USER MOD reduce.3.24.130724 H: found=0, std=0, add=786, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 786 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 34 GLN : amide:sc= 0.607 X(o=1.2,f=1.1) USER MOD Set 1.2: B 38 TYR OH : rot 180:sc= 0.626 USER MOD Set 2.1: A 49 TYR OH : rot 163:sc= 1.36 USER MOD Set 2.2: B 48 GLN : amide:sc= 0.988 K(o=2.3,f=1.4) USER MOD Set 3.1: A 34 GLN :FLIP amide:sc= -0.264 F(o=-0.85,f=-0.17) USER MOD Set 3.2: A 38 TYR OH : rot 98:sc= 0.0975 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 13 SER OG : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 170:sc= 0.279 USER MOD Single : A 16 GLN : amide:sc= 0.128 X(o=0.13,f=-0.021) USER MOD Single : A 17 MET CE :methyl -174:sc= 0 (180deg=-0.0159) USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 20 MET CE :methyl -165:sc= -0.0199 (180deg=-0.285) USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 137:sc= 1.24 USER MOD Single : A 36 LYS NZ :NH3+ -176:sc= 0.901 (180deg=0.703) USER MOD Single : A 37 ASN : amide:sc= -1.59! C(o=-1.6!,f=-3.1!) USER MOD Single : A 46 THR OG1 : rot 180:sc= -0.0368 USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 50 SER OG : rot 54:sc= 0.688 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 HIS : no HD1:sc= -0.0149 X(o=-0.015,f=-0.15) USER MOD Single : B 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 2 SER OG : rot 180:sc= 0 USER MOD Single : B 13 SER OG : rot 93:sc= 0.221 USER MOD Single : B 15 SER OG : rot 171:sc= 1.12 USER MOD Single : B 16 GLN : amide:sc= 0.248 X(o=0.25,f=0) USER MOD Single : B 17 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 19 SER OG : rot 180:sc= 0.00514 USER MOD Single : B 20 MET CE :methyl -121:sc= 0 (180deg=-0.00573) USER MOD Single : B 23 SER OG : rot 180:sc= 0 USER MOD Single : B 30 THR OG1 : rot -25:sc= 0.16 USER MOD Single : B 35 THR OG1 : rot 159:sc= 1.42 USER MOD Single : B 36 LYS NZ :NH3+ 167:sc= -0.0731 (180deg=-0.339) USER MOD Single : B 37 ASN : amide:sc= -0.228 K(o=-0.23,f=-2.6!) USER MOD Single : B 46 THR OG1 : rot 33:sc= -0.613 USER MOD Single : B 49 TYR OH : rot 174:sc= 1.06 USER MOD Single : B 50 SER OG : rot -32:sc= 0.0373 USER MOD Single : B 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 52 HIS : no HD1:sc= 0 X(o=0,f=-0.0025) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 18.861 19.166 -3.554 1.00 10.00 N ATOM 2 CA GLY A 1 18.958 17.778 -4.069 1.00 10.00 C ATOM 3 C GLY A 1 19.544 16.832 -3.049 1.00 10.00 C ATOM 4 O GLY A 1 18.977 16.641 -1.971 1.00 10.00 O ATOM 0 H1 GLY A 1 18.453 19.781 -4.287 1.00 10.00 H new ATOM 0 H2 GLY A 1 18.252 19.182 -2.711 1.00 10.00 H new ATOM 0 H3 GLY A 1 19.810 19.510 -3.302 1.00 10.00 H new ATOM 0 HA2 GLY A 1 17.967 17.429 -4.358 1.00 10.00 H new ATOM 0 HA3 GLY A 1 19.574 17.768 -4.968 1.00 10.00 H new ATOM 10 N SER A 2 20.684 16.240 -3.384 1.00 10.00 N ATOM 11 CA SER A 2 21.356 15.312 -2.491 1.00 10.00 C ATOM 12 C SER A 2 22.655 15.918 -1.967 1.00 10.00 C ATOM 13 O SER A 2 23.644 16.012 -2.694 1.00 10.00 O ATOM 14 CB SER A 2 21.647 13.996 -3.213 1.00 10.00 C ATOM 15 OG SER A 2 20.518 13.557 -3.952 1.00 10.00 O ATOM 0 H SER A 2 21.162 16.389 -4.273 1.00 10.00 H new ATOM 0 HA SER A 2 20.698 15.113 -1.645 1.00 10.00 H new ATOM 0 HB2 SER A 2 22.496 14.126 -3.884 1.00 10.00 H new ATOM 0 HB3 SER A 2 21.928 13.234 -2.486 1.00 10.00 H new ATOM 0 HG SER A 2 20.731 12.715 -4.405 1.00 10.00 H new ATOM 21 N PRO A 3 22.664 16.357 -0.701 1.00 10.00 N ATOM 22 CA PRO A 3 23.845 16.955 -0.083 1.00 10.00 C ATOM 23 C PRO A 3 24.850 15.897 0.367 1.00 10.00 C ATOM 24 O PRO A 3 24.496 14.722 0.514 1.00 10.00 O ATOM 25 CB PRO A 3 23.265 17.689 1.125 1.00 10.00 C ATOM 26 CG PRO A 3 22.072 16.884 1.512 1.00 10.00 C ATOM 27 CD PRO A 3 21.518 16.308 0.232 1.00 10.00 C ATOM 0 HA PRO A 3 24.394 17.599 -0.769 1.00 10.00 H new ATOM 0 HB2 PRO A 3 23.987 17.746 1.940 1.00 10.00 H new ATOM 0 HB3 PRO A 3 22.988 18.713 0.872 1.00 10.00 H new ATOM 0 HG2 PRO A 3 22.347 16.092 2.208 1.00 10.00 H new ATOM 0 HG3 PRO A 3 21.329 17.505 2.013 1.00 10.00 H new ATOM 0 HD2 PRO A 3 21.161 15.288 0.374 1.00 10.00 H new ATOM 0 HD3 PRO A 3 20.675 16.892 -0.138 1.00 10.00 H new ATOM 35 N PRO A 4 26.117 16.292 0.609 1.00 10.00 N ATOM 36 CA PRO A 4 27.167 15.366 1.059 1.00 10.00 C ATOM 37 C PRO A 4 26.900 14.844 2.470 1.00 10.00 C ATOM 38 O PRO A 4 27.612 13.973 2.967 1.00 10.00 O ATOM 39 CB PRO A 4 28.447 16.212 1.038 1.00 10.00 C ATOM 40 CG PRO A 4 28.110 17.435 0.256 1.00 10.00 C ATOM 41 CD PRO A 4 26.639 17.660 0.457 1.00 10.00 C ATOM 0 HA PRO A 4 27.224 14.482 0.423 1.00 10.00 H new ATOM 0 HB2 PRO A 4 28.763 16.469 2.049 1.00 10.00 H new ATOM 0 HB3 PRO A 4 29.269 15.666 0.576 1.00 10.00 H new ATOM 0 HG2 PRO A 4 28.687 18.292 0.603 1.00 10.00 H new ATOM 0 HG3 PRO A 4 28.344 17.300 -0.800 1.00 10.00 H new ATOM 0 HD2 PRO A 4 26.440 18.269 1.339 1.00 10.00 H new ATOM 0 HD3 PRO A 4 26.188 18.173 -0.393 1.00 10.00 H new ATOM 49 N GLU A 5 25.871 15.391 3.107 1.00 10.00 N ATOM 50 CA GLU A 5 25.493 14.983 4.454 1.00 10.00 C ATOM 51 C GLU A 5 24.568 13.772 4.393 1.00 10.00 C ATOM 52 O GLU A 5 24.246 13.170 5.416 1.00 10.00 O ATOM 53 CB GLU A 5 24.796 16.136 5.189 1.00 10.00 C ATOM 54 CG GLU A 5 25.382 17.510 4.898 1.00 10.00 C ATOM 55 CD GLU A 5 26.879 17.569 5.121 1.00 10.00 C ATOM 56 OE1 GLU A 5 27.321 17.450 6.281 1.00 10.00 O ATOM 57 OE2 GLU A 5 27.623 17.731 4.133 1.00 10.00 O ATOM 0 H GLU A 5 25.281 16.122 2.709 1.00 10.00 H new ATOM 0 HA GLU A 5 26.397 14.715 5.001 1.00 10.00 H new ATOM 0 HB2 GLU A 5 23.740 16.139 4.917 1.00 10.00 H new ATOM 0 HB3 GLU A 5 24.848 15.952 6.262 1.00 10.00 H new ATOM 0 HG2 GLU A 5 25.162 17.783 3.866 1.00 10.00 H new ATOM 0 HG3 GLU A 5 24.895 18.250 5.534 1.00 10.00 H new ATOM 64 N ALA A 6 24.138 13.426 3.189 1.00 10.00 N ATOM 65 CA ALA A 6 23.255 12.291 2.988 1.00 10.00 C ATOM 66 C ALA A 6 24.067 11.033 2.717 1.00 10.00 C ATOM 67 O ALA A 6 24.977 11.041 1.885 1.00 10.00 O ATOM 68 CB ALA A 6 22.288 12.562 1.844 1.00 10.00 C ATOM 0 H ALA A 6 24.389 13.920 2.332 1.00 10.00 H new ATOM 0 HA ALA A 6 22.673 12.138 3.897 1.00 10.00 H new ATOM 0 HB1 ALA A 6 21.634 11.700 1.708 1.00 10.00 H new ATOM 0 HB2 ALA A 6 21.686 13.441 2.076 1.00 10.00 H new ATOM 0 HB3 ALA A 6 22.850 12.739 0.927 1.00 10.00 H new ATOM 74 N ASP A 7 23.744 9.958 3.425 1.00 10.00 N ATOM 75 CA ASP A 7 24.452 8.693 3.257 1.00 10.00 C ATOM 76 C ASP A 7 24.145 8.085 1.889 1.00 10.00 C ATOM 77 O ASP A 7 22.978 7.925 1.520 1.00 10.00 O ATOM 78 CB ASP A 7 24.063 7.711 4.365 1.00 10.00 C ATOM 79 CG ASP A 7 24.980 6.507 4.419 1.00 10.00 C ATOM 80 OD1 ASP A 7 24.726 5.523 3.693 1.00 10.00 O ATOM 81 OD2 ASP A 7 25.957 6.532 5.194 1.00 10.00 O ATOM 0 H ASP A 7 22.998 9.936 4.120 1.00 10.00 H new ATOM 0 HA ASP A 7 25.522 8.889 3.321 1.00 10.00 H new ATOM 0 HB2 ASP A 7 24.086 8.225 5.326 1.00 10.00 H new ATOM 0 HB3 ASP A 7 23.038 7.376 4.206 1.00 10.00 H new ATOM 86 N PRO A 8 25.192 7.730 1.124 1.00 10.00 N ATOM 87 CA PRO A 8 25.043 7.150 -0.217 1.00 10.00 C ATOM 88 C PRO A 8 24.307 5.814 -0.213 1.00 10.00 C ATOM 89 O PRO A 8 23.688 5.434 -1.204 1.00 10.00 O ATOM 90 CB PRO A 8 26.486 6.970 -0.697 1.00 10.00 C ATOM 91 CG PRO A 8 27.314 6.963 0.542 1.00 10.00 C ATOM 92 CD PRO A 8 26.610 7.871 1.509 1.00 10.00 C ATOM 0 HA PRO A 8 24.442 7.791 -0.862 1.00 10.00 H new ATOM 0 HB2 PRO A 8 26.602 6.040 -1.253 1.00 10.00 H new ATOM 0 HB3 PRO A 8 26.783 7.780 -1.364 1.00 10.00 H new ATOM 0 HG2 PRO A 8 27.404 5.955 0.947 1.00 10.00 H new ATOM 0 HG3 PRO A 8 28.325 7.316 0.339 1.00 10.00 H new ATOM 0 HD2 PRO A 8 26.780 7.569 2.543 1.00 10.00 H new ATOM 0 HD3 PRO A 8 26.953 8.902 1.417 1.00 10.00 H new ATOM 100 N ARG A 9 24.353 5.109 0.908 1.00 10.00 N ATOM 101 CA ARG A 9 23.684 3.819 1.011 1.00 10.00 C ATOM 102 C ARG A 9 22.228 4.012 1.414 1.00 10.00 C ATOM 103 O ARG A 9 21.361 3.212 1.060 1.00 10.00 O ATOM 104 CB ARG A 9 24.392 2.925 2.029 1.00 10.00 C ATOM 105 CG ARG A 9 25.846 2.651 1.688 1.00 10.00 C ATOM 106 CD ARG A 9 26.643 2.290 2.927 1.00 10.00 C ATOM 107 NE ARG A 9 26.737 3.408 3.864 1.00 10.00 N ATOM 108 CZ ARG A 9 27.504 3.405 4.953 1.00 10.00 C ATOM 109 NH1 ARG A 9 28.208 2.325 5.274 1.00 10.00 N ATOM 110 NH2 ARG A 9 27.558 4.477 5.729 1.00 10.00 N ATOM 0 H ARG A 9 24.842 5.405 1.753 1.00 10.00 H new ATOM 0 HA ARG A 9 23.722 3.334 0.036 1.00 10.00 H new ATOM 0 HB2 ARG A 9 24.340 3.395 3.011 1.00 10.00 H new ATOM 0 HB3 ARG A 9 23.859 1.977 2.100 1.00 10.00 H new ATOM 0 HG2 ARG A 9 25.905 1.838 0.965 1.00 10.00 H new ATOM 0 HG3 ARG A 9 26.283 3.530 1.215 1.00 10.00 H new ATOM 0 HD2 ARG A 9 26.176 1.440 3.423 1.00 10.00 H new ATOM 0 HD3 ARG A 9 27.645 1.977 2.635 1.00 10.00 H new ATOM 0 HE ARG A 9 26.181 4.241 3.672 1.00 10.00 H new ATOM 0 HH11 ARG A 9 28.163 1.493 4.685 1.00 10.00 H new ATOM 0 HH12 ARG A 9 28.794 2.328 6.109 1.00 10.00 H new ATOM 0 HH21 ARG A 9 27.012 5.306 5.493 1.00 10.00 H new ATOM 0 HH22 ARG A 9 28.146 4.474 6.563 1.00 10.00 H new ATOM 124 N LEU A 10 21.967 5.089 2.143 1.00 10.00 N ATOM 125 CA LEU A 10 20.619 5.403 2.601 1.00 10.00 C ATOM 126 C LEU A 10 19.724 5.775 1.421 1.00 10.00 C ATOM 127 O LEU A 10 18.575 5.344 1.340 1.00 10.00 O ATOM 128 CB LEU A 10 20.664 6.552 3.615 1.00 10.00 C ATOM 129 CG LEU A 10 19.313 6.948 4.217 1.00 10.00 C ATOM 130 CD1 LEU A 10 18.771 5.831 5.096 1.00 10.00 C ATOM 131 CD2 LEU A 10 19.447 8.237 5.014 1.00 10.00 C ATOM 0 H LEU A 10 22.675 5.764 2.432 1.00 10.00 H new ATOM 0 HA LEU A 10 20.201 4.520 3.084 1.00 10.00 H new ATOM 0 HB2 LEU A 10 21.336 6.273 4.426 1.00 10.00 H new ATOM 0 HB3 LEU A 10 21.097 7.426 3.129 1.00 10.00 H new ATOM 0 HG LEU A 10 18.608 7.115 3.403 1.00 10.00 H new ATOM 0 HD11 LEU A 10 17.810 6.131 5.515 1.00 10.00 H new ATOM 0 HD12 LEU A 10 18.640 4.929 4.499 1.00 10.00 H new ATOM 0 HD13 LEU A 10 19.473 5.632 5.905 1.00 10.00 H new ATOM 0 HD21 LEU A 10 18.479 8.506 5.436 1.00 10.00 H new ATOM 0 HD22 LEU A 10 20.167 8.093 5.820 1.00 10.00 H new ATOM 0 HD23 LEU A 10 19.792 9.036 4.358 1.00 10.00 H new ATOM 143 N ILE A 11 20.260 6.567 0.497 1.00 10.00 N ATOM 144 CA ILE A 11 19.501 6.986 -0.673 1.00 10.00 C ATOM 145 C ILE A 11 19.337 5.825 -1.654 1.00 10.00 C ATOM 146 O ILE A 11 18.352 5.756 -2.388 1.00 10.00 O ATOM 147 CB ILE A 11 20.157 8.199 -1.378 1.00 10.00 C ATOM 148 CG1 ILE A 11 19.247 8.730 -2.492 1.00 10.00 C ATOM 149 CG2 ILE A 11 21.529 7.831 -1.933 1.00 10.00 C ATOM 150 CD1 ILE A 11 19.691 10.061 -3.059 1.00 10.00 C ATOM 0 H ILE A 11 21.213 6.929 0.537 1.00 10.00 H new ATOM 0 HA ILE A 11 18.515 7.297 -0.328 1.00 10.00 H new ATOM 0 HB ILE A 11 20.294 8.988 -0.639 1.00 10.00 H new ATOM 0 HG12 ILE A 11 19.208 7.997 -3.298 1.00 10.00 H new ATOM 0 HG13 ILE A 11 18.233 8.831 -2.104 1.00 10.00 H new ATOM 0 HG21 ILE A 11 21.968 8.700 -2.423 1.00 10.00 H new ATOM 0 HG22 ILE A 11 22.177 7.508 -1.118 1.00 10.00 H new ATOM 0 HG23 ILE A 11 21.424 7.022 -2.655 1.00 10.00 H new ATOM 0 HD11 ILE A 11 18.999 10.372 -3.842 1.00 10.00 H new ATOM 0 HD12 ILE A 11 19.702 10.809 -2.266 1.00 10.00 H new ATOM 0 HD13 ILE A 11 20.692 9.962 -3.478 1.00 10.00 H new ATOM 162 N GLU A 12 20.280 4.887 -1.626 1.00 10.00 N ATOM 163 CA GLU A 12 20.241 3.732 -2.515 1.00 10.00 C ATOM 164 C GLU A 12 19.105 2.783 -2.145 1.00 10.00 C ATOM 165 O GLU A 12 18.755 1.891 -2.920 1.00 10.00 O ATOM 166 CB GLU A 12 21.577 2.993 -2.486 1.00 10.00 C ATOM 167 CG GLU A 12 22.555 3.482 -3.542 1.00 10.00 C ATOM 168 CD GLU A 12 22.160 3.057 -4.945 1.00 10.00 C ATOM 169 OE1 GLU A 12 21.326 3.743 -5.571 1.00 10.00 O ATOM 170 OE2 GLU A 12 22.677 2.029 -5.425 1.00 10.00 O ATOM 0 H GLU A 12 21.082 4.905 -0.996 1.00 10.00 H new ATOM 0 HA GLU A 12 20.059 4.096 -3.526 1.00 10.00 H new ATOM 0 HB2 GLU A 12 22.028 3.110 -1.501 1.00 10.00 H new ATOM 0 HB3 GLU A 12 21.399 1.927 -2.631 1.00 10.00 H new ATOM 0 HG2 GLU A 12 22.616 4.569 -3.499 1.00 10.00 H new ATOM 0 HG3 GLU A 12 23.550 3.098 -3.316 1.00 10.00 H new ATOM 177 N SER A 13 18.531 2.974 -0.963 1.00 10.00 N ATOM 178 CA SER A 13 17.426 2.139 -0.516 1.00 10.00 C ATOM 179 C SER A 13 16.170 2.463 -1.325 1.00 10.00 C ATOM 180 O SER A 13 15.285 1.625 -1.489 1.00 10.00 O ATOM 181 CB SER A 13 17.182 2.338 0.983 1.00 10.00 C ATOM 182 OG SER A 13 18.379 2.140 1.724 1.00 10.00 O ATOM 0 H SER A 13 18.812 3.697 -0.300 1.00 10.00 H new ATOM 0 HA SER A 13 17.680 1.091 -0.679 1.00 10.00 H new ATOM 0 HB2 SER A 13 16.801 3.343 1.163 1.00 10.00 H new ATOM 0 HB3 SER A 13 16.418 1.641 1.327 1.00 10.00 H new ATOM 0 HG SER A 13 18.199 2.274 2.678 1.00 10.00 H new ATOM 188 N LEU A 14 16.116 3.682 -1.856 1.00 10.00 N ATOM 189 CA LEU A 14 14.983 4.119 -2.662 1.00 10.00 C ATOM 190 C LEU A 14 15.114 3.585 -4.085 1.00 10.00 C ATOM 191 O LEU A 14 14.164 3.033 -4.644 1.00 10.00 O ATOM 192 CB LEU A 14 14.885 5.652 -2.688 1.00 10.00 C ATOM 193 CG LEU A 14 14.478 6.303 -1.364 1.00 10.00 C ATOM 194 CD1 LEU A 14 15.706 6.778 -0.603 1.00 10.00 C ATOM 195 CD2 LEU A 14 13.527 7.461 -1.616 1.00 10.00 C ATOM 0 H LEU A 14 16.846 4.385 -1.741 1.00 10.00 H new ATOM 0 HA LEU A 14 14.073 3.723 -2.211 1.00 10.00 H new ATOM 0 HB2 LEU A 14 15.851 6.056 -2.991 1.00 10.00 H new ATOM 0 HB3 LEU A 14 14.164 5.941 -3.453 1.00 10.00 H new ATOM 0 HG LEU A 14 13.965 5.558 -0.755 1.00 10.00 H new ATOM 0 HD11 LEU A 14 15.397 7.238 0.336 1.00 10.00 H new ATOM 0 HD12 LEU A 14 16.356 5.928 -0.394 1.00 10.00 H new ATOM 0 HD13 LEU A 14 16.247 7.509 -1.205 1.00 10.00 H new ATOM 0 HD21 LEU A 14 13.246 7.914 -0.665 1.00 10.00 H new ATOM 0 HD22 LEU A 14 14.018 8.206 -2.242 1.00 10.00 H new ATOM 0 HD23 LEU A 14 12.633 7.095 -2.121 1.00 10.00 H new ATOM 207 N SER A 15 16.306 3.733 -4.652 1.00 10.00 N ATOM 208 CA SER A 15 16.583 3.280 -6.008 1.00 10.00 C ATOM 209 C SER A 15 16.459 1.761 -6.115 1.00 10.00 C ATOM 210 O SER A 15 16.052 1.228 -7.153 1.00 10.00 O ATOM 211 CB SER A 15 17.986 3.732 -6.410 1.00 10.00 C ATOM 212 OG SER A 15 18.700 4.201 -5.276 1.00 10.00 O ATOM 0 H SER A 15 17.103 4.168 -4.187 1.00 10.00 H new ATOM 0 HA SER A 15 15.850 3.719 -6.685 1.00 10.00 H new ATOM 0 HB2 SER A 15 18.524 2.903 -6.869 1.00 10.00 H new ATOM 0 HB3 SER A 15 17.920 4.522 -7.158 1.00 10.00 H new ATOM 0 HG SER A 15 19.640 4.340 -5.516 1.00 10.00 H new ATOM 218 N GLN A 16 16.801 1.066 -5.032 1.00 10.00 N ATOM 219 CA GLN A 16 16.727 -0.389 -4.993 1.00 10.00 C ATOM 220 C GLN A 16 15.287 -0.858 -5.158 1.00 10.00 C ATOM 221 O GLN A 16 15.024 -1.867 -5.817 1.00 10.00 O ATOM 222 CB GLN A 16 17.304 -0.916 -3.677 1.00 10.00 C ATOM 223 CG GLN A 16 17.312 -2.434 -3.572 1.00 10.00 C ATOM 224 CD GLN A 16 18.232 -3.089 -4.586 1.00 10.00 C ATOM 225 OE1 GLN A 16 19.409 -3.313 -4.315 1.00 10.00 O ATOM 226 NE2 GLN A 16 17.702 -3.411 -5.758 1.00 10.00 N ATOM 0 H GLN A 16 17.133 1.492 -4.167 1.00 10.00 H new ATOM 0 HA GLN A 16 17.317 -0.784 -5.820 1.00 10.00 H new ATOM 0 HB2 GLN A 16 18.324 -0.548 -3.566 1.00 10.00 H new ATOM 0 HB3 GLN A 16 16.726 -0.507 -2.848 1.00 10.00 H new ATOM 0 HG2 GLN A 16 17.622 -2.722 -2.568 1.00 10.00 H new ATOM 0 HG3 GLN A 16 16.298 -2.809 -3.713 1.00 10.00 H new ATOM 0 HE21 GLN A 16 16.720 -3.209 -5.946 1.00 10.00 H new ATOM 0 HE22 GLN A 16 18.276 -3.861 -6.471 1.00 10.00 H new ATOM 235 N MET A 17 14.361 -0.112 -4.568 1.00 10.00 N ATOM 236 CA MET A 17 12.946 -0.446 -4.641 1.00 10.00 C ATOM 237 C MET A 17 12.438 -0.316 -6.071 1.00 10.00 C ATOM 238 O MET A 17 11.691 -1.167 -6.559 1.00 10.00 O ATOM 239 CB MET A 17 12.133 0.461 -3.714 1.00 10.00 C ATOM 240 CG MET A 17 12.416 0.236 -2.237 1.00 10.00 C ATOM 241 SD MET A 17 11.835 -1.370 -1.648 1.00 10.00 S ATOM 242 CE MET A 17 10.083 -1.045 -1.465 1.00 10.00 C ATOM 0 H MET A 17 14.567 0.731 -4.032 1.00 10.00 H new ATOM 0 HA MET A 17 12.824 -1.480 -4.318 1.00 10.00 H new ATOM 0 HB2 MET A 17 12.344 1.501 -3.961 1.00 10.00 H new ATOM 0 HB3 MET A 17 11.071 0.298 -3.900 1.00 10.00 H new ATOM 0 HG2 MET A 17 13.489 0.316 -2.061 1.00 10.00 H new ATOM 0 HG3 MET A 17 11.938 1.025 -1.656 1.00 10.00 H new ATOM 0 HE1 MET A 17 9.599 -1.908 -1.007 1.00 10.00 H new ATOM 0 HE2 MET A 17 9.940 -0.170 -0.832 1.00 10.00 H new ATOM 0 HE3 MET A 17 9.643 -0.860 -2.445 1.00 10.00 H new ATOM 252 N LEU A 18 12.869 0.742 -6.750 1.00 10.00 N ATOM 253 CA LEU A 18 12.456 0.988 -8.128 1.00 10.00 C ATOM 254 C LEU A 18 12.918 -0.142 -9.052 1.00 10.00 C ATOM 255 O LEU A 18 12.177 -0.571 -9.935 1.00 10.00 O ATOM 256 CB LEU A 18 13.004 2.335 -8.614 1.00 10.00 C ATOM 257 CG LEU A 18 12.335 2.906 -9.868 1.00 10.00 C ATOM 258 CD1 LEU A 18 10.853 3.150 -9.625 1.00 10.00 C ATOM 259 CD2 LEU A 18 13.020 4.196 -10.296 1.00 10.00 C ATOM 0 H LEU A 18 13.504 1.443 -6.369 1.00 10.00 H new ATOM 0 HA LEU A 18 11.367 1.020 -8.155 1.00 10.00 H new ATOM 0 HB2 LEU A 18 12.903 3.061 -7.807 1.00 10.00 H new ATOM 0 HB3 LEU A 18 14.070 2.224 -8.811 1.00 10.00 H new ATOM 0 HG LEU A 18 12.435 2.175 -10.670 1.00 10.00 H new ATOM 0 HD11 LEU A 18 10.398 3.556 -10.529 1.00 10.00 H new ATOM 0 HD12 LEU A 18 10.367 2.210 -9.365 1.00 10.00 H new ATOM 0 HD13 LEU A 18 10.730 3.860 -8.807 1.00 10.00 H new ATOM 0 HD21 LEU A 18 12.532 4.588 -11.188 1.00 10.00 H new ATOM 0 HD22 LEU A 18 12.950 4.929 -9.492 1.00 10.00 H new ATOM 0 HD23 LEU A 18 14.069 3.996 -10.514 1.00 10.00 H new ATOM 271 N SER A 19 14.137 -0.627 -8.830 1.00 10.00 N ATOM 272 CA SER A 19 14.691 -1.711 -9.637 1.00 10.00 C ATOM 273 C SER A 19 14.022 -3.043 -9.310 1.00 10.00 C ATOM 274 O SER A 19 14.048 -3.978 -10.112 1.00 10.00 O ATOM 275 CB SER A 19 16.200 -1.822 -9.417 1.00 10.00 C ATOM 276 OG SER A 19 16.918 -1.003 -10.325 1.00 10.00 O ATOM 0 H SER A 19 14.760 -0.286 -8.098 1.00 10.00 H new ATOM 0 HA SER A 19 14.496 -1.477 -10.684 1.00 10.00 H new ATOM 0 HB2 SER A 19 16.442 -1.533 -8.394 1.00 10.00 H new ATOM 0 HB3 SER A 19 16.511 -2.860 -9.537 1.00 10.00 H new ATOM 0 HG SER A 19 17.879 -1.094 -10.158 1.00 10.00 H new ATOM 282 N MET A 20 13.422 -3.128 -8.129 1.00 10.00 N ATOM 283 CA MET A 20 12.745 -4.347 -7.704 1.00 10.00 C ATOM 284 C MET A 20 11.407 -4.490 -8.410 1.00 10.00 C ATOM 285 O MET A 20 10.857 -5.585 -8.500 1.00 10.00 O ATOM 286 CB MET A 20 12.537 -4.354 -6.188 1.00 10.00 C ATOM 287 CG MET A 20 13.477 -5.288 -5.445 1.00 10.00 C ATOM 288 SD MET A 20 13.309 -7.005 -5.979 1.00 10.00 S ATOM 289 CE MET A 20 11.649 -7.390 -5.413 1.00 10.00 C ATOM 0 H MET A 20 13.390 -2.368 -7.449 1.00 10.00 H new ATOM 0 HA MET A 20 13.378 -5.193 -7.973 1.00 10.00 H new ATOM 0 HB2 MET A 20 12.670 -3.341 -5.808 1.00 10.00 H new ATOM 0 HB3 MET A 20 11.508 -4.642 -5.973 1.00 10.00 H new ATOM 0 HG2 MET A 20 14.505 -4.962 -5.599 1.00 10.00 H new ATOM 0 HG3 MET A 20 13.279 -5.222 -4.375 1.00 10.00 H new ATOM 0 HE1 MET A 20 11.501 -8.470 -5.427 1.00 10.00 H new ATOM 0 HE2 MET A 20 11.516 -7.019 -4.397 1.00 10.00 H new ATOM 0 HE3 MET A 20 10.921 -6.915 -6.071 1.00 10.00 H new ATOM 299 N GLY A 21 10.900 -3.381 -8.923 1.00 10.00 N ATOM 300 CA GLY A 21 9.631 -3.403 -9.612 1.00 10.00 C ATOM 301 C GLY A 21 8.559 -2.707 -8.808 1.00 10.00 C ATOM 302 O GLY A 21 7.365 -2.917 -9.031 1.00 10.00 O ATOM 0 H GLY A 21 11.346 -2.465 -8.874 1.00 10.00 H new ATOM 0 HA2 GLY A 21 9.733 -2.918 -10.583 1.00 10.00 H new ATOM 0 HA3 GLY A 21 9.335 -4.435 -9.801 1.00 10.00 H new ATOM 306 N PHE A 22 8.989 -1.886 -7.860 1.00 10.00 N ATOM 307 CA PHE A 22 8.070 -1.144 -7.016 1.00 10.00 C ATOM 308 C PHE A 22 7.909 0.272 -7.545 1.00 10.00 C ATOM 309 O PHE A 22 8.887 1.005 -7.690 1.00 10.00 O ATOM 310 CB PHE A 22 8.587 -1.104 -5.576 1.00 10.00 C ATOM 311 CG PHE A 22 7.569 -1.481 -4.539 1.00 10.00 C ATOM 312 CD1 PHE A 22 6.595 -0.578 -4.142 1.00 10.00 C ATOM 313 CD2 PHE A 22 7.593 -2.736 -3.957 1.00 10.00 C ATOM 314 CE1 PHE A 22 5.662 -0.926 -3.184 1.00 10.00 C ATOM 315 CE2 PHE A 22 6.664 -3.087 -2.997 1.00 10.00 C ATOM 316 CZ PHE A 22 5.697 -2.181 -2.611 1.00 10.00 C ATOM 0 H PHE A 22 9.974 -1.718 -7.657 1.00 10.00 H new ATOM 0 HA PHE A 22 7.102 -1.644 -7.029 1.00 10.00 H new ATOM 0 HB2 PHE A 22 9.440 -1.777 -5.491 1.00 10.00 H new ATOM 0 HB3 PHE A 22 8.951 -0.099 -5.362 1.00 10.00 H new ATOM 0 HD1 PHE A 22 6.565 0.406 -4.585 1.00 10.00 H new ATOM 0 HD2 PHE A 22 8.347 -3.449 -4.257 1.00 10.00 H new ATOM 0 HE1 PHE A 22 4.906 -0.216 -2.884 1.00 10.00 H new ATOM 0 HE2 PHE A 22 6.694 -4.069 -2.549 1.00 10.00 H new ATOM 0 HZ PHE A 22 4.969 -2.454 -1.862 1.00 10.00 H new ATOM 326 N SER A 23 6.675 0.646 -7.831 1.00 10.00 N ATOM 327 CA SER A 23 6.381 1.968 -8.343 1.00 10.00 C ATOM 328 C SER A 23 5.175 2.564 -7.627 1.00 10.00 C ATOM 329 O SER A 23 4.330 1.832 -7.103 1.00 10.00 O ATOM 330 CB SER A 23 6.132 1.901 -9.851 1.00 10.00 C ATOM 331 OG SER A 23 5.549 0.659 -10.224 1.00 10.00 O ATOM 0 H SER A 23 5.857 0.047 -7.716 1.00 10.00 H new ATOM 0 HA SER A 23 7.239 2.614 -8.158 1.00 10.00 H new ATOM 0 HB2 SER A 23 5.475 2.718 -10.150 1.00 10.00 H new ATOM 0 HB3 SER A 23 7.073 2.038 -10.384 1.00 10.00 H new ATOM 0 HG SER A 23 5.400 0.645 -11.192 1.00 10.00 H new ATOM 337 N ASP A 24 5.103 3.886 -7.592 1.00 10.00 N ATOM 338 CA ASP A 24 4.001 4.575 -6.937 1.00 10.00 C ATOM 339 C ASP A 24 3.266 5.477 -7.914 1.00 10.00 C ATOM 340 O ASP A 24 3.875 6.092 -8.789 1.00 10.00 O ATOM 341 CB ASP A 24 4.504 5.395 -5.747 1.00 10.00 C ATOM 342 CG ASP A 24 5.599 6.373 -6.126 1.00 10.00 C ATOM 343 OD1 ASP A 24 6.776 5.967 -6.169 1.00 10.00 O ATOM 344 OD2 ASP A 24 5.291 7.558 -6.360 1.00 10.00 O ATOM 0 H ASP A 24 5.797 4.505 -8.011 1.00 10.00 H new ATOM 0 HA ASP A 24 3.306 3.818 -6.573 1.00 10.00 H new ATOM 0 HB2 ASP A 24 3.669 5.943 -5.311 1.00 10.00 H new ATOM 0 HB3 ASP A 24 4.878 4.719 -4.978 1.00 10.00 H new ATOM 349 N GLU A 25 1.957 5.557 -7.760 1.00 10.00 N ATOM 350 CA GLU A 25 1.130 6.387 -8.623 1.00 10.00 C ATOM 351 C GLU A 25 0.835 7.724 -7.942 1.00 10.00 C ATOM 352 O GLU A 25 1.014 8.788 -8.536 1.00 10.00 O ATOM 353 CB GLU A 25 -0.181 5.663 -8.990 1.00 10.00 C ATOM 354 CG GLU A 25 -0.539 4.487 -8.081 1.00 10.00 C ATOM 355 CD GLU A 25 -0.824 4.906 -6.650 1.00 10.00 C ATOM 356 OE1 GLU A 25 0.145 5.099 -5.886 1.00 10.00 O ATOM 357 OE2 GLU A 25 -2.006 5.071 -6.297 1.00 10.00 O ATOM 0 H GLU A 25 1.439 5.054 -7.040 1.00 10.00 H new ATOM 0 HA GLU A 25 1.678 6.578 -9.546 1.00 10.00 H new ATOM 0 HB2 GLU A 25 -0.997 6.385 -8.966 1.00 10.00 H new ATOM 0 HB3 GLU A 25 -0.105 5.302 -10.016 1.00 10.00 H new ATOM 0 HG2 GLU A 25 -1.413 3.976 -8.485 1.00 10.00 H new ATOM 0 HG3 GLU A 25 0.281 3.768 -8.087 1.00 10.00 H new ATOM 364 N GLY A 26 0.390 7.655 -6.695 1.00 10.00 N ATOM 365 CA GLY A 26 0.088 8.853 -5.934 1.00 10.00 C ATOM 366 C GLY A 26 1.250 9.252 -5.057 1.00 10.00 C ATOM 367 O GLY A 26 1.248 10.322 -4.445 1.00 10.00 O ATOM 0 H GLY A 26 0.231 6.782 -6.192 1.00 10.00 H new ATOM 0 HA2 GLY A 26 -0.153 9.669 -6.616 1.00 10.00 H new ATOM 0 HA3 GLY A 26 -0.794 8.682 -5.317 1.00 10.00 H new ATOM 371 N GLY A 27 2.251 8.385 -5.011 1.00 10.00 N ATOM 372 CA GLY A 27 3.424 8.642 -4.205 1.00 10.00 C ATOM 373 C GLY A 27 3.332 8.002 -2.837 1.00 10.00 C ATOM 374 O GLY A 27 3.915 8.493 -1.873 1.00 10.00 O ATOM 0 H GLY A 27 2.270 7.502 -5.522 1.00 10.00 H new ATOM 0 HA2 GLY A 27 4.307 8.265 -4.721 1.00 10.00 H new ATOM 0 HA3 GLY A 27 3.556 9.718 -4.092 1.00 10.00 H new ATOM 378 N TRP A 28 2.610 6.890 -2.741 1.00 10.00 N ATOM 379 CA TRP A 28 2.453 6.198 -1.467 1.00 10.00 C ATOM 380 C TRP A 28 3.744 5.489 -1.063 1.00 10.00 C ATOM 381 O TRP A 28 3.963 5.215 0.114 1.00 10.00 O ATOM 382 CB TRP A 28 1.279 5.213 -1.518 1.00 10.00 C ATOM 383 CG TRP A 28 1.533 3.953 -2.299 1.00 10.00 C ATOM 384 CD1 TRP A 28 1.602 3.822 -3.656 1.00 10.00 C ATOM 385 CD2 TRP A 28 1.723 2.640 -1.761 1.00 10.00 C ATOM 386 NE1 TRP A 28 1.836 2.510 -3.994 1.00 10.00 N ATOM 387 CE2 TRP A 28 1.912 1.763 -2.848 1.00 10.00 C ATOM 388 CE3 TRP A 28 1.757 2.119 -0.466 1.00 10.00 C ATOM 389 CZ2 TRP A 28 2.132 0.398 -2.675 1.00 10.00 C ATOM 390 CZ3 TRP A 28 1.972 0.765 -0.296 1.00 10.00 C ATOM 391 CH2 TRP A 28 2.156 -0.083 -1.395 1.00 10.00 C ATOM 0 H TRP A 28 2.127 6.451 -3.525 1.00 10.00 H new ATOM 0 HA TRP A 28 2.231 6.947 -0.706 1.00 10.00 H new ATOM 0 HB2 TRP A 28 1.010 4.941 -0.498 1.00 10.00 H new ATOM 0 HB3 TRP A 28 0.417 5.722 -1.950 1.00 10.00 H new ATOM 0 HD1 TRP A 28 1.489 4.632 -4.362 1.00 10.00 H new ATOM 0 HE1 TRP A 28 1.937 2.151 -4.943 1.00 10.00 H new ATOM 0 HE3 TRP A 28 1.617 2.764 0.389 1.00 10.00 H new ATOM 0 HZ2 TRP A 28 2.278 -0.257 -3.521 1.00 10.00 H new ATOM 0 HZ3 TRP A 28 1.999 0.353 0.702 1.00 10.00 H new ATOM 0 HH2 TRP A 28 2.320 -1.137 -1.229 1.00 10.00 H new ATOM 402 N LEU A 29 4.606 5.223 -2.040 1.00 10.00 N ATOM 403 CA LEU A 29 5.873 4.551 -1.780 1.00 10.00 C ATOM 404 C LEU A 29 6.760 5.391 -0.862 1.00 10.00 C ATOM 405 O LEU A 29 7.216 4.911 0.174 1.00 10.00 O ATOM 406 CB LEU A 29 6.601 4.254 -3.093 1.00 10.00 C ATOM 407 CG LEU A 29 7.985 3.610 -2.949 1.00 10.00 C ATOM 408 CD1 LEU A 29 7.889 2.291 -2.197 1.00 10.00 C ATOM 409 CD2 LEU A 29 8.618 3.403 -4.316 1.00 10.00 C ATOM 0 H LEU A 29 4.449 5.463 -3.019 1.00 10.00 H new ATOM 0 HA LEU A 29 5.657 3.608 -1.277 1.00 10.00 H new ATOM 0 HB2 LEU A 29 5.974 3.596 -3.695 1.00 10.00 H new ATOM 0 HB3 LEU A 29 6.709 5.186 -3.647 1.00 10.00 H new ATOM 0 HG LEU A 29 8.620 4.284 -2.373 1.00 10.00 H new ATOM 0 HD11 LEU A 29 8.882 1.851 -2.106 1.00 10.00 H new ATOM 0 HD12 LEU A 29 7.478 2.468 -1.203 1.00 10.00 H new ATOM 0 HD13 LEU A 29 7.238 1.608 -2.742 1.00 10.00 H new ATOM 0 HD21 LEU A 29 9.600 2.945 -4.197 1.00 10.00 H new ATOM 0 HD22 LEU A 29 7.984 2.750 -4.916 1.00 10.00 H new ATOM 0 HD23 LEU A 29 8.725 4.365 -4.817 1.00 10.00 H new ATOM 421 N THR A 30 6.979 6.651 -1.227 1.00 10.00 N ATOM 422 CA THR A 30 7.812 7.537 -0.422 1.00 10.00 C ATOM 423 C THR A 30 7.193 7.776 0.958 1.00 10.00 C ATOM 424 O THR A 30 7.908 7.987 1.936 1.00 10.00 O ATOM 425 CB THR A 30 8.064 8.889 -1.131 1.00 10.00 C ATOM 426 OG1 THR A 30 8.852 9.750 -0.299 1.00 10.00 O ATOM 427 CG2 THR A 30 6.759 9.584 -1.483 1.00 10.00 C ATOM 0 H THR A 30 6.594 7.079 -2.069 1.00 10.00 H new ATOM 0 HA THR A 30 8.772 7.038 -0.293 1.00 10.00 H new ATOM 0 HB THR A 30 8.604 8.678 -2.054 1.00 10.00 H new ATOM 0 HG1 THR A 30 9.005 10.601 -0.761 1.00 10.00 H new ATOM 0 HG21 THR A 30 6.973 10.530 -1.980 1.00 10.00 H new ATOM 0 HG22 THR A 30 6.176 8.948 -2.150 1.00 10.00 H new ATOM 0 HG23 THR A 30 6.190 9.773 -0.573 1.00 10.00 H new ATOM 435 N ARG A 31 5.865 7.719 1.033 1.00 10.00 N ATOM 436 CA ARG A 31 5.164 7.913 2.297 1.00 10.00 C ATOM 437 C ARG A 31 5.369 6.695 3.189 1.00 10.00 C ATOM 438 O ARG A 31 5.627 6.821 4.386 1.00 10.00 O ATOM 439 CB ARG A 31 3.665 8.147 2.058 1.00 10.00 C ATOM 440 CG ARG A 31 3.364 9.321 1.137 1.00 10.00 C ATOM 441 CD ARG A 31 3.364 10.646 1.884 1.00 10.00 C ATOM 442 NE ARG A 31 2.094 10.886 2.576 1.00 10.00 N ATOM 443 CZ ARG A 31 1.427 12.044 2.553 1.00 10.00 C ATOM 444 NH1 ARG A 31 1.882 13.074 1.856 1.00 10.00 N ATOM 445 NH2 ARG A 31 0.288 12.161 3.216 1.00 10.00 N ATOM 0 H ARG A 31 5.256 7.540 0.235 1.00 10.00 H new ATOM 0 HA ARG A 31 5.572 8.795 2.791 1.00 10.00 H new ATOM 0 HB2 ARG A 31 3.229 7.243 1.633 1.00 10.00 H new ATOM 0 HB3 ARG A 31 3.176 8.316 3.017 1.00 10.00 H new ATOM 0 HG2 ARG A 31 4.105 9.355 0.339 1.00 10.00 H new ATOM 0 HG3 ARG A 31 2.393 9.171 0.664 1.00 10.00 H new ATOM 0 HD2 ARG A 31 4.179 10.654 2.608 1.00 10.00 H new ATOM 0 HD3 ARG A 31 3.554 11.458 1.182 1.00 10.00 H new ATOM 0 HE ARG A 31 1.692 10.117 3.112 1.00 10.00 H new ATOM 0 HH11 ARG A 31 2.751 12.989 1.329 1.00 10.00 H new ATOM 0 HH12 ARG A 31 1.364 13.952 1.847 1.00 10.00 H new ATOM 0 HH21 ARG A 31 -0.079 11.369 3.743 1.00 10.00 H new ATOM 0 HH22 ARG A 31 -0.223 13.044 3.200 1.00 10.00 H new ATOM 459 N LEU A 32 5.287 5.516 2.581 1.00 10.00 N ATOM 460 CA LEU A 32 5.461 4.254 3.288 1.00 10.00 C ATOM 461 C LEU A 32 6.889 4.134 3.817 1.00 10.00 C ATOM 462 O LEU A 32 7.124 3.567 4.885 1.00 10.00 O ATOM 463 CB LEU A 32 5.155 3.085 2.347 1.00 10.00 C ATOM 464 CG LEU A 32 4.620 1.828 3.024 1.00 10.00 C ATOM 465 CD1 LEU A 32 3.145 1.995 3.342 1.00 10.00 C ATOM 466 CD2 LEU A 32 4.843 0.614 2.138 1.00 10.00 C ATOM 0 H LEU A 32 5.098 5.409 1.584 1.00 10.00 H new ATOM 0 HA LEU A 32 4.772 4.227 4.132 1.00 10.00 H new ATOM 0 HB2 LEU A 32 4.427 3.417 1.606 1.00 10.00 H new ATOM 0 HB3 LEU A 32 6.066 2.827 1.806 1.00 10.00 H new ATOM 0 HG LEU A 32 5.161 1.673 3.958 1.00 10.00 H new ATOM 0 HD11 LEU A 32 2.772 1.092 3.825 1.00 10.00 H new ATOM 0 HD12 LEU A 32 3.011 2.846 4.010 1.00 10.00 H new ATOM 0 HD13 LEU A 32 2.591 2.168 2.419 1.00 10.00 H new ATOM 0 HD21 LEU A 32 4.456 -0.275 2.635 1.00 10.00 H new ATOM 0 HD22 LEU A 32 4.324 0.755 1.190 1.00 10.00 H new ATOM 0 HD23 LEU A 32 5.910 0.490 1.952 1.00 10.00 H new ATOM 478 N LEU A 33 7.834 4.692 3.068 1.00 10.00 N ATOM 479 CA LEU A 33 9.243 4.655 3.446 1.00 10.00 C ATOM 480 C LEU A 33 9.516 5.567 4.635 1.00 10.00 C ATOM 481 O LEU A 33 10.573 5.495 5.260 1.00 10.00 O ATOM 482 CB LEU A 33 10.108 5.084 2.265 1.00 10.00 C ATOM 483 CG LEU A 33 10.072 4.152 1.047 1.00 10.00 C ATOM 484 CD1 LEU A 33 10.853 4.767 -0.106 1.00 10.00 C ATOM 485 CD2 LEU A 33 10.627 2.776 1.394 1.00 10.00 C ATOM 0 H LEU A 33 7.649 5.178 2.191 1.00 10.00 H new ATOM 0 HA LEU A 33 9.491 3.633 3.731 1.00 10.00 H new ATOM 0 HB2 LEU A 33 9.793 6.079 1.949 1.00 10.00 H new ATOM 0 HB3 LEU A 33 11.140 5.169 2.605 1.00 10.00 H new ATOM 0 HG LEU A 33 9.033 4.027 0.742 1.00 10.00 H new ATOM 0 HD11 LEU A 33 10.821 4.097 -0.965 1.00 10.00 H new ATOM 0 HD12 LEU A 33 10.409 5.725 -0.376 1.00 10.00 H new ATOM 0 HD13 LEU A 33 11.889 4.920 0.197 1.00 10.00 H new ATOM 0 HD21 LEU A 33 10.590 2.136 0.513 1.00 10.00 H new ATOM 0 HD22 LEU A 33 11.660 2.874 1.728 1.00 10.00 H new ATOM 0 HD23 LEU A 33 10.029 2.333 2.190 1.00 10.00 H new ATOM 497 N GLN A 34 8.575 6.449 4.925 1.00 10.00 N ATOM 498 CA GLN A 34 8.723 7.369 6.038 1.00 10.00 C ATOM 499 C GLN A 34 8.045 6.836 7.293 1.00 10.00 C ATOM 500 O GLN A 34 8.352 7.270 8.406 1.00 10.00 O ATOM 501 CB GLN A 34 8.171 8.744 5.671 1.00 10.00 C ATOM 502 CG GLN A 34 9.044 9.505 4.683 1.00 10.00 C ATOM 503 CD GLN A 34 10.442 9.755 5.212 1.00 10.00 C ATOM 504 OE1 GLN A 34 11.344 8.818 4.979 1.00 10.00 O flip ATOM 505 NE2 GLN A 34 10.712 10.786 5.823 1.00 10.00 N flip ATOM 0 H GLN A 34 7.702 6.547 4.406 1.00 10.00 H new ATOM 0 HA GLN A 34 9.787 7.466 6.252 1.00 10.00 H new ATOM 0 HB2 GLN A 34 7.174 8.625 5.246 1.00 10.00 H new ATOM 0 HB3 GLN A 34 8.062 9.337 6.579 1.00 10.00 H new ATOM 0 HG2 GLN A 34 9.107 8.942 3.752 1.00 10.00 H new ATOM 0 HG3 GLN A 34 8.573 10.459 4.448 1.00 10.00 H new ATOM 0 HE21 GLN A 34 9.989 11.487 5.984 1.00 10.00 H new ATOM 0 HE22 GLN A 34 11.659 10.941 6.169 1.00 10.00 H new ATOM 514 N THR A 35 7.117 5.902 7.114 1.00 10.00 N ATOM 515 CA THR A 35 6.408 5.318 8.237 1.00 10.00 C ATOM 516 C THR A 35 7.017 3.974 8.631 1.00 10.00 C ATOM 517 O THR A 35 7.204 3.689 9.818 1.00 10.00 O ATOM 518 CB THR A 35 4.909 5.139 7.926 1.00 10.00 C ATOM 519 OG1 THR A 35 4.729 4.512 6.649 1.00 10.00 O ATOM 520 CG2 THR A 35 4.193 6.481 7.941 1.00 10.00 C ATOM 0 H THR A 35 6.842 5.537 6.202 1.00 10.00 H new ATOM 0 HA THR A 35 6.507 6.010 9.074 1.00 10.00 H new ATOM 0 HB THR A 35 4.481 4.500 8.699 1.00 10.00 H new ATOM 0 HG1 THR A 35 4.026 3.832 6.714 1.00 10.00 H new ATOM 0 HG21 THR A 35 3.136 6.332 7.719 1.00 10.00 H new ATOM 0 HG22 THR A 35 4.296 6.938 8.925 1.00 10.00 H new ATOM 0 HG23 THR A 35 4.633 7.136 7.189 1.00 10.00 H new ATOM 528 N LYS A 36 7.343 3.163 7.636 1.00 10.00 N ATOM 529 CA LYS A 36 7.930 1.852 7.877 1.00 10.00 C ATOM 530 C LYS A 36 9.428 1.849 7.588 1.00 10.00 C ATOM 531 O LYS A 36 10.050 0.786 7.516 1.00 10.00 O ATOM 532 CB LYS A 36 7.220 0.802 7.022 1.00 10.00 C ATOM 533 CG LYS A 36 6.147 0.033 7.778 1.00 10.00 C ATOM 534 CD LYS A 36 5.037 -0.427 6.852 1.00 10.00 C ATOM 535 CE LYS A 36 4.070 0.703 6.542 1.00 10.00 C ATOM 536 NZ LYS A 36 3.261 1.094 7.729 1.00 10.00 N ATOM 0 H LYS A 36 7.211 3.390 6.650 1.00 10.00 H new ATOM 0 HA LYS A 36 7.798 1.608 8.931 1.00 10.00 H new ATOM 0 HB2 LYS A 36 6.767 1.292 6.160 1.00 10.00 H new ATOM 0 HB3 LYS A 36 7.958 0.098 6.637 1.00 10.00 H new ATOM 0 HG2 LYS A 36 6.595 -0.831 8.269 1.00 10.00 H new ATOM 0 HG3 LYS A 36 5.730 0.664 8.563 1.00 10.00 H new ATOM 0 HD2 LYS A 36 5.468 -0.804 5.924 1.00 10.00 H new ATOM 0 HD3 LYS A 36 4.497 -1.254 7.312 1.00 10.00 H new ATOM 0 HE2 LYS A 36 4.628 1.568 6.184 1.00 10.00 H new ATOM 0 HE3 LYS A 36 3.404 0.397 5.735 1.00 10.00 H new ATOM 0 HZ1 LYS A 36 2.569 1.820 7.454 1.00 10.00 H new ATOM 0 HZ2 LYS A 36 2.760 0.260 8.097 1.00 10.00 H new ATOM 0 HZ3 LYS A 36 3.888 1.475 8.466 1.00 10.00 H new ATOM 550 N ASN A 37 9.997 3.049 7.438 1.00 10.00 N ATOM 551 CA ASN A 37 11.427 3.222 7.162 1.00 10.00 C ATOM 552 C ASN A 37 11.791 2.678 5.776 1.00 10.00 C ATOM 553 O ASN A 37 10.928 2.214 5.030 1.00 10.00 O ATOM 554 CB ASN A 37 12.277 2.538 8.246 1.00 10.00 C ATOM 555 CG ASN A 37 13.727 2.995 8.240 1.00 10.00 C ATOM 556 OD1 ASN A 37 14.021 4.167 8.001 1.00 10.00 O ATOM 557 ND2 ASN A 37 14.638 2.069 8.484 1.00 10.00 N ATOM 0 H ASN A 37 9.481 3.926 7.504 1.00 10.00 H new ATOM 0 HA ASN A 37 11.642 4.290 7.175 1.00 10.00 H new ATOM 0 HB2 ASN A 37 11.841 2.742 9.224 1.00 10.00 H new ATOM 0 HB3 ASN A 37 12.241 1.458 8.100 1.00 10.00 H new ATOM 0 HD21 ASN A 37 15.628 2.314 8.479 1.00 10.00 H new ATOM 0 HD22 ASN A 37 14.351 1.110 8.677 1.00 10.00 H new ATOM 564 N TYR A 38 13.072 2.745 5.433 1.00 10.00 N ATOM 565 CA TYR A 38 13.558 2.257 4.148 1.00 10.00 C ATOM 566 C TYR A 38 13.915 0.777 4.248 1.00 10.00 C ATOM 567 O TYR A 38 14.741 0.270 3.486 1.00 10.00 O ATOM 568 CB TYR A 38 14.788 3.054 3.705 1.00 10.00 C ATOM 569 CG TYR A 38 14.532 4.532 3.529 1.00 10.00 C ATOM 570 CD1 TYR A 38 13.812 5.004 2.441 1.00 10.00 C ATOM 571 CD2 TYR A 38 15.019 5.453 4.445 1.00 10.00 C ATOM 572 CE1 TYR A 38 13.580 6.356 2.273 1.00 10.00 C ATOM 573 CE2 TYR A 38 14.791 6.806 4.285 1.00 10.00 C ATOM 574 CZ TYR A 38 14.074 7.254 3.197 1.00 10.00 C ATOM 575 OH TYR A 38 13.845 8.602 3.037 1.00 10.00 O ATOM 0 H TYR A 38 13.798 3.136 6.033 1.00 10.00 H new ATOM 0 HA TYR A 38 12.767 2.386 3.409 1.00 10.00 H new ATOM 0 HB2 TYR A 38 15.581 2.918 4.441 1.00 10.00 H new ATOM 0 HB3 TYR A 38 15.154 2.644 2.763 1.00 10.00 H new ATOM 0 HD1 TYR A 38 13.427 4.304 1.714 1.00 10.00 H new ATOM 0 HD2 TYR A 38 15.585 5.107 5.297 1.00 10.00 H new ATOM 0 HE1 TYR A 38 13.015 6.708 1.423 1.00 10.00 H new ATOM 0 HE2 TYR A 38 15.173 7.510 5.010 1.00 10.00 H new ATOM 0 HH TYR A 38 13.086 8.873 3.594 1.00 10.00 H new ATOM 585 N ASP A 39 13.284 0.089 5.189 1.00 10.00 N ATOM 586 CA ASP A 39 13.534 -1.326 5.400 1.00 10.00 C ATOM 587 C ASP A 39 12.839 -2.158 4.334 1.00 10.00 C ATOM 588 O ASP A 39 11.648 -2.459 4.433 1.00 10.00 O ATOM 589 CB ASP A 39 13.072 -1.753 6.796 1.00 10.00 C ATOM 590 CG ASP A 39 14.217 -1.848 7.787 1.00 10.00 C ATOM 591 OD1 ASP A 39 14.908 -2.890 7.805 1.00 10.00 O ATOM 592 OD2 ASP A 39 14.424 -0.887 8.562 1.00 10.00 O ATOM 0 H ASP A 39 12.592 0.492 5.820 1.00 10.00 H new ATOM 0 HA ASP A 39 14.608 -1.497 5.325 1.00 10.00 H new ATOM 0 HB2 ASP A 39 12.336 -1.039 7.165 1.00 10.00 H new ATOM 0 HB3 ASP A 39 12.573 -2.720 6.729 1.00 10.00 H new ATOM 597 N ILE A 40 13.598 -2.523 3.311 1.00 10.00 N ATOM 598 CA ILE A 40 13.086 -3.317 2.201 1.00 10.00 C ATOM 599 C ILE A 40 12.507 -4.642 2.697 1.00 10.00 C ATOM 600 O ILE A 40 11.452 -5.083 2.236 1.00 10.00 O ATOM 601 CB ILE A 40 14.197 -3.598 1.167 1.00 10.00 C ATOM 602 CG1 ILE A 40 14.865 -2.287 0.735 1.00 10.00 C ATOM 603 CG2 ILE A 40 13.635 -4.335 -0.041 1.00 10.00 C ATOM 604 CD1 ILE A 40 16.140 -2.479 -0.062 1.00 10.00 C ATOM 0 H ILE A 40 14.585 -2.278 3.226 1.00 10.00 H new ATOM 0 HA ILE A 40 12.293 -2.740 1.725 1.00 10.00 H new ATOM 0 HB ILE A 40 14.949 -4.234 1.633 1.00 10.00 H new ATOM 0 HG12 ILE A 40 14.158 -1.711 0.138 1.00 10.00 H new ATOM 0 HG13 ILE A 40 15.089 -1.695 1.623 1.00 10.00 H new ATOM 0 HG21 ILE A 40 14.435 -4.523 -0.757 1.00 10.00 H new ATOM 0 HG22 ILE A 40 13.205 -5.284 0.279 1.00 10.00 H new ATOM 0 HG23 ILE A 40 12.862 -3.727 -0.511 1.00 10.00 H new ATOM 0 HD11 ILE A 40 16.552 -1.506 -0.330 1.00 10.00 H new ATOM 0 HD12 ILE A 40 16.866 -3.027 0.539 1.00 10.00 H new ATOM 0 HD13 ILE A 40 15.921 -3.042 -0.969 1.00 10.00 H new ATOM 616 N GLY A 41 13.186 -5.252 3.662 1.00 10.00 N ATOM 617 CA GLY A 41 12.741 -6.523 4.207 1.00 10.00 C ATOM 618 C GLY A 41 11.400 -6.424 4.911 1.00 10.00 C ATOM 619 O GLY A 41 10.668 -7.409 5.006 1.00 10.00 O ATOM 0 H GLY A 41 14.042 -4.887 4.079 1.00 10.00 H new ATOM 0 HA2 GLY A 41 12.670 -7.254 3.401 1.00 10.00 H new ATOM 0 HA3 GLY A 41 13.488 -6.894 4.909 1.00 10.00 H new ATOM 623 N ALA A 42 11.064 -5.233 5.393 1.00 10.00 N ATOM 624 CA ALA A 42 9.800 -5.023 6.086 1.00 10.00 C ATOM 625 C ALA A 42 8.711 -4.601 5.105 1.00 10.00 C ATOM 626 O ALA A 42 7.585 -5.097 5.163 1.00 10.00 O ATOM 627 CB ALA A 42 9.962 -3.980 7.184 1.00 10.00 C ATOM 0 H ALA A 42 11.648 -4.400 5.317 1.00 10.00 H new ATOM 0 HA ALA A 42 9.500 -5.965 6.545 1.00 10.00 H new ATOM 0 HB1 ALA A 42 9.008 -3.835 7.692 1.00 10.00 H new ATOM 0 HB2 ALA A 42 10.708 -4.321 7.902 1.00 10.00 H new ATOM 0 HB3 ALA A 42 10.286 -3.037 6.745 1.00 10.00 H new ATOM 633 N ALA A 43 9.066 -3.699 4.193 1.00 10.00 N ATOM 634 CA ALA A 43 8.128 -3.186 3.198 1.00 10.00 C ATOM 635 C ALA A 43 7.625 -4.287 2.268 1.00 10.00 C ATOM 636 O ALA A 43 6.449 -4.315 1.904 1.00 10.00 O ATOM 637 CB ALA A 43 8.784 -2.076 2.390 1.00 10.00 C ATOM 0 H ALA A 43 10.005 -3.306 4.123 1.00 10.00 H new ATOM 0 HA ALA A 43 7.264 -2.788 3.731 1.00 10.00 H new ATOM 0 HB1 ALA A 43 8.078 -1.699 1.650 1.00 10.00 H new ATOM 0 HB2 ALA A 43 9.078 -1.266 3.057 1.00 10.00 H new ATOM 0 HB3 ALA A 43 9.666 -2.467 1.883 1.00 10.00 H new ATOM 643 N LEU A 44 8.518 -5.196 1.890 1.00 10.00 N ATOM 644 CA LEU A 44 8.162 -6.302 1.004 1.00 10.00 C ATOM 645 C LEU A 44 7.150 -7.230 1.676 1.00 10.00 C ATOM 646 O LEU A 44 6.263 -7.780 1.026 1.00 10.00 O ATOM 647 CB LEU A 44 9.419 -7.087 0.615 1.00 10.00 C ATOM 648 CG LEU A 44 9.347 -7.819 -0.728 1.00 10.00 C ATOM 649 CD1 LEU A 44 9.356 -6.827 -1.879 1.00 10.00 C ATOM 650 CD2 LEU A 44 10.506 -8.798 -0.863 1.00 10.00 C ATOM 0 H LEU A 44 9.495 -5.190 2.183 1.00 10.00 H new ATOM 0 HA LEU A 44 7.705 -5.890 0.104 1.00 10.00 H new ATOM 0 HB2 LEU A 44 10.263 -6.398 0.589 1.00 10.00 H new ATOM 0 HB3 LEU A 44 9.627 -7.817 1.397 1.00 10.00 H new ATOM 0 HG LEU A 44 8.413 -8.379 -0.764 1.00 10.00 H new ATOM 0 HD11 LEU A 44 9.304 -7.366 -2.825 1.00 10.00 H new ATOM 0 HD12 LEU A 44 8.497 -6.162 -1.793 1.00 10.00 H new ATOM 0 HD13 LEU A 44 10.274 -6.240 -1.846 1.00 10.00 H new ATOM 0 HD21 LEU A 44 10.440 -9.310 -1.823 1.00 10.00 H new ATOM 0 HD22 LEU A 44 11.449 -8.255 -0.805 1.00 10.00 H new ATOM 0 HD23 LEU A 44 10.459 -9.531 -0.057 1.00 10.00 H new ATOM 662 N ASP A 45 7.281 -7.374 2.987 1.00 10.00 N ATOM 663 CA ASP A 45 6.392 -8.236 3.760 1.00 10.00 C ATOM 664 C ASP A 45 5.031 -7.573 3.971 1.00 10.00 C ATOM 665 O ASP A 45 4.018 -8.254 4.127 1.00 10.00 O ATOM 666 CB ASP A 45 7.031 -8.558 5.113 1.00 10.00 C ATOM 667 CG ASP A 45 6.148 -9.422 5.989 1.00 10.00 C ATOM 668 OD1 ASP A 45 6.027 -10.635 5.715 1.00 10.00 O ATOM 669 OD2 ASP A 45 5.587 -8.899 6.970 1.00 10.00 O ATOM 0 H ASP A 45 7.997 -6.904 3.541 1.00 10.00 H new ATOM 0 HA ASP A 45 6.238 -9.159 3.201 1.00 10.00 H new ATOM 0 HB2 ASP A 45 7.981 -9.067 4.949 1.00 10.00 H new ATOM 0 HB3 ASP A 45 7.254 -7.627 5.635 1.00 10.00 H new ATOM 674 N THR A 46 5.011 -6.245 3.940 1.00 10.00 N ATOM 675 CA THR A 46 3.782 -5.483 4.142 1.00 10.00 C ATOM 676 C THR A 46 2.719 -5.830 3.094 1.00 10.00 C ATOM 677 O THR A 46 1.522 -5.804 3.379 1.00 10.00 O ATOM 678 CB THR A 46 4.061 -3.966 4.105 1.00 10.00 C ATOM 679 OG1 THR A 46 5.221 -3.666 4.889 1.00 10.00 O ATOM 680 CG2 THR A 46 2.872 -3.179 4.638 1.00 10.00 C ATOM 0 H THR A 46 5.837 -5.670 3.776 1.00 10.00 H new ATOM 0 HA THR A 46 3.400 -5.756 5.126 1.00 10.00 H new ATOM 0 HB THR A 46 4.232 -3.677 3.068 1.00 10.00 H new ATOM 0 HG1 THR A 46 5.395 -2.702 4.861 1.00 10.00 H new ATOM 0 HG21 THR A 46 3.095 -2.113 4.601 1.00 10.00 H new ATOM 0 HG22 THR A 46 1.994 -3.387 4.027 1.00 10.00 H new ATOM 0 HG23 THR A 46 2.674 -3.472 5.669 1.00 10.00 H new ATOM 688 N ILE A 47 3.156 -6.176 1.891 1.00 10.00 N ATOM 689 CA ILE A 47 2.222 -6.517 0.824 1.00 10.00 C ATOM 690 C ILE A 47 2.240 -8.013 0.514 1.00 10.00 C ATOM 691 O ILE A 47 1.658 -8.448 -0.480 1.00 10.00 O ATOM 692 CB ILE A 47 2.510 -5.717 -0.463 1.00 10.00 C ATOM 693 CG1 ILE A 47 3.889 -6.077 -1.017 1.00 10.00 C ATOM 694 CG2 ILE A 47 2.408 -4.221 -0.191 1.00 10.00 C ATOM 695 CD1 ILE A 47 4.061 -5.709 -2.471 1.00 10.00 C ATOM 0 H ILE A 47 4.141 -6.228 1.630 1.00 10.00 H new ATOM 0 HA ILE A 47 1.229 -6.249 1.186 1.00 10.00 H new ATOM 0 HB ILE A 47 1.763 -5.979 -1.212 1.00 10.00 H new ATOM 0 HG12 ILE A 47 4.654 -5.570 -0.428 1.00 10.00 H new ATOM 0 HG13 ILE A 47 4.053 -7.148 -0.898 1.00 10.00 H new ATOM 0 HG21 ILE A 47 2.614 -3.670 -1.108 1.00 10.00 H new ATOM 0 HG22 ILE A 47 1.403 -3.982 0.158 1.00 10.00 H new ATOM 0 HG23 ILE A 47 3.134 -3.940 0.572 1.00 10.00 H new ATOM 0 HD11 ILE A 47 5.061 -5.991 -2.802 1.00 10.00 H new ATOM 0 HD12 ILE A 47 3.318 -6.236 -3.070 1.00 10.00 H new ATOM 0 HD13 ILE A 47 3.928 -4.634 -2.592 1.00 10.00 H new ATOM 707 N GLN A 48 2.925 -8.784 1.363 1.00 10.00 N ATOM 708 CA GLN A 48 3.032 -10.247 1.225 1.00 10.00 C ATOM 709 C GLN A 48 3.924 -10.671 0.053 1.00 10.00 C ATOM 710 O GLN A 48 4.779 -11.539 0.212 1.00 10.00 O ATOM 711 CB GLN A 48 1.643 -10.889 1.073 1.00 10.00 C ATOM 712 CG GLN A 48 1.394 -12.058 2.015 1.00 10.00 C ATOM 713 CD GLN A 48 2.101 -13.328 1.577 1.00 10.00 C ATOM 714 OE1 GLN A 48 1.576 -14.100 0.778 1.00 10.00 O ATOM 715 NE2 GLN A 48 3.291 -13.559 2.106 1.00 10.00 N ATOM 0 H GLN A 48 3.425 -8.413 2.171 1.00 10.00 H new ATOM 0 HA GLN A 48 3.501 -10.603 2.142 1.00 10.00 H new ATOM 0 HB2 GLN A 48 0.882 -10.128 1.246 1.00 10.00 H new ATOM 0 HB3 GLN A 48 1.523 -11.232 0.045 1.00 10.00 H new ATOM 0 HG2 GLN A 48 1.728 -11.789 3.017 1.00 10.00 H new ATOM 0 HG3 GLN A 48 0.322 -12.247 2.077 1.00 10.00 H new ATOM 0 HE21 GLN A 48 3.694 -12.894 2.766 1.00 10.00 H new ATOM 0 HE22 GLN A 48 3.806 -14.402 1.854 1.00 10.00 H new ATOM 724 N TYR A 49 3.718 -10.062 -1.112 1.00 10.00 N ATOM 725 CA TYR A 49 4.484 -10.382 -2.317 1.00 10.00 C ATOM 726 C TYR A 49 5.990 -10.286 -2.086 1.00 10.00 C ATOM 727 O TYR A 49 6.566 -9.198 -2.091 1.00 10.00 O ATOM 728 CB TYR A 49 4.086 -9.447 -3.462 1.00 10.00 C ATOM 729 CG TYR A 49 2.662 -9.623 -3.940 1.00 10.00 C ATOM 730 CD1 TYR A 49 2.312 -10.687 -4.763 1.00 10.00 C ATOM 731 CD2 TYR A 49 1.667 -8.723 -3.575 1.00 10.00 C ATOM 732 CE1 TYR A 49 1.013 -10.847 -5.207 1.00 10.00 C ATOM 733 CE2 TYR A 49 0.366 -8.879 -4.017 1.00 10.00 C ATOM 734 CZ TYR A 49 0.044 -9.940 -4.831 1.00 10.00 C ATOM 735 OH TYR A 49 -1.252 -10.094 -5.274 1.00 10.00 O ATOM 0 H TYR A 49 3.017 -9.334 -1.249 1.00 10.00 H new ATOM 0 HA TYR A 49 4.249 -11.414 -2.579 1.00 10.00 H new ATOM 0 HB2 TYR A 49 4.224 -8.415 -3.138 1.00 10.00 H new ATOM 0 HB3 TYR A 49 4.762 -9.611 -4.301 1.00 10.00 H new ATOM 0 HD1 TYR A 49 3.067 -11.400 -5.060 1.00 10.00 H new ATOM 0 HD2 TYR A 49 1.914 -7.888 -2.936 1.00 10.00 H new ATOM 0 HE1 TYR A 49 0.757 -11.679 -5.846 1.00 10.00 H new ATOM 0 HE2 TYR A 49 -0.395 -8.170 -3.724 1.00 10.00 H new ATOM 0 HH TYR A 49 -1.853 -9.553 -4.721 1.00 10.00 H new ATOM 745 N SER A 50 6.619 -11.432 -1.883 1.00 10.00 N ATOM 746 CA SER A 50 8.054 -11.484 -1.664 1.00 10.00 C ATOM 747 C SER A 50 8.746 -12.151 -2.847 1.00 10.00 C ATOM 748 O SER A 50 9.882 -11.820 -3.192 1.00 10.00 O ATOM 749 CB SER A 50 8.363 -12.244 -0.376 1.00 10.00 C ATOM 750 OG SER A 50 7.491 -11.841 0.666 1.00 10.00 O ATOM 0 H SER A 50 6.156 -12.341 -1.865 1.00 10.00 H new ATOM 0 HA SER A 50 8.430 -10.465 -1.569 1.00 10.00 H new ATOM 0 HB2 SER A 50 8.262 -13.316 -0.547 1.00 10.00 H new ATOM 0 HB3 SER A 50 9.397 -12.065 -0.081 1.00 10.00 H new ATOM 0 HG SER A 50 6.562 -11.939 0.371 1.00 10.00 H new ATOM 756 N LYS A 51 8.048 -13.090 -3.473 1.00 10.00 N ATOM 757 CA LYS A 51 8.583 -13.804 -4.623 1.00 10.00 C ATOM 758 C LYS A 51 7.735 -13.534 -5.860 1.00 10.00 C ATOM 759 O LYS A 51 8.236 -13.044 -6.873 1.00 10.00 O ATOM 760 CB LYS A 51 8.643 -15.311 -4.354 1.00 10.00 C ATOM 761 CG LYS A 51 9.750 -15.721 -3.394 1.00 10.00 C ATOM 762 CD LYS A 51 9.958 -17.228 -3.391 1.00 10.00 C ATOM 763 CE LYS A 51 10.687 -17.697 -4.641 1.00 10.00 C ATOM 764 NZ LYS A 51 10.876 -19.171 -4.645 1.00 10.00 N ATOM 0 H LYS A 51 7.107 -13.375 -3.202 1.00 10.00 H new ATOM 0 HA LYS A 51 9.596 -13.442 -4.799 1.00 10.00 H new ATOM 0 HB2 LYS A 51 7.685 -15.637 -3.949 1.00 10.00 H new ATOM 0 HB3 LYS A 51 8.783 -15.834 -5.300 1.00 10.00 H new ATOM 0 HG2 LYS A 51 10.679 -15.225 -3.676 1.00 10.00 H new ATOM 0 HG3 LYS A 51 9.502 -15.385 -2.387 1.00 10.00 H new ATOM 0 HD2 LYS A 51 10.528 -17.515 -2.508 1.00 10.00 H new ATOM 0 HD3 LYS A 51 8.992 -17.729 -3.323 1.00 10.00 H new ATOM 0 HE2 LYS A 51 10.123 -17.400 -5.525 1.00 10.00 H new ATOM 0 HE3 LYS A 51 11.658 -17.205 -4.703 1.00 10.00 H new ATOM 0 HZ1 LYS A 51 11.376 -19.455 -5.512 1.00 10.00 H new ATOM 0 HZ2 LYS A 51 11.436 -19.451 -3.815 1.00 10.00 H new ATOM 0 HZ3 LYS A 51 9.948 -19.640 -4.612 1.00 10.00 H new ATOM 778 N HIS A 52 6.449 -13.847 -5.770 1.00 10.00 N ATOM 779 CA HIS A 52 5.531 -13.644 -6.878 1.00 10.00 C ATOM 780 C HIS A 52 4.102 -13.617 -6.363 1.00 10.00 C ATOM 781 O HIS A 52 3.264 -12.915 -6.968 1.00 10.00 O ATOM 782 CB HIS A 52 5.700 -14.756 -7.912 1.00 10.00 C ATOM 783 CG HIS A 52 5.061 -14.456 -9.233 1.00 10.00 C ATOM 784 ND1 HIS A 52 5.262 -13.272 -9.914 1.00 10.00 N ATOM 785 CD2 HIS A 52 4.234 -15.196 -10.009 1.00 10.00 C ATOM 786 CE1 HIS A 52 4.584 -13.299 -11.044 1.00 10.00 C ATOM 787 NE2 HIS A 52 3.952 -14.453 -11.128 1.00 10.00 N ATOM 788 OXT HIS A 52 3.832 -14.292 -5.349 1.00 10.00 O ATOM 0 H HIS A 52 6.018 -14.245 -4.935 1.00 10.00 H new ATOM 0 HA HIS A 52 5.754 -12.690 -7.355 1.00 10.00 H new ATOM 0 HB2 HIS A 52 6.764 -14.937 -8.066 1.00 10.00 H new ATOM 0 HB3 HIS A 52 5.274 -15.677 -7.514 1.00 10.00 H new ATOM 0 HD2 HIS A 52 3.865 -16.187 -9.788 1.00 10.00 H new ATOM 0 HE1 HIS A 52 4.552 -12.508 -11.778 1.00 10.00 H new ATOM 0 HE2 HIS A 52 3.352 -14.746 -11.899 1.00 10.00 H new ATOM 798 N GLY B 1 -18.833 19.760 2.531 1.00 10.00 N ATOM 799 CA GLY B 1 -18.676 18.407 3.113 1.00 10.00 C ATOM 800 C GLY B 1 -19.189 17.332 2.183 1.00 10.00 C ATOM 801 O GLY B 1 -18.601 17.087 1.132 1.00 10.00 O ATOM 0 H1 GLY B 1 -18.470 20.470 3.199 1.00 10.00 H new ATOM 0 H2 GLY B 1 -18.300 19.819 1.640 1.00 10.00 H new ATOM 0 H3 GLY B 1 -19.840 19.943 2.345 1.00 10.00 H new ATOM 0 HA2 GLY B 1 -17.624 18.226 3.332 1.00 10.00 H new ATOM 0 HA3 GLY B 1 -19.213 18.354 4.060 1.00 10.00 H new ATOM 807 N SER B 2 -20.288 16.698 2.559 1.00 10.00 N ATOM 808 CA SER B 2 -20.873 15.644 1.746 1.00 10.00 C ATOM 809 C SER B 2 -22.153 16.145 1.075 1.00 10.00 C ATOM 810 O SER B 2 -23.203 16.237 1.718 1.00 10.00 O ATOM 811 CB SER B 2 -21.170 14.418 2.611 1.00 10.00 C ATOM 812 OG SER B 2 -20.178 14.253 3.614 1.00 10.00 O ATOM 0 H SER B 2 -20.793 16.895 3.423 1.00 10.00 H new ATOM 0 HA SER B 2 -20.162 15.360 0.970 1.00 10.00 H new ATOM 0 HB2 SER B 2 -22.150 14.525 3.077 1.00 10.00 H new ATOM 0 HB3 SER B 2 -21.211 13.527 1.984 1.00 10.00 H new ATOM 0 HG SER B 2 -20.389 13.464 4.156 1.00 10.00 H new ATOM 818 N PRO B 3 -22.078 16.505 -0.216 1.00 10.00 N ATOM 819 CA PRO B 3 -23.236 17.001 -0.965 1.00 10.00 C ATOM 820 C PRO B 3 -24.282 15.907 -1.189 1.00 10.00 C ATOM 821 O PRO B 3 -23.931 14.748 -1.415 1.00 10.00 O ATOM 822 CB PRO B 3 -22.643 17.450 -2.313 1.00 10.00 C ATOM 823 CG PRO B 3 -21.165 17.483 -2.109 1.00 10.00 C ATOM 824 CD PRO B 3 -20.869 16.463 -1.048 1.00 10.00 C ATOM 0 HA PRO B 3 -23.751 17.799 -0.430 1.00 10.00 H new ATOM 0 HB2 PRO B 3 -22.913 16.758 -3.110 1.00 10.00 H new ATOM 0 HB3 PRO B 3 -23.021 18.431 -2.601 1.00 10.00 H new ATOM 0 HG2 PRO B 3 -20.638 17.247 -3.034 1.00 10.00 H new ATOM 0 HG3 PRO B 3 -20.836 18.475 -1.799 1.00 10.00 H new ATOM 0 HD2 PRO B 3 -20.704 15.473 -1.473 1.00 10.00 H new ATOM 0 HD3 PRO B 3 -19.976 16.719 -0.478 1.00 10.00 H new ATOM 832 N PRO B 4 -25.580 16.261 -1.150 1.00 10.00 N ATOM 833 CA PRO B 4 -26.679 15.303 -1.353 1.00 10.00 C ATOM 834 C PRO B 4 -26.671 14.677 -2.749 1.00 10.00 C ATOM 835 O PRO B 4 -27.479 13.802 -3.053 1.00 10.00 O ATOM 836 CB PRO B 4 -27.946 16.145 -1.157 1.00 10.00 C ATOM 837 CG PRO B 4 -27.497 17.363 -0.427 1.00 10.00 C ATOM 838 CD PRO B 4 -26.089 17.618 -0.879 1.00 10.00 C ATOM 0 HA PRO B 4 -26.600 14.462 -0.665 1.00 10.00 H new ATOM 0 HB2 PRO B 4 -28.398 16.404 -2.114 1.00 10.00 H new ATOM 0 HB3 PRO B 4 -28.697 15.599 -0.587 1.00 10.00 H new ATOM 0 HG2 PRO B 4 -28.140 18.213 -0.654 1.00 10.00 H new ATOM 0 HG3 PRO B 4 -27.539 17.210 0.651 1.00 10.00 H new ATOM 0 HD2 PRO B 4 -26.058 18.247 -1.769 1.00 10.00 H new ATOM 0 HD3 PRO B 4 -25.503 18.123 -0.111 1.00 10.00 H new ATOM 846 N GLU B 5 -25.759 15.134 -3.598 1.00 10.00 N ATOM 847 CA GLU B 5 -25.638 14.607 -4.948 1.00 10.00 C ATOM 848 C GLU B 5 -24.715 13.391 -4.978 1.00 10.00 C ATOM 849 O GLU B 5 -24.603 12.714 -5.999 1.00 10.00 O ATOM 850 CB GLU B 5 -25.115 15.688 -5.899 1.00 10.00 C ATOM 851 CG GLU B 5 -26.194 16.633 -6.399 1.00 10.00 C ATOM 852 CD GLU B 5 -27.369 15.906 -7.019 1.00 10.00 C ATOM 853 OE1 GLU B 5 -27.152 15.043 -7.896 1.00 10.00 O ATOM 854 OE2 GLU B 5 -28.521 16.195 -6.633 1.00 10.00 O ATOM 0 H GLU B 5 -25.091 15.871 -3.373 1.00 10.00 H new ATOM 0 HA GLU B 5 -26.629 14.295 -5.279 1.00 10.00 H new ATOM 0 HB2 GLU B 5 -24.345 16.267 -5.389 1.00 10.00 H new ATOM 0 HB3 GLU B 5 -24.639 15.208 -6.754 1.00 10.00 H new ATOM 0 HG2 GLU B 5 -26.548 17.245 -5.569 1.00 10.00 H new ATOM 0 HG3 GLU B 5 -25.763 17.312 -7.135 1.00 10.00 H new ATOM 861 N ALA B 6 -24.052 13.119 -3.855 1.00 10.00 N ATOM 862 CA ALA B 6 -23.147 11.981 -3.754 1.00 10.00 C ATOM 863 C ALA B 6 -23.901 10.740 -3.297 1.00 10.00 C ATOM 864 O ALA B 6 -24.771 10.823 -2.429 1.00 10.00 O ATOM 865 CB ALA B 6 -22.007 12.296 -2.796 1.00 10.00 C ATOM 0 H ALA B 6 -24.127 13.674 -3.002 1.00 10.00 H new ATOM 0 HA ALA B 6 -22.726 11.783 -4.740 1.00 10.00 H new ATOM 0 HB1 ALA B 6 -21.339 11.437 -2.730 1.00 10.00 H new ATOM 0 HB2 ALA B 6 -21.452 13.160 -3.162 1.00 10.00 H new ATOM 0 HB3 ALA B 6 -22.412 12.517 -1.808 1.00 10.00 H new ATOM 871 N ASP B 7 -23.582 9.596 -3.896 1.00 10.00 N ATOM 872 CA ASP B 7 -24.232 8.338 -3.536 1.00 10.00 C ATOM 873 C ASP B 7 -23.851 7.938 -2.114 1.00 10.00 C ATOM 874 O ASP B 7 -22.666 7.822 -1.792 1.00 10.00 O ATOM 875 CB ASP B 7 -23.840 7.226 -4.514 1.00 10.00 C ATOM 876 CG ASP B 7 -24.760 6.019 -4.421 1.00 10.00 C ATOM 877 OD1 ASP B 7 -24.710 5.297 -3.404 1.00 10.00 O ATOM 878 OD2 ASP B 7 -25.531 5.782 -5.376 1.00 10.00 O ATOM 0 H ASP B 7 -22.879 9.513 -4.631 1.00 10.00 H new ATOM 0 HA ASP B 7 -25.311 8.482 -3.590 1.00 10.00 H new ATOM 0 HB2 ASP B 7 -23.861 7.617 -5.531 1.00 10.00 H new ATOM 0 HB3 ASP B 7 -22.815 6.914 -4.313 1.00 10.00 H new ATOM 883 N PRO B 8 -24.856 7.713 -1.253 1.00 10.00 N ATOM 884 CA PRO B 8 -24.638 7.342 0.149 1.00 10.00 C ATOM 885 C PRO B 8 -23.927 6.002 0.307 1.00 10.00 C ATOM 886 O PRO B 8 -23.355 5.717 1.355 1.00 10.00 O ATOM 887 CB PRO B 8 -26.053 7.267 0.733 1.00 10.00 C ATOM 888 CG PRO B 8 -26.952 7.087 -0.441 1.00 10.00 C ATOM 889 CD PRO B 8 -26.289 7.805 -1.580 1.00 10.00 C ATOM 0 HA PRO B 8 -23.992 8.062 0.652 1.00 10.00 H new ATOM 0 HB2 PRO B 8 -26.147 6.436 1.432 1.00 10.00 H new ATOM 0 HB3 PRO B 8 -26.301 8.175 1.283 1.00 10.00 H new ATOM 0 HG2 PRO B 8 -27.087 6.030 -0.671 1.00 10.00 H new ATOM 0 HG3 PRO B 8 -27.941 7.499 -0.242 1.00 10.00 H new ATOM 0 HD2 PRO B 8 -26.514 7.334 -2.537 1.00 10.00 H new ATOM 0 HD3 PRO B 8 -26.620 8.841 -1.649 1.00 10.00 H new ATOM 897 N ARG B 9 -23.956 5.180 -0.733 1.00 10.00 N ATOM 898 CA ARG B 9 -23.306 3.878 -0.680 1.00 10.00 C ATOM 899 C ARG B 9 -21.876 3.980 -1.189 1.00 10.00 C ATOM 900 O ARG B 9 -21.017 3.176 -0.830 1.00 10.00 O ATOM 901 CB ARG B 9 -24.085 2.860 -1.505 1.00 10.00 C ATOM 902 CG ARG B 9 -25.545 2.746 -1.097 1.00 10.00 C ATOM 903 CD ARG B 9 -26.387 2.152 -2.210 1.00 10.00 C ATOM 904 NE ARG B 9 -26.356 2.977 -3.420 1.00 10.00 N ATOM 905 CZ ARG B 9 -26.861 2.599 -4.592 1.00 10.00 C ATOM 906 NH1 ARG B 9 -27.402 1.396 -4.729 1.00 10.00 N ATOM 907 NH2 ARG B 9 -26.816 3.423 -5.629 1.00 10.00 N ATOM 0 H ARG B 9 -24.419 5.389 -1.617 1.00 10.00 H new ATOM 0 HA ARG B 9 -23.286 3.544 0.357 1.00 10.00 H new ATOM 0 HB2 ARG B 9 -24.030 3.137 -2.558 1.00 10.00 H new ATOM 0 HB3 ARG B 9 -23.610 1.884 -1.407 1.00 10.00 H new ATOM 0 HG2 ARG B 9 -25.627 2.125 -0.205 1.00 10.00 H new ATOM 0 HG3 ARG B 9 -25.929 3.732 -0.835 1.00 10.00 H new ATOM 0 HD2 ARG B 9 -26.025 1.151 -2.444 1.00 10.00 H new ATOM 0 HD3 ARG B 9 -27.417 2.047 -1.869 1.00 10.00 H new ATOM 0 HE ARG B 9 -25.921 3.898 -3.361 1.00 10.00 H new ATOM 0 HH11 ARG B 9 -27.432 0.757 -3.935 1.00 10.00 H new ATOM 0 HH12 ARG B 9 -27.788 1.110 -5.629 1.00 10.00 H new ATOM 0 HH21 ARG B 9 -26.394 4.346 -5.529 1.00 10.00 H new ATOM 0 HH22 ARG B 9 -27.203 3.134 -6.527 1.00 10.00 H new ATOM 921 N LEU B 10 -21.626 4.983 -2.019 1.00 10.00 N ATOM 922 CA LEU B 10 -20.301 5.199 -2.580 1.00 10.00 C ATOM 923 C LEU B 10 -19.359 5.737 -1.509 1.00 10.00 C ATOM 924 O LEU B 10 -18.187 5.371 -1.457 1.00 10.00 O ATOM 925 CB LEU B 10 -20.378 6.175 -3.755 1.00 10.00 C ATOM 926 CG LEU B 10 -19.062 6.414 -4.502 1.00 10.00 C ATOM 927 CD1 LEU B 10 -18.628 5.159 -5.238 1.00 10.00 C ATOM 928 CD2 LEU B 10 -19.206 7.574 -5.474 1.00 10.00 C ATOM 0 H LEU B 10 -22.326 5.661 -2.319 1.00 10.00 H new ATOM 0 HA LEU B 10 -19.913 4.247 -2.942 1.00 10.00 H new ATOM 0 HB2 LEU B 10 -21.116 5.803 -4.465 1.00 10.00 H new ATOM 0 HB3 LEU B 10 -20.745 7.133 -3.386 1.00 10.00 H new ATOM 0 HG LEU B 10 -18.294 6.666 -3.770 1.00 10.00 H new ATOM 0 HD11 LEU B 10 -17.691 5.350 -5.762 1.00 10.00 H new ATOM 0 HD12 LEU B 10 -18.485 4.349 -4.523 1.00 10.00 H new ATOM 0 HD13 LEU B 10 -19.396 4.876 -5.958 1.00 10.00 H new ATOM 0 HD21 LEU B 10 -18.262 7.730 -5.996 1.00 10.00 H new ATOM 0 HD22 LEU B 10 -19.988 7.347 -6.198 1.00 10.00 H new ATOM 0 HD23 LEU B 10 -19.471 8.478 -4.925 1.00 10.00 H new ATOM 940 N ILE B 11 -19.881 6.604 -0.649 1.00 10.00 N ATOM 941 CA ILE B 11 -19.083 7.180 0.425 1.00 10.00 C ATOM 942 C ILE B 11 -18.827 6.130 1.512 1.00 10.00 C ATOM 943 O ILE B 11 -17.835 6.192 2.235 1.00 10.00 O ATOM 944 CB ILE B 11 -19.765 8.431 1.032 1.00 10.00 C ATOM 945 CG1 ILE B 11 -18.822 9.139 2.011 1.00 10.00 C ATOM 946 CG2 ILE B 11 -21.074 8.061 1.720 1.00 10.00 C ATOM 947 CD1 ILE B 11 -19.347 10.468 2.512 1.00 10.00 C ATOM 0 H ILE B 11 -20.850 6.922 -0.675 1.00 10.00 H new ATOM 0 HA ILE B 11 -18.129 7.497 0.003 1.00 10.00 H new ATOM 0 HB ILE B 11 -19.995 9.118 0.217 1.00 10.00 H new ATOM 0 HG12 ILE B 11 -18.642 8.485 2.864 1.00 10.00 H new ATOM 0 HG13 ILE B 11 -17.860 9.299 1.523 1.00 10.00 H new ATOM 0 HG21 ILE B 11 -21.532 8.958 2.137 1.00 10.00 H new ATOM 0 HG22 ILE B 11 -21.752 7.611 0.994 1.00 10.00 H new ATOM 0 HG23 ILE B 11 -20.875 7.349 2.521 1.00 10.00 H new ATOM 0 HD11 ILE B 11 -18.625 10.908 3.200 1.00 10.00 H new ATOM 0 HD12 ILE B 11 -19.501 11.140 1.668 1.00 10.00 H new ATOM 0 HD13 ILE B 11 -20.294 10.313 3.030 1.00 10.00 H new ATOM 959 N GLU B 12 -19.711 5.139 1.585 1.00 10.00 N ATOM 960 CA GLU B 12 -19.588 4.077 2.573 1.00 10.00 C ATOM 961 C GLU B 12 -18.477 3.109 2.201 1.00 10.00 C ATOM 962 O GLU B 12 -18.051 2.302 3.024 1.00 10.00 O ATOM 963 CB GLU B 12 -20.911 3.328 2.730 1.00 10.00 C ATOM 964 CG GLU B 12 -21.929 4.077 3.574 1.00 10.00 C ATOM 965 CD GLU B 12 -21.441 4.344 4.984 1.00 10.00 C ATOM 966 OE1 GLU B 12 -20.641 5.287 5.180 1.00 10.00 O ATOM 967 OE2 GLU B 12 -21.862 3.623 5.910 1.00 10.00 O ATOM 0 H GLU B 12 -20.520 5.051 0.970 1.00 10.00 H new ATOM 0 HA GLU B 12 -19.333 4.539 3.527 1.00 10.00 H new ATOM 0 HB2 GLU B 12 -21.334 3.141 1.743 1.00 10.00 H new ATOM 0 HB3 GLU B 12 -20.719 2.356 3.183 1.00 10.00 H new ATOM 0 HG2 GLU B 12 -22.167 5.025 3.091 1.00 10.00 H new ATOM 0 HG3 GLU B 12 -22.853 3.500 3.617 1.00 10.00 H new ATOM 974 N SER B 13 -18.001 3.190 0.964 1.00 10.00 N ATOM 975 CA SER B 13 -16.924 2.325 0.513 1.00 10.00 C ATOM 976 C SER B 13 -15.655 2.613 1.313 1.00 10.00 C ATOM 977 O SER B 13 -14.813 1.738 1.512 1.00 10.00 O ATOM 978 CB SER B 13 -16.677 2.520 -0.982 1.00 10.00 C ATOM 979 OG SER B 13 -17.886 2.379 -1.710 1.00 10.00 O ATOM 0 H SER B 13 -18.344 3.844 0.260 1.00 10.00 H new ATOM 0 HA SER B 13 -17.210 1.286 0.678 1.00 10.00 H new ATOM 0 HB2 SER B 13 -16.252 3.508 -1.160 1.00 10.00 H new ATOM 0 HB3 SER B 13 -15.947 1.791 -1.334 1.00 10.00 H new ATOM 0 HG SER B 13 -18.303 3.258 -1.826 1.00 10.00 H new ATOM 985 N LEU B 14 -15.544 3.849 1.792 1.00 10.00 N ATOM 986 CA LEU B 14 -14.405 4.263 2.597 1.00 10.00 C ATOM 987 C LEU B 14 -14.630 3.835 4.042 1.00 10.00 C ATOM 988 O LEU B 14 -13.725 3.332 4.703 1.00 10.00 O ATOM 989 CB LEU B 14 -14.213 5.784 2.526 1.00 10.00 C ATOM 990 CG LEU B 14 -13.871 6.344 1.142 1.00 10.00 C ATOM 991 CD1 LEU B 14 -15.136 6.735 0.391 1.00 10.00 C ATOM 992 CD2 LEU B 14 -12.934 7.536 1.267 1.00 10.00 C ATOM 0 H LEU B 14 -16.235 4.583 1.634 1.00 10.00 H new ATOM 0 HA LEU B 14 -13.505 3.787 2.207 1.00 10.00 H new ATOM 0 HB2 LEU B 14 -15.126 6.264 2.877 1.00 10.00 H new ATOM 0 HB3 LEU B 14 -13.419 6.065 3.218 1.00 10.00 H new ATOM 0 HG LEU B 14 -13.364 5.564 0.573 1.00 10.00 H new ATOM 0 HD11 LEU B 14 -14.870 7.130 -0.589 1.00 10.00 H new ATOM 0 HD12 LEU B 14 -15.772 5.858 0.268 1.00 10.00 H new ATOM 0 HD13 LEU B 14 -15.673 7.497 0.956 1.00 10.00 H new ATOM 0 HD21 LEU B 14 -12.701 7.922 0.274 1.00 10.00 H new ATOM 0 HD22 LEU B 14 -13.415 8.317 1.856 1.00 10.00 H new ATOM 0 HD23 LEU B 14 -12.013 7.225 1.760 1.00 10.00 H new ATOM 1004 N SER B 15 -15.857 4.031 4.516 1.00 10.00 N ATOM 1005 CA SER B 15 -16.233 3.665 5.872 1.00 10.00 C ATOM 1006 C SER B 15 -16.070 2.163 6.091 1.00 10.00 C ATOM 1007 O SER B 15 -15.616 1.726 7.147 1.00 10.00 O ATOM 1008 CB SER B 15 -17.679 4.084 6.136 1.00 10.00 C ATOM 1009 OG SER B 15 -17.999 5.273 5.426 1.00 10.00 O ATOM 0 H SER B 15 -16.613 4.446 3.972 1.00 10.00 H new ATOM 0 HA SER B 15 -15.576 4.184 6.570 1.00 10.00 H new ATOM 0 HB2 SER B 15 -18.355 3.283 5.836 1.00 10.00 H new ATOM 0 HB3 SER B 15 -17.827 4.242 7.204 1.00 10.00 H new ATOM 0 HG SER B 15 -18.961 5.447 5.496 1.00 10.00 H new ATOM 1015 N GLN B 16 -16.436 1.381 5.075 1.00 10.00 N ATOM 1016 CA GLN B 16 -16.329 -0.074 5.135 1.00 10.00 C ATOM 1017 C GLN B 16 -14.883 -0.496 5.404 1.00 10.00 C ATOM 1018 O GLN B 16 -14.631 -1.467 6.123 1.00 10.00 O ATOM 1019 CB GLN B 16 -16.831 -0.685 3.819 1.00 10.00 C ATOM 1020 CG GLN B 16 -16.636 -2.192 3.715 1.00 10.00 C ATOM 1021 CD GLN B 16 -17.454 -2.969 4.726 1.00 10.00 C ATOM 1022 OE1 GLN B 16 -18.605 -3.324 4.475 1.00 10.00 O ATOM 1023 NE2 GLN B 16 -16.868 -3.238 5.880 1.00 10.00 N ATOM 0 H GLN B 16 -16.812 1.736 4.195 1.00 10.00 H new ATOM 0 HA GLN B 16 -16.947 -0.440 5.955 1.00 10.00 H new ATOM 0 HB2 GLN B 16 -17.891 -0.459 3.708 1.00 10.00 H new ATOM 0 HB3 GLN B 16 -16.314 -0.205 2.988 1.00 10.00 H new ATOM 0 HG2 GLN B 16 -16.906 -2.519 2.711 1.00 10.00 H new ATOM 0 HG3 GLN B 16 -15.581 -2.426 3.854 1.00 10.00 H new ATOM 0 HE21 GLN B 16 -15.912 -2.927 6.051 1.00 10.00 H new ATOM 0 HE22 GLN B 16 -17.372 -3.757 6.599 1.00 10.00 H new ATOM 1032 N MET B 17 -13.941 0.246 4.828 1.00 10.00 N ATOM 1033 CA MET B 17 -12.523 -0.037 5.018 1.00 10.00 C ATOM 1034 C MET B 17 -12.161 0.108 6.488 1.00 10.00 C ATOM 1035 O MET B 17 -11.458 -0.730 7.056 1.00 10.00 O ATOM 1036 CB MET B 17 -11.661 0.907 4.176 1.00 10.00 C ATOM 1037 CG MET B 17 -11.437 0.424 2.755 1.00 10.00 C ATOM 1038 SD MET B 17 -10.626 -1.186 2.689 1.00 10.00 S ATOM 1039 CE MET B 17 -10.363 -1.357 0.927 1.00 10.00 C ATOM 0 H MET B 17 -14.135 1.047 4.227 1.00 10.00 H new ATOM 0 HA MET B 17 -12.330 -1.060 4.695 1.00 10.00 H new ATOM 0 HB2 MET B 17 -12.135 1.888 4.146 1.00 10.00 H new ATOM 0 HB3 MET B 17 -10.695 1.034 4.664 1.00 10.00 H new ATOM 0 HG2 MET B 17 -12.396 0.365 2.240 1.00 10.00 H new ATOM 0 HG3 MET B 17 -10.831 1.154 2.218 1.00 10.00 H new ATOM 0 HE1 MET B 17 -9.868 -2.307 0.723 1.00 10.00 H new ATOM 0 HE2 MET B 17 -11.323 -1.330 0.412 1.00 10.00 H new ATOM 0 HE3 MET B 17 -9.737 -0.538 0.571 1.00 10.00 H new ATOM 1049 N LEU B 18 -12.676 1.167 7.104 1.00 10.00 N ATOM 1050 CA LEU B 18 -12.426 1.438 8.511 1.00 10.00 C ATOM 1051 C LEU B 18 -13.003 0.322 9.381 1.00 10.00 C ATOM 1052 O LEU B 18 -12.390 -0.094 10.367 1.00 10.00 O ATOM 1053 CB LEU B 18 -13.035 2.789 8.908 1.00 10.00 C ATOM 1054 CG LEU B 18 -12.744 3.246 10.339 1.00 10.00 C ATOM 1055 CD1 LEU B 18 -11.265 3.542 10.521 1.00 10.00 C ATOM 1056 CD2 LEU B 18 -13.582 4.469 10.687 1.00 10.00 C ATOM 0 H LEU B 18 -13.273 1.855 6.645 1.00 10.00 H new ATOM 0 HA LEU B 18 -11.348 1.479 8.670 1.00 10.00 H new ATOM 0 HB2 LEU B 18 -12.667 3.550 8.220 1.00 10.00 H new ATOM 0 HB3 LEU B 18 -14.115 2.734 8.775 1.00 10.00 H new ATOM 0 HG LEU B 18 -13.014 2.437 11.018 1.00 10.00 H new ATOM 0 HD11 LEU B 18 -11.082 3.865 11.546 1.00 10.00 H new ATOM 0 HD12 LEU B 18 -10.686 2.642 10.315 1.00 10.00 H new ATOM 0 HD13 LEU B 18 -10.965 4.332 9.832 1.00 10.00 H new ATOM 0 HD21 LEU B 18 -13.363 4.781 11.708 1.00 10.00 H new ATOM 0 HD22 LEU B 18 -13.343 5.281 10.000 1.00 10.00 H new ATOM 0 HD23 LEU B 18 -14.640 4.221 10.602 1.00 10.00 H new ATOM 1068 N SER B 19 -14.180 -0.169 9.001 1.00 10.00 N ATOM 1069 CA SER B 19 -14.842 -1.245 9.732 1.00 10.00 C ATOM 1070 C SER B 19 -14.063 -2.552 9.596 1.00 10.00 C ATOM 1071 O SER B 19 -14.178 -3.452 10.431 1.00 10.00 O ATOM 1072 CB SER B 19 -16.270 -1.429 9.216 1.00 10.00 C ATOM 1073 OG SER B 19 -16.870 -0.176 8.945 1.00 10.00 O ATOM 0 H SER B 19 -14.697 0.164 8.187 1.00 10.00 H new ATOM 0 HA SER B 19 -14.876 -0.973 10.787 1.00 10.00 H new ATOM 0 HB2 SER B 19 -16.259 -2.036 8.311 1.00 10.00 H new ATOM 0 HB3 SER B 19 -16.862 -1.969 9.955 1.00 10.00 H new ATOM 0 HG SER B 19 -17.782 -0.315 8.614 1.00 10.00 H new ATOM 1079 N MET B 20 -13.274 -2.650 8.531 1.00 10.00 N ATOM 1080 CA MET B 20 -12.461 -3.834 8.278 1.00 10.00 C ATOM 1081 C MET B 20 -11.143 -3.739 9.033 1.00 10.00 C ATOM 1082 O MET B 20 -10.362 -4.690 9.076 1.00 10.00 O ATOM 1083 CB MET B 20 -12.198 -3.997 6.776 1.00 10.00 C ATOM 1084 CG MET B 20 -13.396 -4.531 6.003 1.00 10.00 C ATOM 1085 SD MET B 20 -13.738 -6.261 6.373 1.00 10.00 S ATOM 1086 CE MET B 20 -12.522 -7.073 5.335 1.00 10.00 C ATOM 0 H MET B 20 -13.180 -1.919 7.826 1.00 10.00 H new ATOM 0 HA MET B 20 -13.008 -4.709 8.631 1.00 10.00 H new ATOM 0 HB2 MET B 20 -11.908 -3.032 6.359 1.00 10.00 H new ATOM 0 HB3 MET B 20 -11.354 -4.672 6.634 1.00 10.00 H new ATOM 0 HG2 MET B 20 -14.275 -3.931 6.240 1.00 10.00 H new ATOM 0 HG3 MET B 20 -13.214 -4.420 4.934 1.00 10.00 H new ATOM 0 HE1 MET B 20 -13.028 -7.736 4.633 1.00 10.00 H new ATOM 0 HE2 MET B 20 -11.956 -6.323 4.783 1.00 10.00 H new ATOM 0 HE3 MET B 20 -11.842 -7.655 5.958 1.00 10.00 H new ATOM 1096 N GLY B 21 -10.902 -2.580 9.627 1.00 10.00 N ATOM 1097 CA GLY B 21 -9.686 -2.374 10.381 1.00 10.00 C ATOM 1098 C GLY B 21 -8.602 -1.734 9.548 1.00 10.00 C ATOM 1099 O GLY B 21 -7.490 -1.513 10.027 1.00 10.00 O ATOM 0 H GLY B 21 -11.530 -1.777 9.599 1.00 10.00 H new ATOM 0 HA2 GLY B 21 -9.898 -1.744 11.245 1.00 10.00 H new ATOM 0 HA3 GLY B 21 -9.331 -3.331 10.764 1.00 10.00 H new ATOM 1103 N PHE B 22 -8.927 -1.433 8.299 1.00 10.00 N ATOM 1104 CA PHE B 22 -7.967 -0.816 7.405 1.00 10.00 C ATOM 1105 C PHE B 22 -7.837 0.663 7.729 1.00 10.00 C ATOM 1106 O PHE B 22 -8.821 1.402 7.742 1.00 10.00 O ATOM 1107 CB PHE B 22 -8.382 -1.003 5.943 1.00 10.00 C ATOM 1108 CG PHE B 22 -7.224 -1.175 4.997 1.00 10.00 C ATOM 1109 CD1 PHE B 22 -6.188 -0.257 4.961 1.00 10.00 C ATOM 1110 CD2 PHE B 22 -7.175 -2.267 4.147 1.00 10.00 C ATOM 1111 CE1 PHE B 22 -5.126 -0.421 4.093 1.00 10.00 C ATOM 1112 CE2 PHE B 22 -6.119 -2.439 3.277 1.00 10.00 C ATOM 1113 CZ PHE B 22 -5.090 -1.516 3.249 1.00 10.00 C ATOM 0 H PHE B 22 -9.844 -1.606 7.886 1.00 10.00 H new ATOM 0 HA PHE B 22 -7.001 -1.301 7.547 1.00 10.00 H new ATOM 0 HB2 PHE B 22 -9.032 -1.875 5.869 1.00 10.00 H new ATOM 0 HB3 PHE B 22 -8.970 -0.140 5.629 1.00 10.00 H new ATOM 0 HD1 PHE B 22 -6.211 0.598 5.620 1.00 10.00 H new ATOM 0 HD2 PHE B 22 -7.974 -2.993 4.166 1.00 10.00 H new ATOM 0 HE1 PHE B 22 -4.326 0.304 4.074 1.00 10.00 H new ATOM 0 HE2 PHE B 22 -6.096 -3.294 2.618 1.00 10.00 H new ATOM 0 HZ PHE B 22 -4.261 -1.650 2.570 1.00 10.00 H new ATOM 1123 N SER B 23 -6.618 1.076 8.012 1.00 10.00 N ATOM 1124 CA SER B 23 -6.327 2.454 8.334 1.00 10.00 C ATOM 1125 C SER B 23 -4.915 2.784 7.879 1.00 10.00 C ATOM 1126 O SER B 23 -4.020 1.941 7.966 1.00 10.00 O ATOM 1127 CB SER B 23 -6.487 2.686 9.837 1.00 10.00 C ATOM 1128 OG SER B 23 -6.284 1.482 10.561 1.00 10.00 O ATOM 0 H SER B 23 -5.802 0.464 8.025 1.00 10.00 H new ATOM 0 HA SER B 23 -7.027 3.111 7.817 1.00 10.00 H new ATOM 0 HB2 SER B 23 -5.774 3.440 10.170 1.00 10.00 H new ATOM 0 HB3 SER B 23 -7.483 3.076 10.045 1.00 10.00 H new ATOM 0 HG SER B 23 -6.390 1.655 11.520 1.00 10.00 H new ATOM 1134 N ASP B 24 -4.719 3.987 7.373 1.00 10.00 N ATOM 1135 CA ASP B 24 -3.413 4.400 6.894 1.00 10.00 C ATOM 1136 C ASP B 24 -2.743 5.364 7.860 1.00 10.00 C ATOM 1137 O ASP B 24 -3.402 6.067 8.628 1.00 10.00 O ATOM 1138 CB ASP B 24 -3.508 5.029 5.496 1.00 10.00 C ATOM 1139 CG ASP B 24 -4.594 6.089 5.365 1.00 10.00 C ATOM 1140 OD1 ASP B 24 -5.305 6.363 6.349 1.00 10.00 O ATOM 1141 OD2 ASP B 24 -4.745 6.636 4.253 1.00 10.00 O ATOM 0 H ASP B 24 -5.447 4.695 7.283 1.00 10.00 H new ATOM 0 HA ASP B 24 -2.797 3.503 6.829 1.00 10.00 H new ATOM 0 HB2 ASP B 24 -2.546 5.476 5.244 1.00 10.00 H new ATOM 0 HB3 ASP B 24 -3.694 4.241 4.766 1.00 10.00 H new ATOM 1146 N GLU B 25 -1.424 5.368 7.823 1.00 10.00 N ATOM 1147 CA GLU B 25 -0.614 6.229 8.667 1.00 10.00 C ATOM 1148 C GLU B 25 -0.079 7.390 7.847 1.00 10.00 C ATOM 1149 O GLU B 25 -0.102 8.538 8.279 1.00 10.00 O ATOM 1150 CB GLU B 25 0.550 5.441 9.297 1.00 10.00 C ATOM 1151 CG GLU B 25 0.693 4.006 8.790 1.00 10.00 C ATOM 1152 CD GLU B 25 1.228 3.922 7.371 1.00 10.00 C ATOM 1153 OE1 GLU B 25 0.496 4.293 6.431 1.00 10.00 O ATOM 1154 OE2 GLU B 25 2.374 3.470 7.193 1.00 10.00 O ATOM 0 H GLU B 25 -0.879 4.770 7.202 1.00 10.00 H new ATOM 0 HA GLU B 25 -1.238 6.614 9.474 1.00 10.00 H new ATOM 0 HB2 GLU B 25 1.480 5.975 9.104 1.00 10.00 H new ATOM 0 HB3 GLU B 25 0.414 5.419 10.378 1.00 10.00 H new ATOM 0 HG2 GLU B 25 1.360 3.457 9.455 1.00 10.00 H new ATOM 0 HG3 GLU B 25 -0.278 3.513 8.835 1.00 10.00 H new ATOM 1161 N GLY B 26 0.395 7.074 6.649 1.00 10.00 N ATOM 1162 CA GLY B 26 0.924 8.092 5.772 1.00 10.00 C ATOM 1163 C GLY B 26 -0.142 8.687 4.877 1.00 10.00 C ATOM 1164 O GLY B 26 0.143 9.558 4.060 1.00 10.00 O ATOM 0 H GLY B 26 0.421 6.127 6.271 1.00 10.00 H new ATOM 0 HA2 GLY B 26 1.378 8.883 6.369 1.00 10.00 H new ATOM 0 HA3 GLY B 26 1.715 7.664 5.156 1.00 10.00 H new ATOM 1168 N GLY B 27 -1.371 8.200 5.019 1.00 10.00 N ATOM 1169 CA GLY B 27 -2.479 8.702 4.223 1.00 10.00 C ATOM 1170 C GLY B 27 -2.480 8.171 2.806 1.00 10.00 C ATOM 1171 O GLY B 27 -2.796 8.902 1.865 1.00 10.00 O ATOM 0 H GLY B 27 -1.621 7.461 5.676 1.00 10.00 H new ATOM 0 HA2 GLY B 27 -3.418 8.432 4.707 1.00 10.00 H new ATOM 0 HA3 GLY B 27 -2.436 9.791 4.197 1.00 10.00 H new ATOM 1175 N TRP B 28 -2.128 6.900 2.643 1.00 10.00 N ATOM 1176 CA TRP B 28 -2.077 6.295 1.316 1.00 10.00 C ATOM 1177 C TRP B 28 -3.353 5.521 0.967 1.00 10.00 C ATOM 1178 O TRP B 28 -3.596 5.223 -0.203 1.00 10.00 O ATOM 1179 CB TRP B 28 -0.848 5.390 1.172 1.00 10.00 C ATOM 1180 CG TRP B 28 -0.788 4.251 2.142 1.00 10.00 C ATOM 1181 CD1 TRP B 28 -0.387 4.302 3.442 1.00 10.00 C ATOM 1182 CD2 TRP B 28 -1.115 2.883 1.876 1.00 10.00 C ATOM 1183 NE1 TRP B 28 -0.455 3.052 4.007 1.00 10.00 N ATOM 1184 CE2 TRP B 28 -0.900 2.160 3.063 1.00 10.00 C ATOM 1185 CE3 TRP B 28 -1.574 2.202 0.745 1.00 10.00 C ATOM 1186 CZ2 TRP B 28 -1.125 0.786 3.151 1.00 10.00 C ATOM 1187 CZ3 TRP B 28 -1.799 0.839 0.834 1.00 10.00 C ATOM 1188 CH2 TRP B 28 -1.576 0.146 2.029 1.00 10.00 C ATOM 0 H TRP B 28 -1.875 6.273 3.407 1.00 10.00 H new ATOM 0 HA TRP B 28 -1.997 7.118 0.606 1.00 10.00 H new ATOM 0 HB2 TRP B 28 -0.828 4.987 0.159 1.00 10.00 H new ATOM 0 HB3 TRP B 28 0.049 5.998 1.291 1.00 10.00 H new ATOM 0 HD1 TRP B 28 -0.063 5.196 3.955 1.00 10.00 H new ATOM 0 HE1 TRP B 28 -0.214 2.823 4.971 1.00 10.00 H new ATOM 0 HE3 TRP B 28 -1.750 2.729 -0.181 1.00 10.00 H new ATOM 0 HZ2 TRP B 28 -0.950 0.248 4.071 1.00 10.00 H new ATOM 0 HZ3 TRP B 28 -2.153 0.301 -0.033 1.00 10.00 H new ATOM 0 HH2 TRP B 28 -1.764 -0.917 2.066 1.00 10.00 H new ATOM 1199 N LEU B 29 -4.179 5.214 1.957 1.00 10.00 N ATOM 1200 CA LEU B 29 -5.415 4.470 1.706 1.00 10.00 C ATOM 1201 C LEU B 29 -6.409 5.347 0.961 1.00 10.00 C ATOM 1202 O LEU B 29 -7.040 4.913 -0.006 1.00 10.00 O ATOM 1203 CB LEU B 29 -6.027 3.965 3.017 1.00 10.00 C ATOM 1204 CG LEU B 29 -7.383 3.262 2.887 1.00 10.00 C ATOM 1205 CD1 LEU B 29 -7.260 1.961 2.107 1.00 10.00 C ATOM 1206 CD2 LEU B 29 -7.976 3.001 4.263 1.00 10.00 C ATOM 0 H LEU B 29 -4.023 5.463 2.934 1.00 10.00 H new ATOM 0 HA LEU B 29 -5.175 3.603 1.090 1.00 10.00 H new ATOM 0 HB2 LEU B 29 -5.324 3.275 3.484 1.00 10.00 H new ATOM 0 HB3 LEU B 29 -6.140 4.812 3.694 1.00 10.00 H new ATOM 0 HG LEU B 29 -8.051 3.921 2.333 1.00 10.00 H new ATOM 0 HD11 LEU B 29 -8.239 1.487 2.033 1.00 10.00 H new ATOM 0 HD12 LEU B 29 -6.882 2.171 1.107 1.00 10.00 H new ATOM 0 HD13 LEU B 29 -6.571 1.292 2.622 1.00 10.00 H new ATOM 0 HD21 LEU B 29 -8.939 2.501 4.155 1.00 10.00 H new ATOM 0 HD22 LEU B 29 -7.300 2.367 4.836 1.00 10.00 H new ATOM 0 HD23 LEU B 29 -8.115 3.948 4.785 1.00 10.00 H new ATOM 1218 N THR B 30 -6.520 6.597 1.395 1.00 10.00 N ATOM 1219 CA THR B 30 -7.421 7.553 0.764 1.00 10.00 C ATOM 1220 C THR B 30 -6.945 7.882 -0.652 1.00 10.00 C ATOM 1221 O THR B 30 -7.679 8.461 -1.449 1.00 10.00 O ATOM 1222 CB THR B 30 -7.537 8.853 1.599 1.00 10.00 C ATOM 1223 OG1 THR B 30 -8.562 9.707 1.071 1.00 10.00 O ATOM 1224 CG2 THR B 30 -6.213 9.605 1.634 1.00 10.00 C ATOM 0 H THR B 30 -5.995 6.973 2.185 1.00 10.00 H new ATOM 0 HA THR B 30 -8.408 7.093 0.711 1.00 10.00 H new ATOM 0 HB THR B 30 -7.802 8.565 2.617 1.00 10.00 H new ATOM 0 HG1 THR B 30 -8.692 9.512 0.120 1.00 10.00 H new ATOM 0 HG21 THR B 30 -6.326 10.513 2.227 1.00 10.00 H new ATOM 0 HG22 THR B 30 -5.447 8.972 2.081 1.00 10.00 H new ATOM 0 HG23 THR B 30 -5.918 9.869 0.619 1.00 10.00 H new ATOM 1232 N ARG B 31 -5.712 7.489 -0.954 1.00 10.00 N ATOM 1233 CA ARG B 31 -5.122 7.723 -2.262 1.00 10.00 C ATOM 1234 C ARG B 31 -5.342 6.511 -3.161 1.00 10.00 C ATOM 1235 O ARG B 31 -5.718 6.650 -4.324 1.00 10.00 O ATOM 1236 CB ARG B 31 -3.622 7.996 -2.126 1.00 10.00 C ATOM 1237 CG ARG B 31 -3.292 9.124 -1.163 1.00 10.00 C ATOM 1238 CD ARG B 31 -3.744 10.470 -1.703 1.00 10.00 C ATOM 1239 NE ARG B 31 -3.019 10.840 -2.915 1.00 10.00 N ATOM 1240 CZ ARG B 31 -1.935 11.610 -2.927 1.00 10.00 C ATOM 1241 NH1 ARG B 31 -1.465 12.121 -1.796 1.00 10.00 N ATOM 1242 NH2 ARG B 31 -1.328 11.871 -4.077 1.00 10.00 N ATOM 0 H ARG B 31 -5.098 7.002 -0.301 1.00 10.00 H new ATOM 0 HA ARG B 31 -5.603 8.593 -2.709 1.00 10.00 H new ATOM 0 HB2 ARG B 31 -3.125 7.086 -1.790 1.00 10.00 H new ATOM 0 HB3 ARG B 31 -3.215 8.237 -3.108 1.00 10.00 H new ATOM 0 HG2 ARG B 31 -3.773 8.936 -0.203 1.00 10.00 H new ATOM 0 HG3 ARG B 31 -2.217 9.146 -0.982 1.00 10.00 H new ATOM 0 HD2 ARG B 31 -4.813 10.436 -1.915 1.00 10.00 H new ATOM 0 HD3 ARG B 31 -3.594 11.236 -0.942 1.00 10.00 H new ATOM 0 HE ARG B 31 -3.365 10.486 -3.807 1.00 10.00 H new ATOM 0 HH11 ARG B 31 -1.936 11.924 -0.913 1.00 10.00 H new ATOM 0 HH12 ARG B 31 -0.633 12.711 -1.810 1.00 10.00 H new ATOM 0 HH21 ARG B 31 -1.693 11.482 -4.946 1.00 10.00 H new ATOM 0 HH22 ARG B 31 -0.496 12.461 -4.092 1.00 10.00 H new ATOM 1256 N LEU B 32 -5.122 5.329 -2.598 1.00 10.00 N ATOM 1257 CA LEU B 32 -5.282 4.074 -3.328 1.00 10.00 C ATOM 1258 C LEU B 32 -6.715 3.904 -3.825 1.00 10.00 C ATOM 1259 O LEU B 32 -6.949 3.378 -4.913 1.00 10.00 O ATOM 1260 CB LEU B 32 -4.895 2.896 -2.427 1.00 10.00 C ATOM 1261 CG LEU B 32 -4.585 1.590 -3.161 1.00 10.00 C ATOM 1262 CD1 LEU B 32 -3.241 1.687 -3.868 1.00 10.00 C ATOM 1263 CD2 LEU B 32 -4.594 0.418 -2.190 1.00 10.00 C ATOM 0 H LEU B 32 -4.829 5.212 -1.628 1.00 10.00 H new ATOM 0 HA LEU B 32 -4.624 4.098 -4.197 1.00 10.00 H new ATOM 0 HB2 LEU B 32 -4.022 3.180 -1.839 1.00 10.00 H new ATOM 0 HB3 LEU B 32 -5.708 2.715 -1.724 1.00 10.00 H new ATOM 0 HG LEU B 32 -5.359 1.421 -3.910 1.00 10.00 H new ATOM 0 HD11 LEU B 32 -3.034 0.751 -4.386 1.00 10.00 H new ATOM 0 HD12 LEU B 32 -3.268 2.503 -4.590 1.00 10.00 H new ATOM 0 HD13 LEU B 32 -2.457 1.877 -3.135 1.00 10.00 H new ATOM 0 HD21 LEU B 32 -4.372 -0.503 -2.729 1.00 10.00 H new ATOM 0 HD22 LEU B 32 -3.840 0.578 -1.419 1.00 10.00 H new ATOM 0 HD23 LEU B 32 -5.577 0.338 -1.725 1.00 10.00 H new ATOM 1275 N LEU B 33 -7.666 4.372 -3.025 1.00 10.00 N ATOM 1276 CA LEU B 33 -9.081 4.272 -3.368 1.00 10.00 C ATOM 1277 C LEU B 33 -9.441 5.172 -4.550 1.00 10.00 C ATOM 1278 O LEU B 33 -10.526 5.063 -5.117 1.00 10.00 O ATOM 1279 CB LEU B 33 -9.940 4.649 -2.160 1.00 10.00 C ATOM 1280 CG LEU B 33 -9.881 3.675 -0.982 1.00 10.00 C ATOM 1281 CD1 LEU B 33 -10.584 4.266 0.228 1.00 10.00 C ATOM 1282 CD2 LEU B 33 -10.505 2.341 -1.358 1.00 10.00 C ATOM 0 H LEU B 33 -7.482 4.826 -2.130 1.00 10.00 H new ATOM 0 HA LEU B 33 -9.278 3.239 -3.656 1.00 10.00 H new ATOM 0 HB2 LEU B 33 -9.632 5.634 -1.810 1.00 10.00 H new ATOM 0 HB3 LEU B 33 -10.977 4.736 -2.486 1.00 10.00 H new ATOM 0 HG LEU B 33 -8.835 3.505 -0.728 1.00 10.00 H new ATOM 0 HD11 LEU B 33 -10.534 3.561 1.058 1.00 10.00 H new ATOM 0 HD12 LEU B 33 -10.096 5.198 0.513 1.00 10.00 H new ATOM 0 HD13 LEU B 33 -11.627 4.463 -0.018 1.00 10.00 H new ATOM 0 HD21 LEU B 33 -10.453 1.662 -0.507 1.00 10.00 H new ATOM 0 HD22 LEU B 33 -11.547 2.493 -1.638 1.00 10.00 H new ATOM 0 HD23 LEU B 33 -9.963 1.910 -2.199 1.00 10.00 H new ATOM 1294 N GLN B 34 -8.540 6.072 -4.910 1.00 10.00 N ATOM 1295 CA GLN B 34 -8.779 6.981 -6.020 1.00 10.00 C ATOM 1296 C GLN B 34 -8.190 6.421 -7.310 1.00 10.00 C ATOM 1297 O GLN B 34 -8.826 6.465 -8.363 1.00 10.00 O ATOM 1298 CB GLN B 34 -8.182 8.360 -5.723 1.00 10.00 C ATOM 1299 CG GLN B 34 -8.652 8.961 -4.410 1.00 10.00 C ATOM 1300 CD GLN B 34 -10.162 9.077 -4.323 1.00 10.00 C ATOM 1301 OE1 GLN B 34 -10.845 9.298 -5.326 1.00 10.00 O ATOM 1302 NE2 GLN B 34 -10.691 8.931 -3.122 1.00 10.00 N ATOM 0 H GLN B 34 -7.637 6.193 -4.450 1.00 10.00 H new ATOM 0 HA GLN B 34 -9.856 7.086 -6.147 1.00 10.00 H new ATOM 0 HB2 GLN B 34 -7.095 8.279 -5.707 1.00 10.00 H new ATOM 0 HB3 GLN B 34 -8.439 9.040 -6.536 1.00 10.00 H new ATOM 0 HG2 GLN B 34 -8.291 8.347 -3.585 1.00 10.00 H new ATOM 0 HG3 GLN B 34 -8.209 9.949 -4.289 1.00 10.00 H new ATOM 0 HE21 GLN B 34 -10.090 8.749 -2.318 1.00 10.00 H new ATOM 0 HE22 GLN B 34 -11.701 9.000 -2.998 1.00 10.00 H new ATOM 1311 N THR B 35 -6.979 5.883 -7.218 1.00 10.00 N ATOM 1312 CA THR B 35 -6.290 5.334 -8.374 1.00 10.00 C ATOM 1313 C THR B 35 -6.799 3.942 -8.740 1.00 10.00 C ATOM 1314 O THR B 35 -7.044 3.654 -9.912 1.00 10.00 O ATOM 1315 CB THR B 35 -4.779 5.265 -8.117 1.00 10.00 C ATOM 1316 OG1 THR B 35 -4.533 5.299 -6.703 1.00 10.00 O ATOM 1317 CG2 THR B 35 -4.062 6.422 -8.794 1.00 10.00 C ATOM 0 H THR B 35 -6.453 5.816 -6.347 1.00 10.00 H new ATOM 0 HA THR B 35 -6.495 6.003 -9.210 1.00 10.00 H new ATOM 0 HB THR B 35 -4.395 4.334 -8.534 1.00 10.00 H new ATOM 0 HG1 THR B 35 -3.644 4.932 -6.517 1.00 10.00 H new ATOM 0 HG21 THR B 35 -2.992 6.352 -8.598 1.00 10.00 H new ATOM 0 HG22 THR B 35 -4.237 6.380 -9.869 1.00 10.00 H new ATOM 0 HG23 THR B 35 -4.442 7.365 -8.401 1.00 10.00 H new ATOM 1325 N LYS B 36 -6.969 3.088 -7.739 1.00 10.00 N ATOM 1326 CA LYS B 36 -7.435 1.725 -7.973 1.00 10.00 C ATOM 1327 C LYS B 36 -8.946 1.621 -7.789 1.00 10.00 C ATOM 1328 O LYS B 36 -9.508 0.522 -7.806 1.00 10.00 O ATOM 1329 CB LYS B 36 -6.712 0.748 -7.037 1.00 10.00 C ATOM 1330 CG LYS B 36 -6.693 -0.685 -7.547 1.00 10.00 C ATOM 1331 CD LYS B 36 -5.760 -1.564 -6.732 1.00 10.00 C ATOM 1332 CE LYS B 36 -5.770 -2.999 -7.236 1.00 10.00 C ATOM 1333 NZ LYS B 36 -5.463 -3.086 -8.691 1.00 10.00 N ATOM 0 H LYS B 36 -6.792 3.313 -6.760 1.00 10.00 H new ATOM 0 HA LYS B 36 -7.204 1.460 -9.005 1.00 10.00 H new ATOM 0 HB2 LYS B 36 -5.686 1.087 -6.894 1.00 10.00 H new ATOM 0 HB3 LYS B 36 -7.194 0.770 -6.060 1.00 10.00 H new ATOM 0 HG2 LYS B 36 -7.702 -1.096 -7.512 1.00 10.00 H new ATOM 0 HG3 LYS B 36 -6.381 -0.695 -8.591 1.00 10.00 H new ATOM 0 HD2 LYS B 36 -4.746 -1.166 -6.782 1.00 10.00 H new ATOM 0 HD3 LYS B 36 -6.060 -1.542 -5.684 1.00 10.00 H new ATOM 0 HE2 LYS B 36 -5.040 -3.584 -6.677 1.00 10.00 H new ATOM 0 HE3 LYS B 36 -6.747 -3.443 -7.045 1.00 10.00 H new ATOM 0 HZ1 LYS B 36 -5.264 -4.075 -8.945 1.00 10.00 H new ATOM 0 HZ2 LYS B 36 -6.279 -2.745 -9.239 1.00 10.00 H new ATOM 0 HZ3 LYS B 36 -4.632 -2.499 -8.906 1.00 10.00 H new ATOM 1347 N ASN B 37 -9.595 2.778 -7.628 1.00 10.00 N ATOM 1348 CA ASN B 37 -11.045 2.845 -7.440 1.00 10.00 C ATOM 1349 C ASN B 37 -11.443 2.292 -6.071 1.00 10.00 C ATOM 1350 O ASN B 37 -10.618 1.721 -5.354 1.00 10.00 O ATOM 1351 CB ASN B 37 -11.770 2.079 -8.562 1.00 10.00 C ATOM 1352 CG ASN B 37 -13.276 2.256 -8.533 1.00 10.00 C ATOM 1353 OD1 ASN B 37 -13.782 3.349 -8.288 1.00 10.00 O ATOM 1354 ND2 ASN B 37 -14.005 1.174 -8.765 1.00 10.00 N ATOM 0 H ASN B 37 -9.133 3.687 -7.624 1.00 10.00 H new ATOM 0 HA ASN B 37 -11.345 3.892 -7.484 1.00 10.00 H new ATOM 0 HB2 ASN B 37 -11.390 2.416 -9.527 1.00 10.00 H new ATOM 0 HB3 ASN B 37 -11.534 1.018 -8.479 1.00 10.00 H new ATOM 0 HD21 ASN B 37 -15.023 1.231 -8.744 1.00 10.00 H new ATOM 0 HD22 ASN B 37 -13.548 0.284 -8.965 1.00 10.00 H new ATOM 1361 N TYR B 38 -12.706 2.459 -5.710 1.00 10.00 N ATOM 1362 CA TYR B 38 -13.216 1.974 -4.435 1.00 10.00 C ATOM 1363 C TYR B 38 -13.541 0.482 -4.514 1.00 10.00 C ATOM 1364 O TYR B 38 -14.524 0.011 -3.939 1.00 10.00 O ATOM 1365 CB TYR B 38 -14.460 2.769 -4.030 1.00 10.00 C ATOM 1366 CG TYR B 38 -14.202 4.251 -3.872 1.00 10.00 C ATOM 1367 CD1 TYR B 38 -13.528 4.738 -2.761 1.00 10.00 C ATOM 1368 CD2 TYR B 38 -14.625 5.159 -4.834 1.00 10.00 C ATOM 1369 CE1 TYR B 38 -13.281 6.089 -2.612 1.00 10.00 C ATOM 1370 CE2 TYR B 38 -14.383 6.513 -4.692 1.00 10.00 C ATOM 1371 CZ TYR B 38 -13.712 6.971 -3.578 1.00 10.00 C ATOM 1372 OH TYR B 38 -13.464 8.316 -3.431 1.00 10.00 O ATOM 0 H TYR B 38 -13.402 2.931 -6.287 1.00 10.00 H new ATOM 0 HA TYR B 38 -12.445 2.115 -3.678 1.00 10.00 H new ATOM 0 HB2 TYR B 38 -15.237 2.621 -4.780 1.00 10.00 H new ATOM 0 HB3 TYR B 38 -14.845 2.373 -3.090 1.00 10.00 H new ATOM 0 HD1 TYR B 38 -13.191 4.049 -2.000 1.00 10.00 H new ATOM 0 HD2 TYR B 38 -15.151 4.802 -5.707 1.00 10.00 H new ATOM 0 HE1 TYR B 38 -12.753 6.452 -1.743 1.00 10.00 H new ATOM 0 HE2 TYR B 38 -14.717 7.207 -5.449 1.00 10.00 H new ATOM 0 HH TYR B 38 -13.832 8.802 -4.198 1.00 10.00 H new ATOM 1382 N ASP B 39 -12.698 -0.255 -5.223 1.00 10.00 N ATOM 1383 CA ASP B 39 -12.874 -1.689 -5.390 1.00 10.00 C ATOM 1384 C ASP B 39 -12.274 -2.426 -4.204 1.00 10.00 C ATOM 1385 O ASP B 39 -11.088 -2.761 -4.203 1.00 10.00 O ATOM 1386 CB ASP B 39 -12.220 -2.168 -6.689 1.00 10.00 C ATOM 1387 CG ASP B 39 -13.219 -2.407 -7.799 1.00 10.00 C ATOM 1388 OD1 ASP B 39 -13.932 -3.431 -7.753 1.00 10.00 O ATOM 1389 OD2 ASP B 39 -13.285 -1.576 -8.732 1.00 10.00 O ATOM 0 H ASP B 39 -11.877 0.123 -5.696 1.00 10.00 H new ATOM 0 HA ASP B 39 -13.942 -1.902 -5.443 1.00 10.00 H new ATOM 0 HB2 ASP B 39 -11.491 -1.427 -7.017 1.00 10.00 H new ATOM 0 HB3 ASP B 39 -11.672 -3.090 -6.495 1.00 10.00 H new ATOM 1394 N ILE B 40 -13.099 -2.655 -3.191 1.00 10.00 N ATOM 1395 CA ILE B 40 -12.674 -3.341 -1.972 1.00 10.00 C ATOM 1396 C ILE B 40 -12.017 -4.689 -2.277 1.00 10.00 C ATOM 1397 O ILE B 40 -10.937 -4.991 -1.766 1.00 10.00 O ATOM 1398 CB ILE B 40 -13.871 -3.570 -1.024 1.00 10.00 C ATOM 1399 CG1 ILE B 40 -14.608 -2.253 -0.757 1.00 10.00 C ATOM 1400 CG2 ILE B 40 -13.403 -4.195 0.284 1.00 10.00 C ATOM 1401 CD1 ILE B 40 -15.942 -2.435 -0.060 1.00 10.00 C ATOM 0 H ILE B 40 -14.079 -2.373 -3.188 1.00 10.00 H new ATOM 0 HA ILE B 40 -11.940 -2.696 -1.489 1.00 10.00 H new ATOM 0 HB ILE B 40 -14.564 -4.259 -1.507 1.00 10.00 H new ATOM 0 HG12 ILE B 40 -13.974 -1.609 -0.148 1.00 10.00 H new ATOM 0 HG13 ILE B 40 -14.770 -1.738 -1.704 1.00 10.00 H new ATOM 0 HG21 ILE B 40 -14.259 -4.349 0.940 1.00 10.00 H new ATOM 0 HG22 ILE B 40 -12.925 -5.153 0.079 1.00 10.00 H new ATOM 0 HG23 ILE B 40 -12.689 -3.530 0.770 1.00 10.00 H new ATOM 0 HD11 ILE B 40 -16.407 -1.461 0.096 1.00 10.00 H new ATOM 0 HD12 ILE B 40 -16.594 -3.053 -0.677 1.00 10.00 H new ATOM 0 HD13 ILE B 40 -15.786 -2.921 0.903 1.00 10.00 H new ATOM 1413 N GLY B 41 -12.666 -5.480 -3.123 1.00 10.00 N ATOM 1414 CA GLY B 41 -12.145 -6.789 -3.474 1.00 10.00 C ATOM 1415 C GLY B 41 -10.783 -6.715 -4.137 1.00 10.00 C ATOM 1416 O GLY B 41 -9.914 -7.553 -3.891 1.00 10.00 O ATOM 0 H GLY B 41 -13.548 -5.237 -3.574 1.00 10.00 H new ATOM 0 HA2 GLY B 41 -12.075 -7.401 -2.575 1.00 10.00 H new ATOM 0 HA3 GLY B 41 -12.845 -7.287 -4.145 1.00 10.00 H new ATOM 1420 N ALA B 42 -10.593 -5.700 -4.969 1.00 10.00 N ATOM 1421 CA ALA B 42 -9.333 -5.510 -5.670 1.00 10.00 C ATOM 1422 C ALA B 42 -8.236 -5.046 -4.715 1.00 10.00 C ATOM 1423 O ALA B 42 -7.088 -5.484 -4.808 1.00 10.00 O ATOM 1424 CB ALA B 42 -9.505 -4.511 -6.802 1.00 10.00 C ATOM 0 H ALA B 42 -11.299 -4.993 -5.175 1.00 10.00 H new ATOM 0 HA ALA B 42 -9.031 -6.470 -6.089 1.00 10.00 H new ATOM 0 HB1 ALA B 42 -8.554 -4.379 -7.318 1.00 10.00 H new ATOM 0 HB2 ALA B 42 -10.251 -4.883 -7.505 1.00 10.00 H new ATOM 0 HB3 ALA B 42 -9.834 -3.554 -6.396 1.00 10.00 H new ATOM 1430 N ALA B 43 -8.601 -4.162 -3.793 1.00 10.00 N ATOM 1431 CA ALA B 43 -7.655 -3.623 -2.821 1.00 10.00 C ATOM 1432 C ALA B 43 -7.132 -4.716 -1.894 1.00 10.00 C ATOM 1433 O ALA B 43 -5.945 -4.747 -1.562 1.00 10.00 O ATOM 1434 CB ALA B 43 -8.304 -2.506 -2.017 1.00 10.00 C ATOM 0 H ALA B 43 -9.550 -3.801 -3.698 1.00 10.00 H new ATOM 0 HA ALA B 43 -6.805 -3.214 -3.367 1.00 10.00 H new ATOM 0 HB1 ALA B 43 -7.587 -2.113 -1.296 1.00 10.00 H new ATOM 0 HB2 ALA B 43 -8.617 -1.708 -2.690 1.00 10.00 H new ATOM 0 HB3 ALA B 43 -9.174 -2.896 -1.488 1.00 10.00 H new ATOM 1440 N LEU B 44 -8.014 -5.623 -1.490 1.00 10.00 N ATOM 1441 CA LEU B 44 -7.638 -6.722 -0.604 1.00 10.00 C ATOM 1442 C LEU B 44 -6.634 -7.650 -1.286 1.00 10.00 C ATOM 1443 O LEU B 44 -5.745 -8.210 -0.640 1.00 10.00 O ATOM 1444 CB LEU B 44 -8.884 -7.513 -0.181 1.00 10.00 C ATOM 1445 CG LEU B 44 -9.397 -7.225 1.234 1.00 10.00 C ATOM 1446 CD1 LEU B 44 -9.890 -5.789 1.350 1.00 10.00 C ATOM 1447 CD2 LEU B 44 -10.506 -8.201 1.602 1.00 10.00 C ATOM 0 H LEU B 44 -8.997 -5.620 -1.762 1.00 10.00 H new ATOM 0 HA LEU B 44 -7.168 -6.299 0.284 1.00 10.00 H new ATOM 0 HB2 LEU B 44 -9.685 -7.302 -0.889 1.00 10.00 H new ATOM 0 HB3 LEU B 44 -8.662 -8.577 -0.259 1.00 10.00 H new ATOM 0 HG LEU B 44 -8.570 -7.356 1.932 1.00 10.00 H new ATOM 0 HD11 LEU B 44 -10.249 -5.608 2.363 1.00 10.00 H new ATOM 0 HD12 LEU B 44 -9.072 -5.104 1.128 1.00 10.00 H new ATOM 0 HD13 LEU B 44 -10.703 -5.625 0.642 1.00 10.00 H new ATOM 0 HD21 LEU B 44 -10.861 -7.985 2.610 1.00 10.00 H new ATOM 0 HD22 LEU B 44 -11.331 -8.098 0.897 1.00 10.00 H new ATOM 0 HD23 LEU B 44 -10.121 -9.220 1.564 1.00 10.00 H new ATOM 1459 N ASP B 45 -6.769 -7.788 -2.600 1.00 10.00 N ATOM 1460 CA ASP B 45 -5.886 -8.647 -3.384 1.00 10.00 C ATOM 1461 C ASP B 45 -4.540 -7.972 -3.636 1.00 10.00 C ATOM 1462 O ASP B 45 -3.537 -8.638 -3.901 1.00 10.00 O ATOM 1463 CB ASP B 45 -6.549 -8.995 -4.718 1.00 10.00 C ATOM 1464 CG ASP B 45 -5.722 -9.956 -5.549 1.00 10.00 C ATOM 1465 OD1 ASP B 45 -5.686 -11.157 -5.215 1.00 10.00 O ATOM 1466 OD2 ASP B 45 -5.127 -9.520 -6.559 1.00 10.00 O ATOM 0 H ASP B 45 -7.486 -7.313 -3.149 1.00 10.00 H new ATOM 0 HA ASP B 45 -5.708 -9.560 -2.815 1.00 10.00 H new ATOM 0 HB2 ASP B 45 -7.528 -9.435 -4.529 1.00 10.00 H new ATOM 0 HB3 ASP B 45 -6.715 -8.080 -5.286 1.00 10.00 H new ATOM 1471 N THR B 46 -4.519 -6.652 -3.520 1.00 10.00 N ATOM 1472 CA THR B 46 -3.302 -5.882 -3.751 1.00 10.00 C ATOM 1473 C THR B 46 -2.205 -6.261 -2.753 1.00 10.00 C ATOM 1474 O THR B 46 -1.019 -6.227 -3.080 1.00 10.00 O ATOM 1475 CB THR B 46 -3.583 -4.371 -3.654 1.00 10.00 C ATOM 1476 OG1 THR B 46 -4.747 -4.043 -4.427 1.00 10.00 O ATOM 1477 CG2 THR B 46 -2.400 -3.552 -4.156 1.00 10.00 C ATOM 0 H THR B 46 -5.332 -6.090 -3.267 1.00 10.00 H new ATOM 0 HA THR B 46 -2.956 -6.119 -4.757 1.00 10.00 H new ATOM 0 HB THR B 46 -3.750 -4.128 -2.604 1.00 10.00 H new ATOM 0 HG1 THR B 46 -5.375 -4.795 -4.408 1.00 10.00 H new ATOM 0 HG21 THR B 46 -2.632 -2.490 -4.074 1.00 10.00 H new ATOM 0 HG22 THR B 46 -1.519 -3.779 -3.555 1.00 10.00 H new ATOM 0 HG23 THR B 46 -2.202 -3.800 -5.199 1.00 10.00 H new ATOM 1485 N ILE B 47 -2.600 -6.630 -1.540 1.00 10.00 N ATOM 1486 CA ILE B 47 -1.631 -6.999 -0.516 1.00 10.00 C ATOM 1487 C ILE B 47 -1.756 -8.476 -0.135 1.00 10.00 C ATOM 1488 O ILE B 47 -1.066 -8.948 0.766 1.00 10.00 O ATOM 1489 CB ILE B 47 -1.770 -6.121 0.744 1.00 10.00 C ATOM 1490 CG1 ILE B 47 -3.174 -6.256 1.344 1.00 10.00 C ATOM 1491 CG2 ILE B 47 -1.471 -4.666 0.404 1.00 10.00 C ATOM 1492 CD1 ILE B 47 -3.360 -5.496 2.640 1.00 10.00 C ATOM 0 H ILE B 47 -3.575 -6.681 -1.244 1.00 10.00 H new ATOM 0 HA ILE B 47 -0.643 -6.831 -0.945 1.00 10.00 H new ATOM 0 HB ILE B 47 -1.049 -6.462 1.487 1.00 10.00 H new ATOM 0 HG12 ILE B 47 -3.905 -5.901 0.618 1.00 10.00 H new ATOM 0 HG13 ILE B 47 -3.384 -7.311 1.519 1.00 10.00 H new ATOM 0 HG21 ILE B 47 -1.572 -4.055 1.301 1.00 10.00 H new ATOM 0 HG22 ILE B 47 -0.454 -4.583 0.021 1.00 10.00 H new ATOM 0 HG23 ILE B 47 -2.173 -4.318 -0.354 1.00 10.00 H new ATOM 0 HD11 ILE B 47 -4.378 -5.640 3.003 1.00 10.00 H new ATOM 0 HD12 ILE B 47 -2.654 -5.866 3.383 1.00 10.00 H new ATOM 0 HD13 ILE B 47 -3.183 -4.434 2.468 1.00 10.00 H new ATOM 1504 N GLN B 48 -2.669 -9.183 -0.809 1.00 10.00 N ATOM 1505 CA GLN B 48 -2.903 -10.623 -0.589 1.00 10.00 C ATOM 1506 C GLN B 48 -3.531 -10.940 0.770 1.00 10.00 C ATOM 1507 O GLN B 48 -4.023 -12.050 0.983 1.00 10.00 O ATOM 1508 CB GLN B 48 -1.608 -11.424 -0.754 1.00 10.00 C ATOM 1509 CG GLN B 48 -1.261 -11.732 -2.198 1.00 10.00 C ATOM 1510 CD GLN B 48 -2.329 -12.559 -2.889 1.00 10.00 C ATOM 1511 OE1 GLN B 48 -2.984 -13.398 -2.269 1.00 10.00 O ATOM 1512 NE2 GLN B 48 -2.515 -12.326 -4.177 1.00 10.00 N ATOM 0 H GLN B 48 -3.271 -8.776 -1.525 1.00 10.00 H new ATOM 0 HA GLN B 48 -3.621 -10.921 -1.353 1.00 10.00 H new ATOM 0 HB2 GLN B 48 -0.787 -10.867 -0.303 1.00 10.00 H new ATOM 0 HB3 GLN B 48 -1.698 -12.360 -0.204 1.00 10.00 H new ATOM 0 HG2 GLN B 48 -1.121 -10.798 -2.742 1.00 10.00 H new ATOM 0 HG3 GLN B 48 -0.312 -12.267 -2.234 1.00 10.00 H new ATOM 0 HE21 GLN B 48 -1.952 -11.622 -4.655 1.00 10.00 H new ATOM 0 HE22 GLN B 48 -3.222 -12.850 -4.693 1.00 10.00 H new ATOM 1521 N TYR B 49 -3.526 -9.983 1.682 1.00 10.00 N ATOM 1522 CA TYR B 49 -4.091 -10.199 3.008 1.00 10.00 C ATOM 1523 C TYR B 49 -5.616 -10.117 2.972 1.00 10.00 C ATOM 1524 O TYR B 49 -6.214 -9.165 3.468 1.00 10.00 O ATOM 1525 CB TYR B 49 -3.517 -9.193 4.012 1.00 10.00 C ATOM 1526 CG TYR B 49 -2.036 -9.390 4.278 1.00 10.00 C ATOM 1527 CD1 TYR B 49 -1.570 -10.553 4.879 1.00 10.00 C ATOM 1528 CD2 TYR B 49 -1.106 -8.419 3.923 1.00 10.00 C ATOM 1529 CE1 TYR B 49 -0.224 -10.742 5.118 1.00 10.00 C ATOM 1530 CE2 TYR B 49 0.244 -8.606 4.155 1.00 10.00 C ATOM 1531 CZ TYR B 49 0.679 -9.766 4.754 1.00 10.00 C ATOM 1532 OH TYR B 49 2.022 -9.954 4.988 1.00 10.00 O ATOM 0 H TYR B 49 -3.139 -9.051 1.532 1.00 10.00 H new ATOM 0 HA TYR B 49 -3.815 -11.202 3.333 1.00 10.00 H new ATOM 0 HB2 TYR B 49 -3.681 -8.183 3.637 1.00 10.00 H new ATOM 0 HB3 TYR B 49 -4.062 -9.277 4.952 1.00 10.00 H new ATOM 0 HD1 TYR B 49 -2.273 -11.322 5.164 1.00 10.00 H new ATOM 0 HD2 TYR B 49 -1.444 -7.504 3.459 1.00 10.00 H new ATOM 0 HE1 TYR B 49 0.121 -11.651 5.588 1.00 10.00 H new ATOM 0 HE2 TYR B 49 0.954 -7.845 3.867 1.00 10.00 H new ATOM 0 HH TYR B 49 2.530 -9.220 4.584 1.00 10.00 H new ATOM 1542 N SER B 50 -6.233 -11.114 2.354 1.00 10.00 N ATOM 1543 CA SER B 50 -7.682 -11.172 2.254 1.00 10.00 C ATOM 1544 C SER B 50 -8.238 -12.276 3.153 1.00 10.00 C ATOM 1545 O SER B 50 -9.423 -12.281 3.494 1.00 10.00 O ATOM 1546 CB SER B 50 -8.091 -11.424 0.801 1.00 10.00 C ATOM 1547 OG SER B 50 -7.271 -10.686 -0.092 1.00 10.00 O ATOM 0 H SER B 50 -5.749 -11.896 1.913 1.00 10.00 H new ATOM 0 HA SER B 50 -8.094 -10.218 2.583 1.00 10.00 H new ATOM 0 HB2 SER B 50 -8.014 -12.488 0.577 1.00 10.00 H new ATOM 0 HB3 SER B 50 -9.135 -11.143 0.659 1.00 10.00 H new ATOM 0 HG SER B 50 -7.000 -9.845 0.332 1.00 10.00 H new ATOM 1553 N LYS B 51 -7.368 -13.202 3.543 1.00 10.00 N ATOM 1554 CA LYS B 51 -7.763 -14.319 4.389 1.00 10.00 C ATOM 1555 C LYS B 51 -7.500 -14.013 5.857 1.00 10.00 C ATOM 1556 O LYS B 51 -8.383 -14.170 6.699 1.00 10.00 O ATOM 1557 CB LYS B 51 -7.011 -15.589 3.979 1.00 10.00 C ATOM 1558 CG LYS B 51 -7.437 -16.147 2.629 1.00 10.00 C ATOM 1559 CD LYS B 51 -8.203 -17.452 2.775 1.00 10.00 C ATOM 1560 CE LYS B 51 -9.558 -17.238 3.429 1.00 10.00 C ATOM 1561 NZ LYS B 51 -10.220 -18.523 3.757 1.00 10.00 N ATOM 0 H LYS B 51 -6.381 -13.199 3.285 1.00 10.00 H new ATOM 0 HA LYS B 51 -8.833 -14.478 4.257 1.00 10.00 H new ATOM 0 HB2 LYS B 51 -5.943 -15.375 3.952 1.00 10.00 H new ATOM 0 HB3 LYS B 51 -7.164 -16.353 4.742 1.00 10.00 H new ATOM 0 HG2 LYS B 51 -8.059 -15.416 2.113 1.00 10.00 H new ATOM 0 HG3 LYS B 51 -6.556 -16.310 2.008 1.00 10.00 H new ATOM 0 HD2 LYS B 51 -8.340 -17.905 1.793 1.00 10.00 H new ATOM 0 HD3 LYS B 51 -7.618 -18.153 3.371 1.00 10.00 H new ATOM 0 HE2 LYS B 51 -9.434 -16.651 4.339 1.00 10.00 H new ATOM 0 HE3 LYS B 51 -10.197 -16.660 2.761 1.00 10.00 H new ATOM 0 HZ1 LYS B 51 -11.141 -18.335 4.201 1.00 10.00 H new ATOM 0 HZ2 LYS B 51 -10.361 -19.073 2.886 1.00 10.00 H new ATOM 0 HZ3 LYS B 51 -9.622 -19.064 4.414 1.00 10.00 H new ATOM 1575 N HIS B 52 -6.293 -13.566 6.157 1.00 10.00 N ATOM 1576 CA HIS B 52 -5.917 -13.248 7.519 1.00 10.00 C ATOM 1577 C HIS B 52 -4.767 -12.264 7.505 1.00 10.00 C ATOM 1578 O HIS B 52 -4.539 -11.590 8.529 1.00 10.00 O ATOM 1579 CB HIS B 52 -5.513 -14.517 8.278 1.00 10.00 C ATOM 1580 CG HIS B 52 -5.515 -14.347 9.765 1.00 10.00 C ATOM 1581 ND1 HIS B 52 -4.378 -14.445 10.538 1.00 10.00 N ATOM 1582 CD2 HIS B 52 -6.525 -14.086 10.624 1.00 10.00 C ATOM 1583 CE1 HIS B 52 -4.693 -14.254 11.804 1.00 10.00 C ATOM 1584 NE2 HIS B 52 -5.988 -14.032 11.884 1.00 10.00 N ATOM 1585 OXT HIS B 52 -4.091 -12.171 6.465 1.00 10.00 O ATOM 0 H HIS B 52 -5.554 -13.415 5.470 1.00 10.00 H new ATOM 0 HA HIS B 52 -6.772 -12.803 8.028 1.00 10.00 H new ATOM 0 HB2 HIS B 52 -6.196 -15.324 8.011 1.00 10.00 H new ATOM 0 HB3 HIS B 52 -4.517 -14.822 7.956 1.00 10.00 H new ATOM 0 HD2 HIS B 52 -7.564 -13.946 10.365 1.00 10.00 H new ATOM 0 HE1 HIS B 52 -4.004 -14.276 12.636 1.00 10.00 H new ATOM 0 HE2 HIS B 52 -6.507 -13.850 12.743 1.00 10.00 H new