -6.379 -1.235 1.00 0.00 H new ATOM 0 HA GLN A 73 -14.710 -8.006 -1.534 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -13.121 -6.404 -3.133 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -12.740 -8.001 -3.743 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -15.560 -7.940 -3.449 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -15.119 -6.396 -4.151 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -14.688 -9.933 -4.506 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -14.499 -9.913 -6.263 1.00 0.00 H new ATOM 1153 N LEU A 74 -11.855 -9.594 -1.453 1.00 0.00 N ATOM 1154 CA LEU A 74 -11.242 -10.915 -1.384 1.00 0.00 C ATOM 1155 C LEU A 74 -11.728 -11.676 -0.154 1.00 0.00 C ATOM 1156 O LEU A 74 -12.077 -12.853 -0.239 1.00 0.00 O ATOM 1157 CB LEU A 74 -9.718 -10.791 -1.352 1.00 0.00 C ATOM 1158 CG LEU A 74 -9.107 -10.005 -2.513 1.00 0.00 C ATOM 1159 CD1 LEU A 74 -7.791 -9.370 -2.093 1.00 0.00 C ATOM 1160 CD2 LEU A 74 -8.905 -10.909 -3.720 1.00 0.00 C ATOM 0 H LEU A 74 -11.220 -8.823 -1.246 1.00 0.00 H new ATOM 0 HA LEU A 74 -11.536 -11.472 -2.274 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -9.427 -10.312 -0.417 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -9.287 -11.792 -1.345 1.00 0.00 H new ATOM 0 HG LEU A 74 -9.797 -9.209 -2.792 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -7.371 -8.815 -2.932 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -7.965 -8.690 -1.259 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -7.092 -10.149 -1.787 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -8.469 -10.333 -4.537 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -8.235 -11.726 -3.454 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -9.866 -11.316 -4.035 1.00 0.00 H new ATOM 1172 N GLN A 75 -11.746 -10.996 0.987 1.00 0.00 N ATOM 1173 CA GLN A 75 -12.189 -11.608 2.235 1.00 0.00 C ATOM 1174 C GLN A 75 -13.636 -12.078 2.125 1.00 0.00 C ATOM 1175 O GLN A 75 -14.014 -13.096 2.705 1.00 0.00 O ATOM 1176 CB GLN A 75 -12.047 -10.616 3.392 1.00 0.00 C ATOM 1177 CG GLN A 75 -10.730 -10.738 4.139 1.00 0.00 C ATOM 1178 CD GLN A 75 -10.702 -9.911 5.410 1.00 0.00 C ATOM 1179 OE1 GLN A 75 -11.298 -8.836 5.477 1.00 0.00 O ATOM 1180 NE2 GLN A 75 -10.008 -10.410 6.425 1.00 0.00 N ATOM 0 H GLN A 75 -11.459 -10.021 1.074 1.00 0.00 H new ATOM 0 HA GLN A 75 -11.558 -12.475 2.431 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -12.142 -9.602 3.004 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -12.868 -10.768 4.093 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -10.553 -11.785 4.387 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -9.916 -10.423 3.487 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -9.530 -11.305 6.325 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -9.953 -9.898 7.306 1.00 0.00 H new ATOM 1189 N TYR A 76 -14.441 -11.331 1.377 1.00 0.00 N ATOM 1190 CA TYR A 76 -15.847 -11.671 1.191 1.00 0.00 C ATOM 1191 C TYR A 76 -15.993 -12.942 0.360 1.00 0.00 C ATOM 1192 O TYR A 76 -16.742 -13.850 0.722 1.00 0.00 O ATOM 1193 CB TYR A 76 -16.587 -10.517 0.515 1.00 0.00 C ATOM 1194 CG TYR A 76 -18.082 -10.539 0.744 1.00 0.00 C ATOM 1195 CD1 TYR A 76 -18.880 -11.515 0.160 1.00 0.00 C ATOM 1196 CD2 TYR A 76 -18.695 -9.582 1.544 1.00 0.00 C ATOM 1197 CE1 TYR A 76 -20.245 -11.538 0.368 1.00 0.00 C ATOM 1198 CE2 TYR A 76 -20.061 -9.599 1.756 1.00 0.00 C ATOM 1199 CZ TYR A 76 -20.831 -10.578 1.166 1.00 0.00 C ATOM 1200 OH TYR A 76 -22.191 -10.598 1.375 1.00 0.00 O ATOM 0 H TYR A 76 -14.144 -10.486 0.889 1.00 0.00 H new ATOM 0 HA TYR A 76 -16.286 -11.848 2.173 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -16.185 -9.573 0.884 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -16.392 -10.549 -0.557 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -18.425 -12.268 -0.467 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -18.095 -8.813 2.007 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -20.851 -12.304 -0.092 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -20.523 -8.849 2.381 1.00 0.00 H new ATOM 0 HH TYR A 76 -22.443 -9.854 1.961 1.00 0.00 H new ATOM 1210 N GLU A 77 -15.274 -12.999 -0.755 1.00 0.00 N ATOM 1211 CA GLU A 77 -15.324 -14.159 -1.639 1.00 0.00 C ATOM 1212 C GLU A 77 -14.647 -15.363 -0.992 1.00 0.00 C ATOM 1213 O GLU A 77 -15.137 -16.489 -1.088 1.00 0.00 O ATOM 1214 CB GLU A 77 -14.653 -13.838 -2.975 1.00 0.00 C ATOM 1215 CG GLU A 77 -15.333 -12.718 -3.744 1.00 0.00 C ATOM 1216 CD GLU A 77 -16.300 -13.235 -4.792 1.00 0.00 C ATOM 1217 OE1 GLU A 77 -16.937 -14.281 -4.549 1.00 0.00 O ATOM 1218 OE2 GLU A 77 -16.421 -12.592 -5.856 1.00 0.00 O ATOM 0 H GLU A 77 -14.649 -12.256 -1.069 1.00 0.00 H new ATOM 0 HA GLU A 77 -16.371 -14.405 -1.817 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -13.614 -13.564 -2.793 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -14.642 -14.737 -3.592 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -15.869 -12.076 -3.045 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -14.575 -12.101 -4.227 1.00 0.00 H new ATOM 1225 N GLY A 78 -13.518 -15.120 -0.334 1.00 0.00 N ATOM 1226 CA GLY A 78 -12.794 -16.194 0.320 1.00 0.00 C ATOM 1227 C GLY A 78 -11.392 -16.367 -0.231 1.00 0.00 C ATOM 1228 O GLY A 78 -10.911 -17.491 -0.381 1.00 0.00 O ATOM 0 H GLY A 78 -13.092 -14.198 -0.242 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -12.738 -15.992 1.390 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -13.346 -17.126 0.200 1.00 0.00 H new ATOM 1232 N VAL A 79 -10.734 -15.252 -0.533 1.00 0.00 N ATOM 1233 CA VAL A 79 -9.379 -15.286 -1.070 1.00 0.00 C ATOM 1234 C VAL A 79 -8.403 -14.576 -0.138 1.00 0.00 C ATOM 1235 O VAL A 79 -8.136 -13.384 -0.293 1.00 0.00 O ATOM 1236 CB VAL A 79 -9.309 -14.633 -2.464 1.00 0.00 C ATOM 1237 CG1 VAL A 79 -7.928 -14.818 -3.074 1.00 0.00 C ATOM 1238 CG2 VAL A 79 -10.383 -15.203 -3.378 1.00 0.00 C ATOM 0 H VAL A 79 -11.117 -14.314 -0.415 1.00 0.00 H new ATOM 0 HA VAL A 79 -9.098 -16.336 -1.156 1.00 0.00 H new ATOM 0 HB VAL A 79 -9.491 -13.564 -2.351 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -7.899 -14.350 -4.058 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -7.181 -14.355 -2.430 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -7.713 -15.882 -3.172 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -10.317 -14.729 -4.357 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -10.237 -16.278 -3.485 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -11.366 -15.011 -2.948 1.00 0.00 H new ATOM 1248 N ALA A 80 -7.874 -15.315 0.831 1.00 0.00 N ATOM 1249 CA ALA A 80 -6.928 -14.756 1.789 1.00 0.00 C ATOM 1250 C ALA A 80 -5.602 -14.414 1.116 1.00 0.00 C ATOM 1251 O ALA A 80 -4.910 -13.481 1.525 1.00 0.00 O ATOM 1252 CB ALA A 80 -6.703 -15.728 2.937 1.00 0.00 C ATOM 0 H ALA A 80 -8.084 -16.303 0.974 1.00 0.00 H new ATOM 0 HA ALA A 80 -7.353 -13.834 2.186 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -5.994 -15.298 3.645 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -7.650 -15.920 3.442 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -6.303 -16.664 2.548 1.00 0.00 H new ATOM 1258 N VAL A 81 -5.255 -15.173 0.082 1.00 0.00 N ATOM 1259 CA VAL A 81 -4.012 -14.949 -0.646 1.00 0.00 C ATOM 1260 C VAL A 81 -4.214 -13.953 -1.783 1.00 0.00 C ATOM 1261 O VAL A 81 -5.181 -14.046 -2.538 1.00 0.00 O ATOM 1262 CB VAL A 81 -3.453 -16.263 -1.223 1.00 0.00 C ATOM 1263 CG1 VAL A 81 -2.063 -16.044 -1.800 1.00 0.00 C ATOM 1264 CG2 VAL A 81 -3.431 -17.348 -0.158 1.00 0.00 C ATOM 0 H VAL A 81 -5.817 -15.948 -0.270 1.00 0.00 H new ATOM 0 HA VAL A 81 -3.296 -14.542 0.068 1.00 0.00 H new ATOM 0 HB VAL A 81 -4.109 -16.592 -2.029 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -1.684 -16.983 -2.203 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -2.112 -15.301 -2.596 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -1.395 -15.690 -1.015 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -3.033 -18.269 -0.585 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -2.800 -17.030 0.672 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -4.444 -17.524 0.203 1.00 0.00 H new ATOM 1274 N MET A 82 -3.294 -13.001 -1.898 1.00 0.00 N ATOM 1275 CA MET A 82 -3.370 -11.986 -2.944 1.00 0.00 C ATOM 1276 C MET A 82 -2.162 -12.069 -3.871 1.00 0.00 C ATOM 1277 O MET A 82 -1.084 -12.503 -3.465 1.00 0.00 O ATOM 1278 CB MET A 82 -3.455 -10.590 -2.322 1.00 0.00 C ATOM 1279 CG MET A 82 -4.002 -9.535 -3.271 1.00 0.00 C ATOM 1280 SD MET A 82 -4.326 -7.964 -2.447 1.00 0.00 S ATOM 1281 CE MET A 82 -2.666 -7.309 -2.300 1.00 0.00 C ATOM 0 H MET A 82 -2.487 -12.911 -1.280 1.00 0.00 H new ATOM 0 HA MET A 82 -4.269 -12.171 -3.531 1.00 0.00 H new ATOM 0 HB2 MET A 82 -4.088 -10.634 -1.436 1.00 0.00 H new ATOM 0 HB3 MET A 82 -2.462 -10.288 -1.989 1.00 0.00 H new ATOM 0 HG2 MET A 82 -3.290 -9.376 -4.081 1.00 0.00 H new ATOM 0 HG3 MET A 82 -4.924 -9.901 -3.723 1.00 0.00 H new ATOM 0 HE1 MET A 82 -2.681 -6.235 -2.486 1.00 0.00 H new ATOM 0 HE2 MET A 82 -2.288 -7.498 -1.295 1.00 0.00 H new ATOM 0 HE3 MET A 82 -2.017 -7.795 -3.029 1.00 0.00 H new ATOM 1291 N LYS A 83 -2.350 -11.649 -5.118 1.00 0.00 N ATOM 1292 CA LYS A 83 -1.275 -11.676 -6.103 1.00 0.00 C ATOM 1293 C LYS A 83 -0.778 -10.265 -6.405 1.00 0.00 C ATOM 1294 O LYS A 83 -1.484 -9.466 -7.019 1.00 0.00 O ATOM 1295 CB LYS A 83 -1.752 -12.347 -7.392 1.00 0.00 C ATOM 1296 CG LYS A 83 -0.671 -12.460 -8.455 1.00 0.00 C ATOM 1297 CD LYS A 83 0.344 -13.538 -8.108 1.00 0.00 C ATOM 1298 CE LYS A 83 0.107 -14.809 -8.908 1.00 0.00 C ATOM 1299 NZ LYS A 83 1.164 -15.025 -9.934 1.00 0.00 N ATOM 0 H LYS A 83 -3.236 -11.286 -5.470 1.00 0.00 H new ATOM 0 HA LYS A 83 -0.449 -12.252 -5.686 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -2.124 -13.344 -7.157 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -2.591 -11.781 -7.797 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -1.129 -12.687 -9.418 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -0.163 -11.502 -8.562 1.00 0.00 H new ATOM 0 HD2 LYS A 83 1.350 -13.167 -8.303 1.00 0.00 H new ATOM 0 HD3 LYS A 83 0.288 -13.762 -7.043 1.00 0.00 H new ATOM 0 HE2 LYS A 83 0.078 -15.663 -8.232 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -0.866 -14.755 -9.396 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 1.185 -16.029 -10.205 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 0.958 -14.444 -10.772 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 2.088 -14.753 -9.543 1.00 0.00 H new ATOM 1313 N LEU A 84 0.441 -9.967 -5.967 1.00 0.00 N ATOM 1314 CA LEU A 84 1.032 -8.652 -6.191 1.00 0.00 C ATOM 1315 C LEU A 84 2.133 -8.723 -7.244 1.00 0.00 C ATOM 1316 O LEU A 84 3.133 -9.419 -7.065 1.00 0.00 O ATOM 1317 CB LEU A 84 1.594 -8.093 -4.883 1.00 0.00 C ATOM 1318 CG LEU A 84 0.547 -7.560 -3.905 1.00 0.00 C ATOM 1319 CD1 LEU A 84 1.175 -7.283 -2.547 1.00 0.00 C ATOM 1320 CD2 LEU A 84 -0.106 -6.302 -4.458 1.00 0.00 C ATOM 0 H LEU A 84 1.038 -10.617 -5.456 1.00 0.00 H new ATOM 0 HA LEU A 84 0.250 -7.986 -6.555 1.00 0.00 H new ATOM 0 HB2 LEU A 84 2.167 -8.877 -4.387 1.00 0.00 H new ATOM 0 HB3 LEU A 84 2.291 -7.289 -5.119 1.00 0.00 H new ATOM 0 HG LEU A 84 -0.223 -8.321 -3.777 1.00 0.00 H new ATOM 0 HD11 LEU A 84 0.414 -6.904 -1.865 1.00 0.00 H new ATOM 0 HD12 LEU A 84 1.596 -8.205 -2.146 1.00 0.00 H new ATOM 0 HD13 LEU A 84 1.966 -6.541 -2.656 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -0.849 -5.936 -3.749 1.00 0.00 H new ATOM 0 HD22 LEU A 84 0.654 -5.537 -4.615 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -0.592 -6.531 -5.407 1.00 0.00 H new ATOM 1332 N PHE A 85 1.942 -7.999 -8.342 1.00 0.00 N ATOM 1333 CA PHE A 85 2.918 -7.980 -9.425 1.00 0.00 C ATOM 1334 C PHE A 85 3.108 -9.375 -10.015 1.00 0.00 C ATOM 1335 O PHE A 85 4.154 -9.680 -10.588 1.00 0.00 O ATOM 1336 CB PHE A 85 4.258 -7.441 -8.922 1.00 0.00 C ATOM 1337 CG PHE A 85 4.164 -6.070 -8.313 1.00 0.00 C ATOM 1338 CD1 PHE A 85 3.484 -5.054 -8.966 1.00 0.00 C ATOM 1339 CD2 PHE A 85 4.756 -5.799 -7.090 1.00 0.00 C ATOM 1340 CE1 PHE A 85 3.395 -3.792 -8.408 1.00 0.00 C ATOM 1341 CE2 PHE A 85 4.671 -4.539 -6.528 1.00 0.00 C ATOM 1342 CZ PHE A 85 3.991 -3.535 -7.188 1.00 0.00 C ATOM 0 H PHE A 85 1.120 -7.418 -8.505 1.00 0.00 H new ATOM 0 HA PHE A 85 2.539 -7.323 -10.208 1.00 0.00 H new ATOM 0 HB2 PHE A 85 4.663 -8.131 -8.182 1.00 0.00 H new ATOM 0 HB3 PHE A 85 4.964 -7.413 -9.752 1.00 0.00 H new ATOM 0 HD1 PHE A 85 3.019 -5.250 -9.921 1.00 0.00 H new ATOM 0 HD2 PHE A 85 5.290 -6.581 -6.570 1.00 0.00 H new ATOM 0 HE1 PHE A 85 2.861 -3.009 -8.925 1.00 0.00 H new ATOM 0 HE2 PHE A 85 5.136 -4.340 -5.574 1.00 0.00 H new ATOM 0 HZ PHE A 85 3.925 -2.549 -6.751 1.00 0.00 H new ATOM 1352 N ASP A 86 2.089 -10.219 -9.873 1.00 0.00 N ATOM 1353 CA ASP A 86 2.144 -11.581 -10.395 1.00 0.00 C ATOM 1354 C ASP A 86 3.356 -12.330 -9.849 1.00 0.00 C ATOM 1355 O ASP A 86 3.948 -13.159 -10.538 1.00 0.00 O ATOM 1356 CB ASP A 86 2.189 -11.562 -11.924 1.00 0.00 C ATOM 1357 CG ASP A 86 1.376 -12.684 -12.540 1.00 0.00 C ATOM 1358 OD1 ASP A 86 0.263 -12.954 -12.041 1.00 0.00 O ATOM 1359 OD2 ASP A 86 1.853 -13.293 -13.520 1.00 0.00 O ATOM 0 H ASP A 86 1.216 -9.983 -9.401 1.00 0.00 H new ATOM 0 HA ASP A 86 1.243 -12.102 -10.070 1.00 0.00 H new ATOM 0 HB2 ASP A 86 1.813 -10.604 -12.284 1.00 0.00 H new ATOM 0 HB3 ASP A 86 3.224 -11.643 -12.255 1.00 0.00 H new ATOM 1364 N ARG A 87 3.720 -12.032 -8.605 1.00 0.00 N ATOM 1365 CA ARG A 87 4.861 -12.678 -7.968 1.00 0.00 C ATOM 1366 C ARG A 87 4.689 -12.720 -6.453 1.00 0.00 C ATOM 1367 O ARG A 87 4.371 -13.764 -5.883 1.00 0.00 O ATOM 1368 CB ARG A 87 6.155 -11.944 -8.327 1.00 0.00 C ATOM 1369 CG ARG A 87 6.842 -12.493 -9.567 1.00 0.00 C ATOM 1370 CD ARG A 87 7.957 -11.573 -10.038 1.00 0.00 C ATOM 1371 NE ARG A 87 8.487 -11.976 -11.338 1.00 0.00 N ATOM 1372 CZ ARG A 87 9.198 -11.177 -12.130 1.00 0.00 C ATOM 1373 NH1 ARG A 87 9.464 -9.930 -11.759 1.00 0.00 N ATOM 1374 NH2 ARG A 87 9.643 -11.625 -13.296 1.00 0.00 N ATOM 0 H ARG A 87 3.241 -11.348 -8.019 1.00 0.00 H new ATOM 0 HA ARG A 87 4.918 -13.702 -8.336 1.00 0.00 H new ATOM 0 HB2 ARG A 87 5.933 -10.888 -8.482 1.00 0.00 H new ATOM 0 HB3 ARG A 87 6.843 -12.004 -7.484 1.00 0.00 H new ATOM 0 HG2 ARG A 87 7.250 -13.480 -9.351 1.00 0.00 H new ATOM 0 HG3 ARG A 87 6.110 -12.618 -10.365 1.00 0.00 H new ATOM 0 HD2 ARG A 87 7.582 -10.551 -10.100 1.00 0.00 H new ATOM 0 HD3 ARG A 87 8.762 -11.573 -9.303 1.00 0.00 H new ATOM 0 HE ARG A 87 8.301 -12.927 -11.658 1.00 0.00 H new ATOM 0 HH11 ARG A 87 9.123 -9.581 -10.863 1.00 0.00 H new ATOM 0 HH12 ARG A 87 10.009 -9.322 -12.370 1.00 0.00 H new ATOM 0 HH21 ARG A 87 9.440 -12.582 -13.586 1.00 0.00 H new ATOM 0 HH22 ARG A 87 10.188 -11.013 -13.903 1.00 0.00 H new ATOM 1388 N ALA A 88 4.902 -11.579 -5.806 1.00 0.00 N ATOM 1389 CA ALA A 88 4.771 -11.486 -4.357 1.00 0.00 C ATOM 1390 C ALA A 88 3.327 -11.710 -3.921 1.00 0.00 C ATOM 1391 O ALA A 88 2.402 -11.109 -4.468 1.00 0.00 O ATOM 1392 CB ALA A 88 5.268 -10.134 -3.868 1.00 0.00 C ATOM 0 H ALA A 88 5.166 -10.706 -6.262 1.00 0.00 H new ATOM 0 HA ALA A 88 5.384 -12.269 -3.911 1.00 0.00 H new ATOM 0 HB1 ALA A 88 5.164 -10.078 -2.784 1.00 0.00 H new ATOM 0 HB2 ALA A 88 6.317 -10.012 -4.139 1.00 0.00 H new ATOM 0 HB3 ALA A 88 4.680 -9.341 -4.330 1.00 0.00 H new ATOM 1398 N LYS A 89 3.141 -12.578 -2.931 1.00 0.00 N ATOM 1399 CA LYS A 89 1.809 -12.882 -2.421 1.00 0.00 C ATOM 1400 C LYS A 89 1.697 -12.514 -0.945 1.00 0.00 C ATOM 1401 O LYS A 89 2.536 -12.904 -0.133 1.00 0.00 O ATOM 1402 CB LYS A 89 1.492 -14.366 -2.614 1.00 0.00 C ATOM 1403 CG LYS A 89 1.244 -14.750 -4.063 1.00 0.00 C ATOM 1404 CD LYS A 89 1.021 -16.246 -4.212 1.00 0.00 C ATOM 1405 CE LYS A 89 -0.028 -16.552 -5.270 1.00 0.00 C ATOM 1406 NZ LYS A 89 -0.942 -17.647 -4.846 1.00 0.00 N ATOM 0 H LYS A 89 3.896 -13.083 -2.466 1.00 0.00 H new ATOM 0 HA LYS A 89 1.087 -12.288 -2.982 1.00 0.00 H new ATOM 0 HB2 LYS A 89 2.320 -14.960 -2.226 1.00 0.00 H new ATOM 0 HB3 LYS A 89 0.612 -14.621 -2.023 1.00 0.00 H new ATOM 0 HG2 LYS A 89 0.374 -14.212 -4.439 1.00 0.00 H new ATOM 0 HG3 LYS A 89 2.095 -14.445 -4.672 1.00 0.00 H new ATOM 0 HD2 LYS A 89 1.960 -16.730 -4.479 1.00 0.00 H new ATOM 0 HD3 LYS A 89 0.708 -16.665 -3.256 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -0.609 -15.653 -5.475 1.00 0.00 H new ATOM 0 HE3 LYS A 89 0.466 -16.832 -6.201 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -1.262 -18.175 -5.683 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -0.438 -18.290 -4.202 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -1.765 -17.242 -4.356 1.00 0.00 H new ATOM 1420 N VAL A 90 0.657 -11.760 -0.605 1.00 0.00 N ATOM 1421 CA VAL A 90 0.437 -11.339 0.774 1.00 0.00 C ATOM 1422 C VAL A 90 -0.931 -11.791 1.275 1.00 0.00 C ATOM 1423 O VAL A 90 -1.852 -12.005 0.487 1.00 0.00 O ATOM 1424 CB VAL A 90 0.544 -9.808 0.918 1.00 0.00 C ATOM 1425 CG1 VAL A 90 0.471 -9.402 2.382 1.00 0.00 C ATOM 1426 CG2 VAL A 90 1.828 -9.298 0.279 1.00 0.00 C ATOM 0 H VAL A 90 -0.046 -11.428 -1.265 1.00 0.00 H new ATOM 0 HA VAL A 90 1.215 -11.808 1.376 1.00 0.00 H new ATOM 0 HB VAL A 90 -0.299 -9.354 0.397 1.00 0.00 H new ATOM 0 HG11 VAL A 90 0.548 -8.318 2.463 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -0.479 -9.731 2.804 1.00 0.00 H new ATOM 0 HG13 VAL A 90 1.291 -9.866 2.930 1.00 0.00 H new ATOM 0 HG21 VAL A 90 1.885 -8.215 0.391 1.00 0.00 H new ATOM 0 HG22 VAL A 90 2.686 -9.759 0.768 1.00 0.00 H new ATOM 0 HG23 VAL A 90 1.834 -9.554 -0.781 1.00 0.00 H new ATOM 1436 N ASN A 91 -1.056 -11.931 2.590 1.00 0.00 N ATOM 1437 CA ASN A 91 -2.312 -12.355 3.198 1.00 0.00 C ATOM 1438 C ASN A 91 -3.236 -11.162 3.424 1.00 0.00 C ATOM 1439 O ASN A 91 -2.895 -10.230 4.150 1.00 0.00 O ATOM 1440 CB ASN A 91 -2.045 -13.067 4.527 1.00 0.00 C ATOM 1441 CG ASN A 91 -3.272 -13.785 5.054 1.00 0.00 C ATOM 1442 OD1 ASN A 91 -4.212 -14.062 4.308 1.00 0.00 O ATOM 1443 ND2 ASN A 91 -3.270 -14.088 6.347 1.00 0.00 N ATOM 0 H ASN A 91 -0.303 -11.757 3.256 1.00 0.00 H new ATOM 0 HA ASN A 91 -2.802 -13.048 2.515 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -1.236 -13.785 4.395 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -1.708 -12.339 5.265 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -4.069 -14.570 6.759 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -2.469 -13.839 6.928 1.00 0.00 H new ATOM 1450 N VAL A 92 -4.405 -11.200 2.794 1.00 0.00 N ATOM 1451 CA VAL A 92 -5.378 -10.121 2.925 1.00 0.00 C ATOM 1452 C VAL A 92 -5.964 -10.077 4.333 1.00 0.00 C ATOM 1453 O VAL A 92 -6.323 -9.011 4.833 1.00 0.00 O ATOM 1454 CB VAL A 92 -6.526 -10.275 1.907 1.00 0.00 C ATOM 1455 CG1 VAL A 92 -7.444 -9.062 1.947 1.00 0.00 C ATOM 1456 CG2 VAL A 92 -5.974 -10.488 0.505 1.00 0.00 C ATOM 0 H VAL A 92 -4.702 -11.965 2.188 1.00 0.00 H new ATOM 0 HA VAL A 92 -4.848 -9.190 2.726 1.00 0.00 H new ATOM 0 HB VAL A 92 -7.111 -11.154 2.180 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -8.248 -9.190 1.222 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -7.869 -8.960 2.945 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -6.874 -8.166 1.703 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -6.800 -10.594 -0.199 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -5.363 -9.631 0.221 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -5.364 -11.391 0.488 1.00 0.00 H new ATOM 1466 N ASN A 93 -6.057 -11.241 4.967 1.00 0.00 N ATOM 1467 CA ASN A 93 -6.599 -11.334 6.318 1.00 0.00 C ATOM 1468 C ASN A 93 -5.728 -10.569 7.311 1.00 0.00 C ATOM 1469 O ASN A 93 -6.222 -10.051 8.313 1.00 0.00 O ATOM 1470 CB ASN A 93 -6.714 -12.801 6.742 1.00 0.00 C ATOM 1471 CG ASN A 93 -8.152 -13.280 6.780 1.00 0.00 C ATOM 1472 OD1 ASN A 93 -8.992 -12.703 7.471 1.00 0.00 O ATOM 1473 ND2 ASN A 93 -8.442 -14.342 6.038 1.00 0.00 N ATOM 0 H ASN A 93 -5.764 -12.133 4.567 1.00 0.00 H new ATOM 0 HA ASN A 93 -7.592 -10.884 6.317 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -6.145 -13.422 6.050 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -6.265 -12.928 7.727 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -9.393 -14.711 6.025 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -7.714 -14.789 5.481 1.00 0.00 H new ATOM 1480 N LEU A 94 -4.432 -10.504 7.028 1.00 0.00 N ATOM 1481 CA LEU A 94 -3.494 -9.805 7.900 1.00 0.00 C ATOM 1482 C LEU A 94 -3.074 -8.468 7.293 1.00 0.00 C ATOM 1483 O LEU A 94 -2.748 -7.525 8.014 1.00 0.00 O ATOM 1484 CB LEU A 94 -2.260 -10.671 8.155 1.00 0.00 C ATOM 1485 CG LEU A 94 -2.419 -11.713 9.264 1.00 0.00 C ATOM 1486 CD1 LEU A 94 -1.205 -12.626 9.317 1.00 0.00 C ATOM 1487 CD2 LEU A 94 -2.634 -11.031 10.607 1.00 0.00 C ATOM 0 H LEU A 94 -4.007 -10.926 6.203 1.00 0.00 H new ATOM 0 HA LEU A 94 -3.996 -9.610 8.848 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -1.997 -11.184 7.230 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -1.423 -10.019 8.407 1.00 0.00 H new ATOM 0 HG LEU A 94 -3.296 -12.322 9.042 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -1.336 -13.360 10.112 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -1.095 -13.140 8.362 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -0.312 -12.033 9.515 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -2.745 -11.786 11.385 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -1.776 -10.399 10.835 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -3.535 -10.419 10.564 1.00 0.00 H new ATOM 1499 N LEU A 95 -3.084 -8.394 5.966 1.00 0.00 N ATOM 1500 CA LEU A 95 -2.703 -7.173 5.265 1.00 0.00 C ATOM 1501 C LEU A 95 -3.578 -6.000 5.695 1.00 0.00 C ATOM 1502 O LEU A 95 -3.093 -4.880 5.860 1.00 0.00 O ATOM 1503 CB LEU A 95 -2.809 -7.375 3.752 1.00 0.00 C ATOM 1504 CG LEU A 95 -2.401 -6.167 2.907 1.00 0.00 C ATOM 1505 CD1 LEU A 95 -0.913 -5.888 3.058 1.00 0.00 C ATOM 1506 CD2 LEU A 95 -2.757 -6.394 1.447 1.00 0.00 C ATOM 0 H LEU A 95 -3.352 -9.165 5.354 1.00 0.00 H new ATOM 0 HA LEU A 95 -1.669 -6.944 5.524 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -2.186 -8.224 3.470 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -3.838 -7.639 3.507 1.00 0.00 H new ATOM 0 HG LEU A 95 -2.951 -5.296 3.263 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -0.641 -5.025 2.450 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -0.686 -5.681 4.104 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -0.344 -6.758 2.729 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -2.460 -5.525 0.861 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -2.234 -7.277 1.078 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -3.833 -6.544 1.354 1.00 0.00 H new ATOM 1518 N ILE A 96 -4.868 -6.264 5.876 1.00 0.00 N ATOM 1519 CA ILE A 96 -5.808 -5.229 6.287 1.00 0.00 C ATOM 1520 C ILE A 96 -5.682 -4.932 7.777 1.00 0.00 C ATOM 1521 O ILE A 96 -5.917 -3.806 8.217 1.00 0.00 O ATOM 1522 CB ILE A 96 -7.262 -5.636 5.978 1.00 0.00 C ATOM 1523 CG1 ILE A 96 -7.381 -6.128 4.536 1.00 0.00 C ATOM 1524 CG2 ILE A 96 -8.203 -4.468 6.225 1.00 0.00 C ATOM 1525 CD1 ILE A 96 -8.700 -6.806 4.235 1.00 0.00 C ATOM 0 H ILE A 96 -5.285 -7.185 5.744 1.00 0.00 H new ATOM 0 HA ILE A 96 -5.560 -4.333 5.718 1.00 0.00 H new ATOM 0 HB ILE A 96 -7.545 -6.451 6.644 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -7.254 -5.282 3.860 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -6.568 -6.825 4.330 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -9.226 -4.771 6.002 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -8.135 -4.160 7.268 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -7.924 -3.634 5.582 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -8.714 -7.129 3.194 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -8.821 -7.672 4.885 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -9.517 -6.106 4.408 1.00 0.00 H new ATOM 1537 N PHE A 97 -5.310 -5.947 8.550 1.00 0.00 N ATOM 1538 CA PHE A 97 -5.154 -5.793 9.991 1.00 0.00 C ATOM 1539 C PHE A 97 -4.000 -4.850 10.317 1.00 0.00 C ATOM 1540 O PHE A 97 -4.135 -3.952 11.148 1.00 0.00 O ATOM 1541 CB PHE A 97 -4.915 -7.155 10.647 1.00 0.00 C ATOM 1542 CG PHE A 97 -4.977 -7.118 12.148 1.00 0.00 C ATOM 1543 CD1 PHE A 97 -3.847 -6.821 12.893 1.00 0.00 C ATOM 1544 CD2 PHE A 97 -6.165 -7.378 12.812 1.00 0.00 C ATOM 1545 CE1 PHE A 97 -3.901 -6.785 14.274 1.00 0.00 C ATOM 1546 CE2 PHE A 97 -6.225 -7.344 14.192 1.00 0.00 C ATOM 1547 CZ PHE A 97 -5.091 -7.048 14.924 1.00 0.00 C ATOM 0 H PHE A 97 -5.111 -6.885 8.202 1.00 0.00 H new ATOM 0 HA PHE A 97 -6.074 -5.362 10.386 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -5.658 -7.862 10.278 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -3.938 -7.530 10.341 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -2.914 -6.615 12.389 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -7.054 -7.610 12.244 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -3.014 -6.552 14.844 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -7.157 -7.549 14.698 1.00 0.00 H new ATOM 0 HZ PHE A 97 -5.135 -7.022 16.003 1.00 0.00 H new ATOM 1557 N LEU A 98 -2.866 -5.060 9.657 1.00 0.00 N ATOM 1558 CA LEU A 98 -1.688 -4.228 9.877 1.00 0.00 C ATOM 1559 C LEU A 98 -1.983 -2.768 9.547 1.00 0.00 C ATOM 1560 O LEU A 98 -1.756 -1.879 10.368 1.00 0.00 O ATOM 1561 CB LEU A 98 -0.519 -4.729 9.027 1.00 0.00 C ATOM 1562 CG LEU A 98 0.846 -4.143 9.394 1.00 0.00 C ATOM 1563 CD1 LEU A 98 1.442 -4.881 10.583 1.00 0.00 C ATOM 1564 CD2 LEU A 98 1.789 -4.202 8.201 1.00 0.00 C ATOM 0 H LEU A 98 -2.737 -5.799 8.966 1.00 0.00 H new ATOM 0 HA LEU A 98 -1.418 -4.296 10.931 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -0.466 -5.814 9.112 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -0.726 -4.501 7.981 1.00 0.00 H new ATOM 0 HG LEU A 98 0.708 -3.098 9.673 1.00 0.00 H new ATOM 0 HD11 LEU A 98 2.413 -4.450 10.829 1.00 0.00 H new ATOM 0 HD12 LEU A 98 0.775 -4.788 11.440 1.00 0.00 H new ATOM 0 HD13 LEU A 98 1.566 -5.935 10.332 1.00 0.00 H new ATOM 0 HD21 LEU A 98 2.755 -3.781 8.480 1.00 0.00 H new ATOM 0 HD22 LEU A 98 1.920 -5.239 7.892 1.00 0.00 H new ATOM 0 HD23 LEU A 98 1.368 -3.628 7.376 1.00 0.00 H new ATOM 1576 N LEU A 99 -2.489 -2.528 8.342 1.00 0.00 N ATOM 1577 CA LEU A 99 -2.814 -1.176 7.904 1.00 0.00 C ATOM 1578 C LEU A 99 -3.876 -0.552 8.805 1.00 0.00 C ATOM 1579 O LEU A 99 -3.883 0.659 9.027 1.00 0.00 O ATOM 1580 CB LEU A 99 -3.304 -1.191 6.455 1.00 0.00 C ATOM 1581 CG LEU A 99 -2.271 -1.657 5.428 1.00 0.00 C ATOM 1582 CD1 LEU A 99 -2.881 -1.690 4.035 1.00 0.00 C ATOM 1583 CD2 LEU A 99 -1.048 -0.752 5.455 1.00 0.00 C ATOM 0 H LEU A 99 -2.683 -3.253 7.651 1.00 0.00 H new ATOM 0 HA LEU A 99 -1.908 -0.573 7.968 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -4.178 -1.840 6.389 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -3.632 -0.186 6.188 1.00 0.00 H new ATOM 0 HG LEU A 99 -1.957 -2.668 5.689 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -2.132 -2.024 3.317 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -3.726 -2.379 4.024 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -3.223 -0.691 3.764 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -0.323 -1.098 4.718 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -1.346 0.270 5.219 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -0.598 -0.778 6.447 1.00 0.00 H new ATOM 1595 N ASN A 100 -4.773 -1.387 9.320 1.00 0.00 N ATOM 1596 CA ASN A 100 -5.841 -0.918 10.195 1.00 0.00 C ATOM 1597 C ASN A 100 -5.275 -0.225 11.433 1.00 0.00 C ATOM 1598 O ASN A 100 -5.945 0.602 12.052 1.00 0.00 O ATOM 1599 CB ASN A 100 -6.735 -2.090 10.613 1.00 0.00 C ATOM 1600 CG ASN A 100 -8.126 -1.999 10.015 1.00 0.00 C ATOM 1601 OD1 ASN A 100 -8.895 -1.094 10.337 1.00 0.00 O ATOM 1602 ND2 ASN A 100 -8.455 -2.941 9.138 1.00 0.00 N ATOM 0 H ASN A 100 -4.781 -2.392 9.146 1.00 0.00 H new ATOM 0 HA ASN A 100 -6.437 -0.192 9.641 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -6.270 -3.026 10.304 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -6.811 -2.116 11.700 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -9.377 -2.932 8.702 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -7.785 -3.673 8.900 1.00 0.00 H new ATOM 1609 N LYS A 101 -4.042 -0.569 11.791 1.00 0.00 N ATOM 1610 CA LYS A 101 -3.393 0.022 12.956 1.00 0.00 C ATOM 1611 C LYS A 101 -2.221 0.910 12.545 1.00 0.00 C ATOM 1612 O LYS A 101 -1.839 1.825 13.276 1.00 0.00 O ATOM 1613 CB LYS A 101 -2.907 -1.076 13.905 1.00 0.00 C ATOM 1614 CG LYS A 101 -3.897 -1.409 15.010 1.00 0.00 C ATOM 1615 CD LYS A 101 -3.199 -1.609 16.346 1.00 0.00 C ATOM 1616 CE LYS A 101 -3.776 -2.794 17.103 1.00 0.00 C ATOM 1617 NZ LYS A 101 -2.731 -3.517 17.881 1.00 0.00 N ATOM 0 H LYS A 101 -3.473 -1.253 11.292 1.00 0.00 H new ATOM 0 HA LYS A 101 -4.127 0.642 13.470 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -2.702 -1.978 13.329 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -1.964 -0.764 14.355 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -4.629 -0.606 15.098 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -4.446 -2.313 14.747 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -2.133 -1.765 16.181 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -3.299 -0.707 16.949 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -4.558 -2.447 17.779 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -4.245 -3.481 16.399 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -3.164 -4.318 18.383 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -1.998 -3.870 17.233 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -2.301 -2.868 18.571 1.00 0.00 H new ATOM 1631 N LYS A 102 -1.649 0.632 11.378 1.00 0.00 N ATOM 1632 CA LYS A 102 -0.517 1.405 10.881 1.00 0.00 C ATOM 1633 C LYS A 102 -0.982 2.676 10.173 1.00 0.00 C ATOM 1634 O LYS A 102 -0.894 3.772 10.726 1.00 0.00 O ATOM 1635 CB LYS A 102 0.325 0.556 9.926 1.00 0.00 C ATOM 1636 CG LYS A 102 1.054 -0.589 10.611 1.00 0.00 C ATOM 1637 CD LYS A 102 2.159 -0.078 11.521 1.00 0.00 C ATOM 1638 CE LYS A 102 3.314 -1.064 11.601 1.00 0.00 C ATOM 1639 NZ LYS A 102 2.885 -2.380 12.151 1.00 0.00 N ATOM 0 H LYS A 102 -1.950 -0.121 10.760 1.00 0.00 H new ATOM 0 HA LYS A 102 0.092 1.695 11.738 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -0.322 0.150 9.148 1.00 0.00 H new ATOM 0 HB3 LYS A 102 1.055 1.197 9.432 1.00 0.00 H new ATOM 0 HG2 LYS A 102 0.345 -1.178 11.193 1.00 0.00 H new ATOM 0 HG3 LYS A 102 1.478 -1.254 9.859 1.00 0.00 H new ATOM 0 HD2 LYS A 102 2.522 0.881 11.151 1.00 0.00 H new ATOM 0 HD3 LYS A 102 1.758 0.097 12.519 1.00 0.00 H new ATOM 0 HE2 LYS A 102 3.738 -1.207 10.607 1.00 0.00 H new ATOM 0 HE3 LYS A 102 4.103 -0.649 12.228 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 3.558 -3.116 11.856 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 2.859 -2.331 13.190 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 1.937 -2.614 11.792 1.00 0.00 H new ATOM 1653 N PHE A 103 -1.470 2.521 8.946 1.00 0.00 N ATOM 1654 CA PHE A 103 -1.941 3.658 8.161 1.00 0.00 C ATOM 1655 C PHE A 103 -3.234 4.228 8.733 1.00 0.00 C ATOM 1656 O PHE A 103 -3.401 5.446 8.820 1.00 0.00 O ATOM 1657 CB PHE A 103 -2.153 3.243 6.704 1.00 0.00 C ATOM 1658 CG PHE A 103 -0.876 3.144 5.919 1.00 0.00 C ATOM 1659 CD1 PHE A 103 0.035 2.133 6.178 1.00 0.00 C ATOM 1660 CD2 PHE A 103 -0.587 4.063 4.924 1.00 0.00 C ATOM 1661 CE1 PHE A 103 1.211 2.039 5.458 1.00 0.00 C ATOM 1662 CE2 PHE A 103 0.587 3.975 4.201 1.00 0.00 C ATOM 1663 CZ PHE A 103 1.488 2.962 4.468 1.00 0.00 C ATOM 0 H PHE A 103 -1.550 1.620 8.474 1.00 0.00 H new ATOM 0 HA PHE A 103 -1.178 4.435 8.206 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -2.662 2.279 6.679 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -2.813 3.964 6.221 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -0.176 1.410 6.952 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -1.287 4.857 4.711 1.00 0.00 H new ATOM 0 HE1 PHE A 103 1.912 1.245 5.669 1.00 0.00 H new ATOM 0 HE2 PHE A 103 0.800 4.698 3.427 1.00 0.00 H new ATOM 0 HZ PHE A 103 2.406 2.892 3.904 1.00 0.00 H new ATOM 1673 N TYR A 104 -4.150 3.345 9.122 1.00 0.00 N ATOM 1674 CA TYR A 104 -5.428 3.767 9.684 1.00 0.00 C ATOM 1675 C TYR A 104 -5.222 4.680 10.890 1.00 0.00 C ATOM 1676 O TYR A 104 -4.961 4.213 11.997 1.00 0.00 O ATOM 1677 CB TYR A 104 -6.261 2.547 10.087 1.00 0.00 C ATOM 1678 CG TYR A 104 -7.600 2.470 9.389 1.00 0.00 C ATOM 1679 CD1 TYR A 104 -7.693 2.063 8.064 1.00 0.00 C ATOM 1680 CD2 TYR A 104 -8.772 2.806 10.056 1.00 0.00 C ATOM 1681 CE1 TYR A 104 -8.915 1.991 7.424 1.00 0.00 C ATOM 1682 CE2 TYR A 104 -9.998 2.736 9.423 1.00 0.00 C ATOM 1683 CZ TYR A 104 -10.065 2.329 8.107 1.00 0.00 C ATOM 1684 OH TYR A 104 -11.284 2.258 7.473 1.00 0.00 O ATOM 0 H TYR A 104 -4.030 2.334 9.058 1.00 0.00 H new ATOM 0 HA TYR A 104 -5.964 4.327 8.918 1.00 0.00 H new ATOM 0 HB2 TYR A 104 -5.694 1.642 9.868 1.00 0.00 H new ATOM 0 HB3 TYR A 104 -6.423 2.568 11.165 1.00 0.00 H new ATOM 0 HD1 TYR A 104 -6.795 1.799 7.525 1.00 0.00 H new ATOM 0 HD2 TYR A 104 -8.724 3.127 11.086 1.00 0.00 H new ATOM 0 HE1 TYR A 104 -8.970 1.672 6.394 1.00 0.00 H new ATOM 0 HE2 TYR A 104 -10.900 2.999 9.956 1.00 0.00 H new ATOM 0 HH TYR A 104 -11.992 2.528 8.094 1.00 0.00 H new ATOM 1694 N GLY A 105 -5.345 5.985 10.664 1.00 0.00 N ATOM 1695 CA GLY A 105 -5.169 6.943 11.739 1.00 0.00 C ATOM 1696 C GLY A 105 -5.687 8.321 11.378 1.00 0.00 C ATOM 1697 O GLY A 105 -5.173 9.331 11.861 1.00 0.00 O ATOM 0 H GLY A 105 -5.563 6.395 9.756 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -5.687 6.585 12.629 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -4.111 7.011 11.992 1.00 0.00 H new ATOM 1701 N LYS A 106 -6.708 8.365 10.527 1.00 0.00 N ATOM 1702 CA LYS A 106 -7.294 9.631 10.102 1.00 0.00 C ATOM 1703 C LYS A 106 -8.180 10.213 11.199 1.00 0.00 C ATOM 1704 O LYS A 106 -8.078 11.394 11.532 1.00 0.00 O ATOM 1705 CB LYS A 106 -8.108 9.435 8.821 1.00 0.00 C ATOM 1706 CG LYS A 106 -7.366 9.851 7.560 1.00 0.00 C ATOM 1707 CD LYS A 106 -7.248 8.701 6.572 1.00 0.00 C ATOM 1708 CE LYS A 106 -6.062 7.809 6.894 1.00 0.00 C ATOM 1709 NZ LYS A 106 -6.185 6.468 6.258 1.00 0.00 N ATOM 0 H LYS A 106 -7.146 7.539 10.119 1.00 0.00 H new ATOM 0 HA LYS A 106 -6.483 10.332 9.904 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -8.391 8.386 8.737 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -9.032 10.009 8.896 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -7.888 10.684 7.089 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -6.370 10.207 7.824 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -8.164 8.110 6.589 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -7.143 9.097 5.562 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -5.144 8.289 6.554 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -5.979 7.692 7.975 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -5.311 5.927 6.417 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -6.989 5.958 6.676 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -6.340 6.581 5.236 1.00 0.00 H new ATOM 1723 N SER A 107 -9.050 9.377 11.758 1.00 0.00 N ATOM 1724 CA SER A 107 -9.953 9.808 12.818 1.00 0.00 C ATOM 1725 C SER A 107 -9.827 8.906 14.041 1.00 0.00 C ATOM 1726 O SER A 107 -9.471 9.361 15.127 1.00 0.00 O ATOM 1727 CB SER A 107 -11.398 9.807 12.316 1.00 0.00 C ATOM 1728 OG SER A 107 -11.757 11.072 11.790 1.00 0.00 O ATOM 0 H SER A 107 -9.148 8.397 11.494 1.00 0.00 H new ATOM 0 HA SER A 107 -9.676 10.822 13.107 1.00 0.00 H new ATOM 0 HB2 SER A 107 -11.519 9.043 11.548 1.00 0.00 H new ATOM 0 HB3 SER A 107 -12.070 9.546 13.134 1.00 0.00 H new ATOM 0 HG SER A 107 -12.684 11.044 11.475 1.00 0.00 H new ATOM 1734 N GLY A 108 -10.121 7.623 13.856 1.00 0.00 N ATOM 1735 CA GLY A 108 -10.034 6.676 14.951 1.00 0.00 C ATOM 1736 C GLY A 108 -11.232 5.742 15.008 1.00 0.00 C ATOM 1737 O GLY A 108 -11.425 4.929 14.104 1.00 0.00 O ATOM 0 H GLY A 108 -10.418 7.223 12.966 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -9.123 6.087 14.847 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -9.956 7.220 15.892 1.00 0.00 H new ATOM 1741 N PRO A 109 -12.063 5.834 16.062 1.00 0.00 N ATOM 1742 CA PRO A 109 -13.246 4.979 16.209 1.00 0.00 C ATOM 1743 C PRO A 109 -14.153 5.033 14.984 1.00 0.00 C ATOM 1744 O PRO A 109 -14.389 6.102 14.420 1.00 0.00 O ATOM 1745 CB PRO A 109 -13.963 5.564 17.429 1.00 0.00 C ATOM 1746 CG PRO A 109 -12.892 6.248 18.207 1.00 0.00 C ATOM 1747 CD PRO A 109 -11.917 6.773 17.190 1.00 0.00 C ATOM 0 HA PRO A 109 -12.977 3.929 16.321 1.00 0.00 H new ATOM 0 HB2 PRO A 109 -14.744 6.264 17.131 1.00 0.00 H new ATOM 0 HB3 PRO A 109 -14.443 4.783 18.018 1.00 0.00 H new ATOM 0 HG2 PRO A 109 -13.303 7.058 18.809 1.00 0.00 H new ATOM 0 HG3 PRO A 109 -12.405 5.556 18.894 1.00 0.00 H new ATOM 0 HD2 PRO A 109 -12.155 7.795 16.896 1.00 0.00 H new ATOM 0 HD3 PRO A 109 -10.898 6.781 17.577 1.00 0.00 H new ATOM 1755 N SER A 110 -14.660 3.873 14.579 1.00 0.00 N ATOM 1756 CA SER A 110 -15.542 3.788 13.421 1.00 0.00 C ATOM 1757 C SER A 110 -16.257 2.441 13.380 1.00 0.00 C ATOM 1758 O SER A 110 -16.543 1.911 12.307 1.00 0.00 O ATOM 1759 CB SER A 110 -14.746 3.994 12.130 1.00 0.00 C ATOM 1760 OG SER A 110 -13.994 2.839 11.803 1.00 0.00 O ATOM 0 H SER A 110 -14.475 2.980 15.035 1.00 0.00 H new ATOM 0 HA SER A 110 -16.291 4.575 13.508 1.00 0.00 H new ATOM 0 HB2 SER A 110 -15.428 4.231 11.313 1.00 0.00 H new ATOM 0 HB3 SER A 110 -14.077 4.847 12.244 1.00 0.00 H new ATOM 0 HG SER A 110 -13.496 2.997 10.974 1.00 0.00 H new ATOM 1766 N SER A 111 -16.543 1.894 14.556 1.00 0.00 N ATOM 1767 CA SER A 111 -17.225 0.609 14.656 1.00 0.00 C ATOM 1768 C SER A 111 -17.625 0.315 16.099 1.00 0.00 C ATOM 1769 O SER A 111 -16.817 0.453 17.017 1.00 0.00 O ATOM 1770 CB SER A 111 -16.328 -0.510 14.124 1.00 0.00 C ATOM 1771 OG SER A 111 -17.059 -1.712 13.951 1.00 0.00 O ATOM 0 H SER A 111 -16.313 2.320 15.454 1.00 0.00 H new ATOM 0 HA SER A 111 -18.130 0.658 14.051 1.00 0.00 H new ATOM 0 HB2 SER A 111 -15.889 -0.208 13.173 1.00 0.00 H new ATOM 0 HB3 SER A 111 -15.503 -0.679 14.816 1.00 0.00 H new ATOM 0 HG SER A 111 -16.463 -2.411 13.609 1.00 0.00 H new ATOM 1777 N GLY A 112 -18.875 -0.091 16.289 1.00 0.00 N ATOM 1778 CA GLY A 112 -19.360 -0.398 17.623 1.00 0.00 C ATOM 1779 C GLY A 112 -19.215 -1.867 17.968 1.00 0.00 C ATOM 1780 O GLY A 112 -19.353 -2.212 19.160 1.00 0.00 O ATOM 1781 OXT GLY A 112 -18.965 -2.671 17.046 1.00 0.00 O ATOM 0 H GLY A 112 -19.561 -0.213 15.544 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -18.812 0.199 18.352 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -20.409 -0.112 17.700 1.00 0.00 H new TER 1785 GLY A 112