USER MOD reduce.3.24.130724 H: found=0, std=0, add=1520, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1523 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 LYS NZ :NH3+ -174:sc= 0.935 (180deg=-0.0714) USER MOD Set 1.2: B 38 GLN :FLIP amide:sc= -1.27 F(o=-8.7!,f=-0.33) USER MOD Set 2.1: A 86 ASN : amide:sc= -1.45 K(o=-0.83,f=-4.6!) USER MOD Set 2.2: B 26 TYR OH : rot -58:sc= 0.619 USER MOD Set 3.1: A 82 THR OG1 : rot -170:sc= -0.107 USER MOD Set 3.2: B 8 MET CE :methyl 153:sc= -0.0111 (180deg=-0.912) USER MOD Set 4.1: A 34 LYS NZ :NH3+ -172:sc= 0.902 (180deg=-0.119) USER MOD Set 4.2: A 38 GLN :FLIP amide:sc= -1.36 F(o=-8.7!,f=-0.45) USER MOD Set 5.1: A 26 TYR OH : rot -60:sc= 0.24 USER MOD Set 5.2: B 86 ASN : amide:sc= -2.05 K(o=-1.8,f=-5!) USER MOD Set 6.1: A 8 MET CE :methyl 160:sc= 0 (180deg=-0.796) USER MOD Set 6.2: B 82 THR OG1 : rot 180:sc= -0.0572 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot -140:sc= -0.249 USER MOD Single : A 6 THR OG1 : rot 88:sc= 0.979 USER MOD Single : A 10 THR OG1 : rot -66:sc= -0.583! USER MOD Single : A 13 ASN : amide:sc= -0.0183 K(o=-0.018,f=-2.2!) USER MOD Single : A 16 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 18 HIS : no HD1:sc= -0.778 K(o=-0.78,f=-2.9) USER MOD Single : A 19 SER OG : rot 146:sc= 1.39 USER MOD Single : A 21 LYS NZ :NH3+ 164:sc= -0.0301 (180deg=-0.389) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ -150:sc= -0.0213 (180deg=-0.871) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 THR OG1 : rot 106:sc= 1.13 USER MOD Single : A 42 SER OG : rot 180:sc= 0.0449 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 48 GLN : amide:sc= -0.464 X(o=-0.46,f=-0.0011) USER MOD Single : A 49 LYS NZ :NH3+ 153:sc= -0.161 (180deg=-0.673) USER MOD Single : A 56 LYS NZ :NH3+ 157:sc= -0.131 (180deg=-0.827) USER MOD Single : A 58 MET CE :methyl -170:sc= -0.044 (180deg=-0.182) USER MOD Single : A 59 LYS NZ :NH3+ -151:sc= -0.118 (180deg=-0.712) USER MOD Single : A 64 ASN : amide:sc= -0.157 X(o=-0.16,f=0) USER MOD Single : A 72 GLN : amide:sc= -3.97! C(o=-4!,f=-5.6!) USER MOD Single : A 85 CYS SG : rot 180:sc= 0 USER MOD Single : A 87 ASN : amide:sc= 0 X(o=0,f=-0.097) USER MOD Single : B 2 SER OG : rot -140:sc= -0.181 USER MOD Single : B 6 THR OG1 : rot 88:sc= 1.17 USER MOD Single : B 10 THR OG1 : rot -62:sc= -0.543! USER MOD Single : B 13 ASN : amide:sc= -0.0515 K(o=-0.052,f=-2.1!) USER MOD Single : B 16 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 18 HIS : no HD1:sc= -0.878 K(o=-0.88,f=-2.9) USER MOD Single : B 19 SER OG : rot 147:sc= 1.38 USER MOD Single : B 21 LYS NZ :NH3+ 166:sc= -0.0366 (180deg=-0.383) USER MOD Single : B 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 29 SER OG : rot 180:sc= 0 USER MOD Single : B 30 LYS NZ :NH3+ -149:sc= -0.0946 (180deg=-0.887) USER MOD Single : B 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 39 THR OG1 : rot 106:sc= 1.15 USER MOD Single : B 42 SER OG : rot 180:sc= 0.0757 USER MOD Single : B 43 SER OG : rot 180:sc= 0 USER MOD Single : B 48 GLN : amide:sc= -0.498 X(o=-0.5,f=-0.0049) USER MOD Single : B 49 LYS NZ :NH3+ 155:sc= -0.203 (180deg=-0.713) USER MOD Single : B 56 LYS NZ :NH3+ 160:sc= -0.106 (180deg=-0.727) USER MOD Single : B 58 MET CE :methyl -172:sc= -0.0492 (180deg=-0.174) USER MOD Single : B 59 LYS NZ :NH3+ -149:sc= -0.0858 (180deg=-0.751) USER MOD Single : B 64 ASN : amide:sc= -0.129 X(o=-0.13,f=-1.5e-05) USER MOD Single : B 72 GLN : amide:sc= -3.87! C(o=-3.9!,f=-5.6!) USER MOD Single : B 85 CYS SG : rot 180:sc= 0 USER MOD Single : B 87 ASN : amide:sc= 0 X(o=0,f=-0.085) USER MOD Single : X 8 ASN : amide:sc= -3.3! C(o=-3.3!,f=-5.4!) USER MOD Single : X 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : X 12 SER OG : rot -66:sc= 0.895 USER MOD Single : Y 8 ASN : amide:sc= -5.58! C(o=-5.6!,f=-6.7!) USER MOD Single : Y 9 LYS NZ :NH3+ 166:sc= -0.01 (180deg=-0.31) USER MOD Single : Y 12 SER OG : rot 37:sc= 1.11 USER MOD ----------------------------------------------------------------- ATOM 77 N ILE X 5 72.175 16.856 15.180 1.00 0.00 N ATOM 78 CA ILE X 5 71.816 15.628 14.392 1.00 0.00 C ATOM 79 C ILE X 5 72.589 15.649 13.058 1.00 0.00 C ATOM 80 O ILE X 5 72.337 16.457 12.188 1.00 0.00 O ATOM 81 CB ILE X 5 70.274 15.586 14.169 1.00 0.00 C ATOM 82 CG1 ILE X 5 69.917 14.952 12.815 1.00 0.00 C ATOM 83 CG2 ILE X 5 69.701 17.001 14.225 1.00 0.00 C ATOM 84 CD1 ILE X 5 68.415 14.663 12.769 1.00 0.00 C ATOM 0 HA ILE X 5 72.096 14.725 14.935 1.00 0.00 H new ATOM 0 HB ILE X 5 69.842 14.975 14.962 1.00 0.00 H new ATOM 0 HG12 ILE X 5 70.194 15.623 12.002 1.00 0.00 H new ATOM 0 HG13 ILE X 5 70.480 14.030 12.673 1.00 0.00 H new ATOM 0 HG21 ILE X 5 68.623 16.963 14.068 1.00 0.00 H new ATOM 0 HG22 ILE X 5 69.911 17.440 15.200 1.00 0.00 H new ATOM 0 HG23 ILE X 5 70.160 17.610 13.446 1.00 0.00 H new ATOM 0 HD11 ILE X 5 68.160 14.213 11.809 1.00 0.00 H new ATOM 0 HD12 ILE X 5 68.152 13.976 13.573 1.00 0.00 H new ATOM 0 HD13 ILE X 5 67.861 15.594 12.892 1.00 0.00 H new ATOM 96 N ASP X 6 73.530 14.747 12.905 1.00 0.00 N ATOM 97 CA ASP X 6 74.338 14.662 11.643 1.00 0.00 C ATOM 98 C ASP X 6 74.319 13.206 11.178 1.00 0.00 C ATOM 99 O ASP X 6 75.158 12.749 10.423 1.00 0.00 O ATOM 100 CB ASP X 6 75.782 15.091 11.925 1.00 0.00 C ATOM 101 CG ASP X 6 76.415 14.132 12.935 1.00 0.00 C ATOM 102 OD1 ASP X 6 75.675 13.513 13.682 1.00 0.00 O ATOM 103 OD2 ASP X 6 77.631 14.035 12.947 1.00 0.00 O ATOM 0 H ASP X 6 73.777 14.055 13.612 1.00 0.00 H new ATOM 0 HA ASP X 6 73.922 15.317 10.877 1.00 0.00 H new ATOM 0 HB2 ASP X 6 76.358 15.093 11.000 1.00 0.00 H new ATOM 0 HB3 ASP X 6 75.800 16.109 12.314 1.00 0.00 H new ATOM 108 N TRP X 7 73.363 12.480 11.662 1.00 0.00 N ATOM 109 CA TRP X 7 73.234 11.041 11.327 1.00 0.00 C ATOM 110 C TRP X 7 73.055 10.835 9.812 1.00 0.00 C ATOM 111 O TRP X 7 73.730 10.030 9.206 1.00 0.00 O ATOM 112 CB TRP X 7 72.015 10.530 12.087 1.00 0.00 C ATOM 113 CG TRP X 7 71.778 9.089 11.817 1.00 0.00 C ATOM 114 CD1 TRP X 7 72.582 8.073 12.202 1.00 0.00 C ATOM 115 CD2 TRP X 7 70.651 8.490 11.134 1.00 0.00 C ATOM 116 NE1 TRP X 7 72.015 6.882 11.791 1.00 0.00 N ATOM 117 CE2 TRP X 7 70.822 7.090 11.128 1.00 0.00 C ATOM 118 CE3 TRP X 7 69.505 9.025 10.523 1.00 0.00 C ATOM 119 CZ2 TRP X 7 69.888 6.250 10.537 1.00 0.00 C ATOM 120 CZ3 TRP X 7 68.564 8.179 9.927 1.00 0.00 C ATOM 121 CH2 TRP X 7 68.756 6.795 9.935 1.00 0.00 C ATOM 0 H TRP X 7 72.644 12.832 12.294 1.00 0.00 H new ATOM 0 HA TRP X 7 74.135 10.496 11.609 1.00 0.00 H new ATOM 0 HB2 TRP X 7 72.160 10.683 13.156 1.00 0.00 H new ATOM 0 HB3 TRP X 7 71.136 11.106 11.799 1.00 0.00 H new ATOM 0 HD1 TRP X 7 73.512 8.175 12.741 1.00 0.00 H new ATOM 0 HE1 TRP X 7 72.427 5.964 11.957 1.00 0.00 H new ATOM 0 HE3 TRP X 7 69.350 10.094 10.513 1.00 0.00 H new ATOM 0 HZ2 TRP X 7 70.038 5.180 10.544 1.00 0.00 H new ATOM 0 HZ3 TRP X 7 67.685 8.597 9.459 1.00 0.00 H new ATOM 0 HH2 TRP X 7 68.026 6.147 9.474 1.00 0.00 H new ATOM 132 N ASN X 8 72.169 11.545 9.174 1.00 0.00 N ATOM 133 CA ASN X 8 72.000 11.330 7.703 1.00 0.00 C ATOM 134 C ASN X 8 73.378 11.386 7.027 1.00 0.00 C ATOM 135 O ASN X 8 73.637 10.706 6.047 1.00 0.00 O ATOM 136 CB ASN X 8 71.090 12.415 7.121 1.00 0.00 C ATOM 137 CG ASN X 8 70.449 11.947 5.812 1.00 0.00 C ATOM 138 OD1 ASN X 8 70.144 12.758 4.969 1.00 0.00 O ATOM 139 ND2 ASN X 8 70.210 10.679 5.607 1.00 0.00 N ATOM 0 H ASN X 8 71.564 12.252 9.592 1.00 0.00 H new ATOM 0 HA ASN X 8 71.544 10.356 7.525 1.00 0.00 H new ATOM 0 HB2 ASN X 8 70.312 12.668 7.841 1.00 0.00 H new ATOM 0 HB3 ASN X 8 71.667 13.323 6.944 1.00 0.00 H new ATOM 0 HD21 ASN X 8 69.768 10.377 4.739 1.00 0.00 H new ATOM 0 HD22 ASN X 8 70.465 9.991 6.315 1.00 0.00 H new ATOM 146 N LYS X 9 74.276 12.167 7.560 1.00 0.00 N ATOM 147 CA LYS X 9 75.633 12.228 6.965 1.00 0.00 C ATOM 148 C LYS X 9 76.231 10.831 7.076 1.00 0.00 C ATOM 149 O LYS X 9 77.056 10.424 6.282 1.00 0.00 O ATOM 150 CB LYS X 9 76.504 13.234 7.718 1.00 0.00 C ATOM 151 CG LYS X 9 77.802 13.458 6.937 1.00 0.00 C ATOM 152 CD LYS X 9 78.595 14.600 7.572 1.00 0.00 C ATOM 153 CE LYS X 9 79.844 14.877 6.733 1.00 0.00 C ATOM 154 NZ LYS X 9 80.523 16.102 7.242 1.00 0.00 N ATOM 0 H LYS X 9 74.127 12.761 8.376 1.00 0.00 H new ATOM 0 HA LYS X 9 75.582 12.551 5.925 1.00 0.00 H new ATOM 0 HB2 LYS X 9 75.970 14.177 7.839 1.00 0.00 H new ATOM 0 HB3 LYS X 9 76.727 12.863 8.719 1.00 0.00 H new ATOM 0 HG2 LYS X 9 78.398 12.546 6.935 1.00 0.00 H new ATOM 0 HG3 LYS X 9 77.576 13.694 5.897 1.00 0.00 H new ATOM 0 HD2 LYS X 9 77.978 15.496 7.633 1.00 0.00 H new ATOM 0 HD3 LYS X 9 78.879 14.338 8.591 1.00 0.00 H new ATOM 0 HE2 LYS X 9 80.523 14.026 6.780 1.00 0.00 H new ATOM 0 HE3 LYS X 9 79.570 15.008 5.686 1.00 0.00 H new ATOM 0 HZ1 LYS X 9 81.372 16.291 6.672 1.00 0.00 H new ATOM 0 HZ2 LYS X 9 79.874 16.912 7.175 1.00 0.00 H new ATOM 0 HZ3 LYS X 9 80.797 15.960 8.235 1.00 0.00 H new ATOM 168 N ILE X 10 75.793 10.082 8.058 1.00 0.00 N ATOM 169 CA ILE X 10 76.302 8.691 8.231 1.00 0.00 C ATOM 170 C ILE X 10 76.232 7.988 6.883 1.00 0.00 C ATOM 171 O ILE X 10 77.116 7.246 6.504 1.00 0.00 O ATOM 172 CB ILE X 10 75.411 7.935 9.242 1.00 0.00 C ATOM 173 CG1 ILE X 10 76.131 6.666 9.715 1.00 0.00 C ATOM 174 CG2 ILE X 10 74.049 7.533 8.611 1.00 0.00 C ATOM 175 CD1 ILE X 10 75.183 5.845 10.600 1.00 0.00 C ATOM 0 H ILE X 10 75.103 10.377 8.748 1.00 0.00 H new ATOM 0 HA ILE X 10 77.327 8.711 8.601 1.00 0.00 H new ATOM 0 HB ILE X 10 75.221 8.602 10.083 1.00 0.00 H new ATOM 0 HG12 ILE X 10 76.450 6.074 8.857 1.00 0.00 H new ATOM 0 HG13 ILE X 10 77.030 6.930 10.272 1.00 0.00 H new ATOM 0 HG21 ILE X 10 73.448 7.003 9.350 1.00 0.00 H new ATOM 0 HG22 ILE X 10 73.519 8.429 8.287 1.00 0.00 H new ATOM 0 HG23 ILE X 10 74.223 6.884 7.752 1.00 0.00 H new ATOM 0 HD11 ILE X 10 75.691 4.942 10.938 1.00 0.00 H new ATOM 0 HD12 ILE X 10 74.886 6.439 11.464 1.00 0.00 H new ATOM 0 HD13 ILE X 10 74.297 5.570 10.027 1.00 0.00 H new ATOM 187 N LEU X 11 75.180 8.223 6.155 1.00 0.00 N ATOM 188 CA LEU X 11 75.050 7.561 4.827 1.00 0.00 C ATOM 189 C LEU X 11 76.081 8.162 3.869 1.00 0.00 C ATOM 190 O LEU X 11 76.689 7.466 3.080 1.00 0.00 O ATOM 191 CB LEU X 11 73.633 7.776 4.273 1.00 0.00 C ATOM 192 CG LEU X 11 73.478 7.087 2.902 1.00 0.00 C ATOM 193 CD1 LEU X 11 73.506 5.561 3.068 1.00 0.00 C ATOM 194 CD2 LEU X 11 72.142 7.502 2.272 1.00 0.00 C ATOM 0 H LEU X 11 74.410 8.839 6.417 1.00 0.00 H new ATOM 0 HA LEU X 11 75.227 6.490 4.931 1.00 0.00 H new ATOM 0 HB2 LEU X 11 72.898 7.377 4.972 1.00 0.00 H new ATOM 0 HB3 LEU X 11 73.433 8.843 4.175 1.00 0.00 H new ATOM 0 HG LEU X 11 74.303 7.391 2.258 1.00 0.00 H new ATOM 0 HD11 LEU X 11 73.396 5.087 2.093 1.00 0.00 H new ATOM 0 HD12 LEU X 11 74.455 5.261 3.512 1.00 0.00 H new ATOM 0 HD13 LEU X 11 72.687 5.251 3.717 1.00 0.00 H new ATOM 0 HD21 LEU X 11 72.030 7.016 1.303 1.00 0.00 H new ATOM 0 HD22 LEU X 11 71.323 7.201 2.925 1.00 0.00 H new ATOM 0 HD23 LEU X 11 72.122 8.584 2.140 1.00 0.00 H new ATOM 206 N SER X 12 76.281 9.452 3.927 1.00 0.00 N ATOM 207 CA SER X 12 77.271 10.099 3.013 1.00 0.00 C ATOM 208 C SER X 12 78.662 10.064 3.658 1.00 0.00 C ATOM 209 O SER X 12 79.415 11.003 3.457 1.00 0.00 O ATOM 210 CB SER X 12 76.847 11.548 2.760 1.00 0.00 C ATOM 211 OG SER X 12 77.920 12.261 2.162 1.00 0.00 O ATOM 212 OXT SER X 12 78.952 9.094 4.338 1.00 0.00 O ATOM 0 H SER X 12 75.803 10.086 4.567 1.00 0.00 H new ATOM 0 HA SER X 12 77.306 9.562 2.065 1.00 0.00 H new ATOM 0 HB2 SER X 12 75.973 11.573 2.109 1.00 0.00 H new ATOM 0 HB3 SER X 12 76.560 12.023 3.698 1.00 0.00 H new ATOM 0 HG SER X 12 78.660 12.335 2.801 1.00 0.00 H new ATOM 295 N ILE Y 5 57.786 -16.551 -13.420 1.00 0.00 N ATOM 296 CA ILE Y 5 58.178 -15.112 -13.558 1.00 0.00 C ATOM 297 C ILE Y 5 59.688 -14.937 -13.308 1.00 0.00 C ATOM 298 O ILE Y 5 60.231 -15.385 -12.318 1.00 0.00 O ATOM 299 CB ILE Y 5 57.341 -14.302 -12.553 1.00 0.00 C ATOM 300 CG1 ILE Y 5 57.559 -14.832 -11.128 1.00 0.00 C ATOM 301 CG2 ILE Y 5 55.864 -14.466 -12.922 1.00 0.00 C ATOM 302 CD1 ILE Y 5 56.722 -14.019 -10.129 1.00 0.00 C ATOM 0 HA ILE Y 5 57.984 -14.755 -14.569 1.00 0.00 H new ATOM 0 HB ILE Y 5 57.639 -13.254 -12.589 1.00 0.00 H new ATOM 0 HG12 ILE Y 5 57.280 -15.884 -11.076 1.00 0.00 H new ATOM 0 HG13 ILE Y 5 58.615 -14.769 -10.866 1.00 0.00 H new ATOM 0 HG21 ILE Y 5 55.249 -13.900 -12.222 1.00 0.00 H new ATOM 0 HG22 ILE Y 5 55.698 -14.095 -13.933 1.00 0.00 H new ATOM 0 HG23 ILE Y 5 55.592 -15.520 -12.873 1.00 0.00 H new ATOM 0 HD11 ILE Y 5 56.884 -14.403 -9.122 1.00 0.00 H new ATOM 0 HD12 ILE Y 5 57.022 -12.972 -10.171 1.00 0.00 H new ATOM 0 HD13 ILE Y 5 55.666 -14.105 -10.385 1.00 0.00 H new ATOM 314 N ASP Y 6 60.368 -14.294 -14.230 1.00 0.00 N ATOM 315 CA ASP Y 6 61.848 -14.071 -14.101 1.00 0.00 C ATOM 316 C ASP Y 6 62.114 -12.579 -13.877 1.00 0.00 C ATOM 317 O ASP Y 6 63.194 -12.078 -14.120 1.00 0.00 O ATOM 318 CB ASP Y 6 62.537 -14.527 -15.388 1.00 0.00 C ATOM 319 CG ASP Y 6 62.352 -16.037 -15.551 1.00 0.00 C ATOM 320 OD1 ASP Y 6 62.485 -16.740 -14.562 1.00 0.00 O ATOM 321 OD2 ASP Y 6 62.077 -16.465 -16.659 1.00 0.00 O ATOM 0 H ASP Y 6 59.955 -13.908 -15.079 1.00 0.00 H new ATOM 0 HA ASP Y 6 62.238 -14.640 -13.257 1.00 0.00 H new ATOM 0 HB2 ASP Y 6 62.116 -14.002 -16.246 1.00 0.00 H new ATOM 0 HB3 ASP Y 6 63.598 -14.280 -15.353 1.00 0.00 H new ATOM 326 N TRP Y 7 61.126 -11.868 -13.424 1.00 0.00 N ATOM 327 CA TRP Y 7 61.281 -10.408 -13.189 1.00 0.00 C ATOM 328 C TRP Y 7 62.392 -10.134 -12.161 1.00 0.00 C ATOM 329 O TRP Y 7 63.265 -9.336 -12.397 1.00 0.00 O ATOM 330 CB TRP Y 7 59.949 -9.868 -12.663 1.00 0.00 C ATOM 331 CG TRP Y 7 60.045 -8.399 -12.403 1.00 0.00 C ATOM 332 CD1 TRP Y 7 60.301 -7.452 -13.337 1.00 0.00 C ATOM 333 CD2 TRP Y 7 59.872 -7.692 -11.142 1.00 0.00 C ATOM 334 NE1 TRP Y 7 60.304 -6.210 -12.724 1.00 0.00 N ATOM 335 CE2 TRP Y 7 60.044 -6.307 -11.371 1.00 0.00 C ATOM 336 CE3 TRP Y 7 59.588 -8.118 -9.832 1.00 0.00 C ATOM 337 CZ2 TRP Y 7 59.938 -5.378 -10.334 1.00 0.00 C ATOM 338 CZ3 TRP Y 7 59.480 -7.184 -8.791 1.00 0.00 C ATOM 339 CH2 TRP Y 7 59.655 -5.819 -9.043 1.00 0.00 C ATOM 0 H TRP Y 7 60.203 -12.241 -13.203 1.00 0.00 H new ATOM 0 HA TRP Y 7 61.557 -9.916 -14.122 1.00 0.00 H new ATOM 0 HB2 TRP Y 7 59.159 -10.064 -13.388 1.00 0.00 H new ATOM 0 HB3 TRP Y 7 59.676 -10.389 -11.745 1.00 0.00 H new ATOM 0 HD1 TRP Y 7 60.474 -7.635 -14.387 1.00 0.00 H new ATOM 0 HE1 TRP Y 7 60.477 -5.331 -13.212 1.00 0.00 H new ATOM 0 HE3 TRP Y 7 59.452 -9.170 -9.627 1.00 0.00 H new ATOM 0 HZ2 TRP Y 7 60.074 -4.325 -10.531 1.00 0.00 H new ATOM 0 HZ3 TRP Y 7 59.260 -7.521 -7.789 1.00 0.00 H new ATOM 0 HH2 TRP Y 7 59.571 -5.106 -8.236 1.00 0.00 H new ATOM 350 N ASN Y 8 62.393 -10.776 -11.027 1.00 0.00 N ATOM 351 CA ASN Y 8 63.480 -10.485 -10.037 1.00 0.00 C ATOM 352 C ASN Y 8 64.833 -10.570 -10.742 1.00 0.00 C ATOM 353 O ASN Y 8 65.771 -9.852 -10.437 1.00 0.00 O ATOM 354 CB ASN Y 8 63.431 -11.504 -8.893 1.00 0.00 C ATOM 355 CG ASN Y 8 64.158 -12.789 -9.289 1.00 0.00 C ATOM 356 OD1 ASN Y 8 63.842 -13.399 -10.292 1.00 0.00 O ATOM 357 ND2 ASN Y 8 65.131 -13.223 -8.538 1.00 0.00 N ATOM 0 H ASN Y 8 61.707 -11.475 -10.742 1.00 0.00 H new ATOM 0 HA ASN Y 8 63.340 -9.485 -9.626 1.00 0.00 H new ATOM 0 HB2 ASN Y 8 63.890 -11.080 -8.000 1.00 0.00 H new ATOM 0 HB3 ASN Y 8 62.394 -11.728 -8.642 1.00 0.00 H new ATOM 0 HD21 ASN Y 8 65.629 -14.076 -8.791 1.00 0.00 H new ATOM 0 HD22 ASN Y 8 65.394 -12.709 -7.697 1.00 0.00 H new ATOM 364 N LYS Y 9 64.927 -11.441 -11.695 1.00 0.00 N ATOM 365 CA LYS Y 9 66.190 -11.585 -12.440 1.00 0.00 C ATOM 366 C LYS Y 9 66.483 -10.229 -13.068 1.00 0.00 C ATOM 367 O LYS Y 9 67.617 -9.867 -13.312 1.00 0.00 O ATOM 368 CB LYS Y 9 66.008 -12.678 -13.492 1.00 0.00 C ATOM 369 CG LYS Y 9 67.364 -13.243 -13.934 1.00 0.00 C ATOM 370 CD LYS Y 9 67.131 -14.616 -14.562 1.00 0.00 C ATOM 371 CE LYS Y 9 68.406 -15.092 -15.263 1.00 0.00 C ATOM 372 NZ LYS Y 9 69.517 -15.177 -14.275 1.00 0.00 N ATOM 0 H LYS Y 9 64.175 -12.064 -11.991 1.00 0.00 H new ATOM 0 HA LYS Y 9 67.027 -11.876 -11.805 1.00 0.00 H new ATOM 0 HB2 LYS Y 9 65.390 -13.479 -13.087 1.00 0.00 H new ATOM 0 HB3 LYS Y 9 65.479 -12.273 -14.355 1.00 0.00 H new ATOM 0 HG2 LYS Y 9 67.839 -12.573 -14.651 1.00 0.00 H new ATOM 0 HG3 LYS Y 9 68.037 -13.325 -13.081 1.00 0.00 H new ATOM 0 HD2 LYS Y 9 66.839 -15.332 -13.794 1.00 0.00 H new ATOM 0 HD3 LYS Y 9 66.310 -14.564 -15.277 1.00 0.00 H new ATOM 0 HE2 LYS Y 9 68.239 -16.066 -15.722 1.00 0.00 H new ATOM 0 HE3 LYS Y 9 68.671 -14.403 -16.065 1.00 0.00 H new ATOM 0 HZ1 LYS Y 9 70.306 -15.717 -14.685 1.00 0.00 H new ATOM 0 HZ2 LYS Y 9 69.841 -14.219 -14.034 1.00 0.00 H new ATOM 0 HZ3 LYS Y 9 69.181 -15.655 -13.415 1.00 0.00 H new ATOM 386 N ILE Y 10 65.451 -9.452 -13.280 1.00 0.00 N ATOM 387 CA ILE Y 10 65.643 -8.086 -13.834 1.00 0.00 C ATOM 388 C ILE Y 10 66.654 -7.384 -12.943 1.00 0.00 C ATOM 389 O ILE Y 10 67.465 -6.593 -13.383 1.00 0.00 O ATOM 390 CB ILE Y 10 64.309 -7.311 -13.784 1.00 0.00 C ATOM 391 CG1 ILE Y 10 64.416 -6.063 -14.670 1.00 0.00 C ATOM 392 CG2 ILE Y 10 63.964 -6.880 -12.326 1.00 0.00 C ATOM 393 CD1 ILE Y 10 63.200 -5.165 -14.426 1.00 0.00 C ATOM 0 H ILE Y 10 64.482 -9.710 -13.091 1.00 0.00 H new ATOM 0 HA ILE Y 10 65.985 -8.133 -14.868 1.00 0.00 H new ATOM 0 HB ILE Y 10 63.516 -7.965 -14.146 1.00 0.00 H new ATOM 0 HG12 ILE Y 10 65.334 -5.521 -14.445 1.00 0.00 H new ATOM 0 HG13 ILE Y 10 64.465 -6.351 -15.720 1.00 0.00 H new ATOM 0 HG21 ILE Y 10 63.019 -6.336 -12.321 1.00 0.00 H new ATOM 0 HG22 ILE Y 10 63.876 -7.765 -11.696 1.00 0.00 H new ATOM 0 HG23 ILE Y 10 64.755 -6.237 -11.940 1.00 0.00 H new ATOM 0 HD11 ILE Y 10 63.272 -4.277 -15.054 1.00 0.00 H new ATOM 0 HD12 ILE Y 10 62.289 -5.711 -14.673 1.00 0.00 H new ATOM 0 HD13 ILE Y 10 63.172 -4.867 -13.378 1.00 0.00 H new ATOM 405 N LEU Y 11 66.592 -7.680 -11.677 1.00 0.00 N ATOM 406 CA LEU Y 11 67.530 -7.047 -10.715 1.00 0.00 C ATOM 407 C LEU Y 11 68.949 -7.517 -11.041 1.00 0.00 C ATOM 408 O LEU Y 11 69.896 -6.758 -10.998 1.00 0.00 O ATOM 409 CB LEU Y 11 67.137 -7.470 -9.282 1.00 0.00 C ATOM 410 CG LEU Y 11 67.387 -6.329 -8.274 1.00 0.00 C ATOM 411 CD1 LEU Y 11 68.832 -5.827 -8.391 1.00 0.00 C ATOM 412 CD2 LEU Y 11 66.404 -5.162 -8.519 1.00 0.00 C ATOM 0 H LEU Y 11 65.928 -8.337 -11.266 1.00 0.00 H new ATOM 0 HA LEU Y 11 67.485 -5.960 -10.787 1.00 0.00 H new ATOM 0 HB2 LEU Y 11 66.085 -7.754 -9.260 1.00 0.00 H new ATOM 0 HB3 LEU Y 11 67.711 -8.349 -8.989 1.00 0.00 H new ATOM 0 HG LEU Y 11 67.224 -6.717 -7.269 1.00 0.00 H new ATOM 0 HD11 LEU Y 11 68.997 -5.022 -7.675 1.00 0.00 H new ATOM 0 HD12 LEU Y 11 69.520 -6.646 -8.181 1.00 0.00 H new ATOM 0 HD13 LEU Y 11 69.008 -5.456 -9.401 1.00 0.00 H new ATOM 0 HD21 LEU Y 11 66.596 -4.367 -7.798 1.00 0.00 H new ATOM 0 HD22 LEU Y 11 66.541 -4.777 -9.529 1.00 0.00 H new ATOM 0 HD23 LEU Y 11 65.380 -5.518 -8.402 1.00 0.00 H new ATOM 424 N SER Y 12 69.095 -8.773 -11.373 1.00 0.00 N ATOM 425 CA SER Y 12 70.445 -9.313 -11.713 1.00 0.00 C ATOM 426 C SER Y 12 70.648 -9.245 -13.228 1.00 0.00 C ATOM 427 O SER Y 12 71.115 -8.221 -13.699 1.00 0.00 O ATOM 428 CB SER Y 12 70.539 -10.767 -11.248 1.00 0.00 C ATOM 429 OG SER Y 12 69.491 -11.521 -11.846 1.00 0.00 O ATOM 430 OXT SER Y 12 70.330 -10.217 -13.892 1.00 0.00 O ATOM 0 H SER Y 12 68.334 -9.451 -11.424 1.00 0.00 H new ATOM 0 HA SER Y 12 71.215 -8.723 -11.216 1.00 0.00 H new ATOM 0 HB2 SER Y 12 71.507 -11.187 -11.523 1.00 0.00 H new ATOM 0 HB3 SER Y 12 70.466 -10.819 -10.162 1.00 0.00 H new ATOM 0 HG SER Y 12 69.339 -11.202 -12.760 1.00 0.00 H new ATOM 437 N GLY A 1 46.137 -5.227 2.249 1.00 0.00 N ATOM 438 CA GLY A 1 47.642 -5.399 2.028 1.00 0.00 C ATOM 439 C GLY A 1 48.471 -6.030 3.096 1.00 0.00 C ATOM 440 O GLY A 1 48.235 -5.837 4.272 1.00 0.00 O ATOM 0 H1 GLY A 1 45.713 -4.774 1.414 1.00 0.00 H new ATOM 0 H2 GLY A 1 45.699 -6.159 2.397 1.00 0.00 H new ATOM 0 H3 GLY A 1 45.975 -4.631 3.086 1.00 0.00 H new ATOM 0 HA2 GLY A 1 47.774 -5.988 1.120 1.00 0.00 H new ATOM 0 HA3 GLY A 1 48.059 -4.411 1.831 1.00 0.00 H new ATOM 446 N SER A 2 49.457 -6.798 2.720 1.00 0.00 N ATOM 447 CA SER A 2 50.320 -7.457 3.740 1.00 0.00 C ATOM 448 C SER A 2 51.297 -6.431 4.315 1.00 0.00 C ATOM 449 O SER A 2 51.534 -5.394 3.728 1.00 0.00 O ATOM 450 CB SER A 2 51.111 -8.581 3.078 1.00 0.00 C ATOM 451 OG SER A 2 52.045 -8.015 2.168 1.00 0.00 O ATOM 0 H SER A 2 49.702 -6.997 1.750 1.00 0.00 H new ATOM 0 HA SER A 2 49.698 -7.862 4.538 1.00 0.00 H new ATOM 0 HB2 SER A 2 51.631 -9.171 3.833 1.00 0.00 H new ATOM 0 HB3 SER A 2 50.437 -9.258 2.553 1.00 0.00 H new ATOM 0 HG SER A 2 52.085 -8.563 1.357 1.00 0.00 H new ATOM 457 N GLU A 3 51.836 -6.688 5.476 1.00 0.00 N ATOM 458 CA GLU A 3 52.761 -5.703 6.105 1.00 0.00 C ATOM 459 C GLU A 3 53.795 -5.212 5.090 1.00 0.00 C ATOM 460 O GLU A 3 54.018 -4.029 4.945 1.00 0.00 O ATOM 461 CB GLU A 3 53.500 -6.383 7.257 1.00 0.00 C ATOM 462 CG GLU A 3 52.526 -6.671 8.397 1.00 0.00 C ATOM 463 CD GLU A 3 53.274 -7.373 9.529 1.00 0.00 C ATOM 464 OE1 GLU A 3 54.484 -7.494 9.426 1.00 0.00 O ATOM 465 OE2 GLU A 3 52.627 -7.779 10.479 1.00 0.00 O ATOM 0 H GLU A 3 51.675 -7.538 6.016 1.00 0.00 H new ATOM 0 HA GLU A 3 52.178 -4.854 6.464 1.00 0.00 H new ATOM 0 HB2 GLU A 3 53.955 -7.311 6.912 1.00 0.00 H new ATOM 0 HB3 GLU A 3 54.309 -5.744 7.610 1.00 0.00 H new ATOM 0 HG2 GLU A 3 52.084 -5.742 8.758 1.00 0.00 H new ATOM 0 HG3 GLU A 3 51.707 -7.297 8.043 1.00 0.00 H new ATOM 472 N LEU A 4 54.443 -6.106 4.396 1.00 0.00 N ATOM 473 CA LEU A 4 55.470 -5.666 3.409 1.00 0.00 C ATOM 474 C LEU A 4 54.805 -4.954 2.232 1.00 0.00 C ATOM 475 O LEU A 4 55.256 -3.916 1.792 1.00 0.00 O ATOM 476 CB LEU A 4 56.256 -6.893 2.908 1.00 0.00 C ATOM 477 CG LEU A 4 57.407 -7.212 3.881 1.00 0.00 C ATOM 478 CD1 LEU A 4 57.824 -8.681 3.733 1.00 0.00 C ATOM 479 CD2 LEU A 4 58.613 -6.302 3.567 1.00 0.00 C ATOM 0 H LEU A 4 54.308 -7.114 4.468 1.00 0.00 H new ATOM 0 HA LEU A 4 56.155 -4.969 3.892 1.00 0.00 H new ATOM 0 HB2 LEU A 4 55.591 -7.752 2.824 1.00 0.00 H new ATOM 0 HB3 LEU A 4 56.654 -6.699 1.912 1.00 0.00 H new ATOM 0 HG LEU A 4 57.071 -7.036 4.903 1.00 0.00 H new ATOM 0 HD11 LEU A 4 58.638 -8.899 4.424 1.00 0.00 H new ATOM 0 HD12 LEU A 4 56.974 -9.325 3.959 1.00 0.00 H new ATOM 0 HD13 LEU A 4 58.156 -8.864 2.711 1.00 0.00 H new ATOM 0 HD21 LEU A 4 59.428 -6.527 4.255 1.00 0.00 H new ATOM 0 HD22 LEU A 4 58.944 -6.477 2.543 1.00 0.00 H new ATOM 0 HD23 LEU A 4 58.320 -5.258 3.680 1.00 0.00 H new ATOM 491 N GLU A 5 53.746 -5.496 1.713 1.00 0.00 N ATOM 492 CA GLU A 5 53.078 -4.831 0.568 1.00 0.00 C ATOM 493 C GLU A 5 52.630 -3.435 1.000 1.00 0.00 C ATOM 494 O GLU A 5 52.725 -2.476 0.260 1.00 0.00 O ATOM 495 CB GLU A 5 51.877 -5.658 0.105 1.00 0.00 C ATOM 496 CG GLU A 5 51.226 -4.982 -1.103 1.00 0.00 C ATOM 497 CD GLU A 5 50.070 -5.846 -1.611 1.00 0.00 C ATOM 498 OE1 GLU A 5 49.821 -6.879 -1.012 1.00 0.00 O ATOM 499 OE2 GLU A 5 49.460 -5.465 -2.597 1.00 0.00 O ATOM 0 H GLU A 5 53.316 -6.365 2.029 1.00 0.00 H new ATOM 0 HA GLU A 5 53.774 -4.747 -0.266 1.00 0.00 H new ATOM 0 HB2 GLU A 5 52.196 -6.667 -0.158 1.00 0.00 H new ATOM 0 HB3 GLU A 5 51.154 -5.753 0.915 1.00 0.00 H new ATOM 0 HG2 GLU A 5 50.860 -3.993 -0.826 1.00 0.00 H new ATOM 0 HG3 GLU A 5 51.962 -4.840 -1.894 1.00 0.00 H new ATOM 506 N THR A 6 52.143 -3.322 2.201 1.00 0.00 N ATOM 507 CA THR A 6 51.684 -2.004 2.713 1.00 0.00 C ATOM 508 C THR A 6 52.754 -0.940 2.458 1.00 0.00 C ATOM 509 O THR A 6 52.486 0.130 1.955 1.00 0.00 O ATOM 510 CB THR A 6 51.504 -2.127 4.227 1.00 0.00 C ATOM 511 OG1 THR A 6 50.610 -3.195 4.513 1.00 0.00 O ATOM 512 CG2 THR A 6 50.933 -0.823 4.777 1.00 0.00 C ATOM 0 H THR A 6 52.042 -4.096 2.858 1.00 0.00 H new ATOM 0 HA THR A 6 50.757 -1.721 2.214 1.00 0.00 H new ATOM 0 HB THR A 6 52.469 -2.327 4.694 1.00 0.00 H new ATOM 0 HG1 THR A 6 51.112 -4.034 4.577 1.00 0.00 H new ATOM 0 HG21 THR A 6 50.804 -0.909 5.856 1.00 0.00 H new ATOM 0 HG22 THR A 6 51.618 -0.004 4.557 1.00 0.00 H new ATOM 0 HG23 THR A 6 49.968 -0.623 4.311 1.00 0.00 H new ATOM 520 N ALA A 7 53.961 -1.243 2.846 1.00 0.00 N ATOM 521 CA ALA A 7 55.107 -0.296 2.704 1.00 0.00 C ATOM 522 C ALA A 7 55.514 -0.063 1.244 1.00 0.00 C ATOM 523 O ALA A 7 56.060 0.970 0.912 1.00 0.00 O ATOM 524 CB ALA A 7 56.302 -0.900 3.444 1.00 0.00 C ATOM 0 H ALA A 7 54.210 -2.137 3.270 1.00 0.00 H new ATOM 0 HA ALA A 7 54.801 0.666 3.114 1.00 0.00 H new ATOM 0 HB1 ALA A 7 57.158 -0.231 3.359 1.00 0.00 H new ATOM 0 HB2 ALA A 7 56.049 -1.034 4.496 1.00 0.00 H new ATOM 0 HB3 ALA A 7 56.551 -1.866 3.005 1.00 0.00 H new ATOM 530 N MET A 8 55.295 -0.997 0.373 1.00 0.00 N ATOM 531 CA MET A 8 55.728 -0.784 -1.037 1.00 0.00 C ATOM 532 C MET A 8 54.867 0.283 -1.697 1.00 0.00 C ATOM 533 O MET A 8 55.356 1.197 -2.332 1.00 0.00 O ATOM 534 CB MET A 8 55.599 -2.096 -1.815 1.00 0.00 C ATOM 535 CG MET A 8 55.980 -1.862 -3.280 1.00 0.00 C ATOM 536 SD MET A 8 56.046 -3.442 -4.157 1.00 0.00 S ATOM 537 CE MET A 8 56.060 -2.755 -5.831 1.00 0.00 C ATOM 0 H MET A 8 54.841 -1.890 0.566 1.00 0.00 H new ATOM 0 HA MET A 8 56.767 -0.454 -1.042 1.00 0.00 H new ATOM 0 HB2 MET A 8 56.246 -2.856 -1.377 1.00 0.00 H new ATOM 0 HB3 MET A 8 54.578 -2.471 -1.749 1.00 0.00 H new ATOM 0 HG2 MET A 8 55.252 -1.203 -3.754 1.00 0.00 H new ATOM 0 HG3 MET A 8 56.947 -1.363 -3.338 1.00 0.00 H new ATOM 0 HE1 MET A 8 56.449 -3.499 -6.526 1.00 0.00 H new ATOM 0 HE2 MET A 8 55.045 -2.482 -6.121 1.00 0.00 H new ATOM 0 HE3 MET A 8 56.695 -1.869 -5.855 1.00 0.00 H new ATOM 547 N GLU A 9 53.589 0.146 -1.577 1.00 0.00 N ATOM 548 CA GLU A 9 52.667 1.103 -2.214 1.00 0.00 C ATOM 549 C GLU A 9 52.761 2.472 -1.543 1.00 0.00 C ATOM 550 O GLU A 9 52.507 3.482 -2.161 1.00 0.00 O ATOM 551 CB GLU A 9 51.255 0.550 -2.093 1.00 0.00 C ATOM 552 CG GLU A 9 51.083 -0.637 -3.038 1.00 0.00 C ATOM 553 CD GLU A 9 51.078 -0.145 -4.487 1.00 0.00 C ATOM 554 OE1 GLU A 9 50.469 0.881 -4.741 1.00 0.00 O ATOM 555 OE2 GLU A 9 51.685 -0.801 -5.318 1.00 0.00 O ATOM 0 H GLU A 9 53.136 -0.603 -1.054 1.00 0.00 H new ATOM 0 HA GLU A 9 52.933 1.232 -3.263 1.00 0.00 H new ATOM 0 HB2 GLU A 9 51.063 0.240 -1.066 1.00 0.00 H new ATOM 0 HB3 GLU A 9 50.528 1.326 -2.333 1.00 0.00 H new ATOM 0 HG2 GLU A 9 51.892 -1.353 -2.889 1.00 0.00 H new ATOM 0 HG3 GLU A 9 50.151 -1.158 -2.817 1.00 0.00 H new ATOM 562 N THR A 10 53.093 2.524 -0.284 1.00 0.00 N ATOM 563 CA THR A 10 53.165 3.850 0.396 1.00 0.00 C ATOM 564 C THR A 10 54.262 4.720 -0.248 1.00 0.00 C ATOM 565 O THR A 10 53.989 5.808 -0.697 1.00 0.00 O ATOM 566 CB THR A 10 53.437 3.636 1.904 1.00 0.00 C ATOM 567 OG1 THR A 10 53.428 2.247 2.177 1.00 0.00 O ATOM 568 CG2 THR A 10 52.357 4.316 2.753 1.00 0.00 C ATOM 0 H THR A 10 53.316 1.717 0.299 1.00 0.00 H new ATOM 0 HA THR A 10 52.216 4.373 0.282 1.00 0.00 H new ATOM 0 HB THR A 10 54.405 4.072 2.153 1.00 0.00 H new ATOM 0 HG1 THR A 10 52.526 1.892 2.036 1.00 0.00 H new ATOM 0 HG21 THR A 10 52.568 4.153 3.810 1.00 0.00 H new ATOM 0 HG22 THR A 10 52.351 5.386 2.545 1.00 0.00 H new ATOM 0 HG23 THR A 10 51.382 3.894 2.508 1.00 0.00 H new ATOM 576 N LEU A 11 55.486 4.280 -0.294 1.00 0.00 N ATOM 577 CA LEU A 11 56.557 5.129 -0.908 1.00 0.00 C ATOM 578 C LEU A 11 56.172 5.515 -2.341 1.00 0.00 C ATOM 579 O LEU A 11 56.423 6.618 -2.783 1.00 0.00 O ATOM 580 CB LEU A 11 57.872 4.333 -0.940 1.00 0.00 C ATOM 581 CG LEU A 11 58.565 4.410 0.423 1.00 0.00 C ATOM 582 CD1 LEU A 11 57.618 3.912 1.514 1.00 0.00 C ATOM 583 CD2 LEU A 11 59.817 3.532 0.398 1.00 0.00 C ATOM 0 H LEU A 11 55.796 3.376 0.063 1.00 0.00 H new ATOM 0 HA LEU A 11 56.677 6.035 -0.314 1.00 0.00 H new ATOM 0 HB2 LEU A 11 57.671 3.293 -1.196 1.00 0.00 H new ATOM 0 HB3 LEU A 11 58.529 4.731 -1.714 1.00 0.00 H new ATOM 0 HG LEU A 11 58.841 5.443 0.633 1.00 0.00 H new ATOM 0 HD11 LEU A 11 58.116 3.969 2.482 1.00 0.00 H new ATOM 0 HD12 LEU A 11 56.722 4.533 1.530 1.00 0.00 H new ATOM 0 HD13 LEU A 11 57.339 2.878 1.310 1.00 0.00 H new ATOM 0 HD21 LEU A 11 60.316 3.582 1.366 1.00 0.00 H new ATOM 0 HD22 LEU A 11 59.534 2.500 0.189 1.00 0.00 H new ATOM 0 HD23 LEU A 11 60.495 3.887 -0.378 1.00 0.00 H new ATOM 595 N ILE A 12 55.608 4.616 -3.079 1.00 0.00 N ATOM 596 CA ILE A 12 55.249 4.930 -4.491 1.00 0.00 C ATOM 597 C ILE A 12 54.175 6.040 -4.590 1.00 0.00 C ATOM 598 O ILE A 12 54.245 6.871 -5.474 1.00 0.00 O ATOM 599 CB ILE A 12 54.762 3.642 -5.165 1.00 0.00 C ATOM 600 CG1 ILE A 12 55.941 2.679 -5.326 1.00 0.00 C ATOM 601 CG2 ILE A 12 54.166 3.951 -6.538 1.00 0.00 C ATOM 602 CD1 ILE A 12 55.427 1.302 -5.756 1.00 0.00 C ATOM 0 H ILE A 12 55.376 3.672 -2.771 1.00 0.00 H new ATOM 0 HA ILE A 12 56.133 5.313 -5.000 1.00 0.00 H new ATOM 0 HB ILE A 12 53.992 3.186 -4.543 1.00 0.00 H new ATOM 0 HG12 ILE A 12 56.640 3.065 -6.068 1.00 0.00 H new ATOM 0 HG13 ILE A 12 56.487 2.597 -4.386 1.00 0.00 H new ATOM 0 HG21 ILE A 12 53.825 3.026 -7.003 1.00 0.00 H new ATOM 0 HG22 ILE A 12 53.323 4.632 -6.424 1.00 0.00 H new ATOM 0 HG23 ILE A 12 54.925 4.416 -7.168 1.00 0.00 H new ATOM 0 HD11 ILE A 12 56.269 0.619 -5.870 1.00 0.00 H new ATOM 0 HD12 ILE A 12 54.745 0.915 -4.998 1.00 0.00 H new ATOM 0 HD13 ILE A 12 54.901 1.391 -6.706 1.00 0.00 H new ATOM 614 N ASN A 13 53.174 6.067 -3.747 1.00 0.00 N ATOM 615 CA ASN A 13 52.121 7.134 -3.892 1.00 0.00 C ATOM 616 C ASN A 13 52.568 8.480 -3.280 1.00 0.00 C ATOM 617 O ASN A 13 52.332 9.527 -3.850 1.00 0.00 O ATOM 618 CB ASN A 13 50.820 6.663 -3.236 1.00 0.00 C ATOM 619 CG ASN A 13 49.678 7.610 -3.615 1.00 0.00 C ATOM 620 OD1 ASN A 13 49.807 8.400 -4.529 1.00 0.00 O ATOM 621 ND2 ASN A 13 48.555 7.561 -2.949 1.00 0.00 N ATOM 0 H ASN A 13 53.035 5.413 -2.977 1.00 0.00 H new ATOM 0 HA ASN A 13 51.960 7.301 -4.957 1.00 0.00 H new ATOM 0 HB2 ASN A 13 50.586 5.648 -3.558 1.00 0.00 H new ATOM 0 HB3 ASN A 13 50.937 6.635 -2.153 1.00 0.00 H new ATOM 0 HD21 ASN A 13 47.788 8.186 -3.197 1.00 0.00 H new ATOM 0 HD22 ASN A 13 48.446 6.898 -2.182 1.00 0.00 H new ATOM 628 N VAL A 14 53.196 8.474 -2.132 1.00 0.00 N ATOM 629 CA VAL A 14 53.628 9.764 -1.517 1.00 0.00 C ATOM 630 C VAL A 14 54.590 10.463 -2.474 1.00 0.00 C ATOM 631 O VAL A 14 54.532 11.660 -2.696 1.00 0.00 O ATOM 632 CB VAL A 14 54.320 9.480 -0.178 1.00 0.00 C ATOM 633 CG1 VAL A 14 55.695 8.846 -0.406 1.00 0.00 C ATOM 634 CG2 VAL A 14 54.477 10.786 0.602 1.00 0.00 C ATOM 0 H VAL A 14 53.427 7.637 -1.597 1.00 0.00 H new ATOM 0 HA VAL A 14 52.767 10.407 -1.337 1.00 0.00 H new ATOM 0 HB VAL A 14 53.707 8.783 0.393 1.00 0.00 H new ATOM 0 HG11 VAL A 14 56.170 8.652 0.556 1.00 0.00 H new ATOM 0 HG12 VAL A 14 55.578 7.908 -0.949 1.00 0.00 H new ATOM 0 HG13 VAL A 14 56.317 9.526 -0.988 1.00 0.00 H new ATOM 0 HG21 VAL A 14 54.969 10.585 1.554 1.00 0.00 H new ATOM 0 HG22 VAL A 14 55.080 11.485 0.023 1.00 0.00 H new ATOM 0 HG23 VAL A 14 53.494 11.220 0.786 1.00 0.00 H new ATOM 644 N PHE A 15 55.465 9.707 -3.055 1.00 0.00 N ATOM 645 CA PHE A 15 56.436 10.289 -4.022 1.00 0.00 C ATOM 646 C PHE A 15 55.661 10.928 -5.184 1.00 0.00 C ATOM 647 O PHE A 15 56.019 11.978 -5.663 1.00 0.00 O ATOM 648 CB PHE A 15 57.387 9.192 -4.524 1.00 0.00 C ATOM 649 CG PHE A 15 58.077 9.643 -5.791 1.00 0.00 C ATOM 650 CD1 PHE A 15 57.410 9.533 -7.017 1.00 0.00 C ATOM 651 CD2 PHE A 15 59.372 10.166 -5.743 1.00 0.00 C ATOM 652 CE1 PHE A 15 58.037 9.947 -8.196 1.00 0.00 C ATOM 653 CE2 PHE A 15 60.001 10.579 -6.925 1.00 0.00 C ATOM 654 CZ PHE A 15 59.333 10.470 -8.150 1.00 0.00 C ATOM 0 H PHE A 15 55.555 8.702 -2.904 1.00 0.00 H new ATOM 0 HA PHE A 15 57.037 11.059 -3.537 1.00 0.00 H new ATOM 0 HB2 PHE A 15 58.128 8.964 -3.758 1.00 0.00 H new ATOM 0 HB3 PHE A 15 56.830 8.274 -4.711 1.00 0.00 H new ATOM 0 HD1 PHE A 15 56.410 9.128 -7.052 1.00 0.00 H new ATOM 0 HD2 PHE A 15 59.887 10.252 -4.797 1.00 0.00 H new ATOM 0 HE1 PHE A 15 57.521 9.863 -9.141 1.00 0.00 H new ATOM 0 HE2 PHE A 15 61.002 10.982 -6.891 1.00 0.00 H new ATOM 0 HZ PHE A 15 59.819 10.790 -9.060 1.00 0.00 H new ATOM 664 N HIS A 16 54.608 10.316 -5.631 1.00 0.00 N ATOM 665 CA HIS A 16 53.811 10.904 -6.751 1.00 0.00 C ATOM 666 C HIS A 16 53.276 12.289 -6.342 1.00 0.00 C ATOM 667 O HIS A 16 53.232 13.208 -7.137 1.00 0.00 O ATOM 668 CB HIS A 16 52.635 9.976 -7.069 1.00 0.00 C ATOM 669 CG HIS A 16 51.835 10.540 -8.212 1.00 0.00 C ATOM 670 ND1 HIS A 16 50.593 11.133 -8.028 1.00 0.00 N ATOM 671 CD2 HIS A 16 52.080 10.594 -9.564 1.00 0.00 C ATOM 672 CE1 HIS A 16 50.141 11.513 -9.239 1.00 0.00 C ATOM 673 NE2 HIS A 16 51.009 11.207 -10.205 1.00 0.00 N ATOM 0 H HIS A 16 54.257 9.428 -5.271 1.00 0.00 H new ATOM 0 HA HIS A 16 54.446 11.013 -7.631 1.00 0.00 H new ATOM 0 HB2 HIS A 16 53.003 8.983 -7.326 1.00 0.00 H new ATOM 0 HB3 HIS A 16 52.001 9.863 -6.190 1.00 0.00 H new ATOM 0 HD2 HIS A 16 52.967 10.218 -10.052 1.00 0.00 H new ATOM 0 HE1 HIS A 16 49.194 12.004 -9.407 1.00 0.00 H new ATOM 0 HE2 HIS A 16 50.908 11.385 -11.204 1.00 0.00 H new ATOM 682 N ALA A 17 52.843 12.429 -5.120 1.00 0.00 N ATOM 683 CA ALA A 17 52.273 13.733 -4.645 1.00 0.00 C ATOM 684 C ALA A 17 53.221 14.924 -4.883 1.00 0.00 C ATOM 685 O ALA A 17 52.844 15.913 -5.475 1.00 0.00 O ATOM 686 CB ALA A 17 52.022 13.637 -3.138 1.00 0.00 C ATOM 0 H ALA A 17 52.858 11.690 -4.418 1.00 0.00 H new ATOM 0 HA ALA A 17 51.358 13.908 -5.210 1.00 0.00 H new ATOM 0 HB1 ALA A 17 51.607 14.578 -2.778 1.00 0.00 H new ATOM 0 HB2 ALA A 17 51.318 12.830 -2.937 1.00 0.00 H new ATOM 0 HB3 ALA A 17 52.962 13.435 -2.625 1.00 0.00 H new ATOM 692 N HIS A 18 54.431 14.859 -4.397 1.00 0.00 N ATOM 693 CA HIS A 18 55.368 16.023 -4.572 1.00 0.00 C ATOM 694 C HIS A 18 55.980 16.051 -5.980 1.00 0.00 C ATOM 695 O HIS A 18 56.132 17.091 -6.589 1.00 0.00 O ATOM 696 CB HIS A 18 56.493 15.917 -3.542 1.00 0.00 C ATOM 697 CG HIS A 18 55.924 16.086 -2.160 1.00 0.00 C ATOM 698 ND1 HIS A 18 55.285 15.052 -1.490 1.00 0.00 N ATOM 699 CD2 HIS A 18 55.890 17.163 -1.308 1.00 0.00 C ATOM 700 CE1 HIS A 18 54.897 15.524 -0.291 1.00 0.00 C ATOM 701 NE2 HIS A 18 55.242 16.803 -0.132 1.00 0.00 N ATOM 0 H HIS A 18 54.815 14.062 -3.890 1.00 0.00 H new ATOM 0 HA HIS A 18 54.798 16.941 -4.431 1.00 0.00 H new ATOM 0 HB2 HIS A 18 56.989 14.950 -3.627 1.00 0.00 H new ATOM 0 HB3 HIS A 18 57.248 16.680 -3.732 1.00 0.00 H new ATOM 0 HD2 HIS A 18 56.303 18.138 -1.519 1.00 0.00 H new ATOM 0 HE1 HIS A 18 54.372 14.940 0.450 1.00 0.00 H new ATOM 0 HE2 HIS A 18 55.067 17.393 0.682 1.00 0.00 H new ATOM 710 N SER A 19 56.363 14.917 -6.468 1.00 0.00 N ATOM 711 CA SER A 19 57.017 14.795 -7.807 1.00 0.00 C ATOM 712 C SER A 19 56.125 15.196 -8.993 1.00 0.00 C ATOM 713 O SER A 19 56.628 15.629 -10.010 1.00 0.00 O ATOM 714 CB SER A 19 57.408 13.326 -7.994 1.00 0.00 C ATOM 715 OG SER A 19 58.423 13.231 -8.984 1.00 0.00 O ATOM 0 H SER A 19 56.249 14.028 -5.981 1.00 0.00 H new ATOM 0 HA SER A 19 57.864 15.480 -7.809 1.00 0.00 H new ATOM 0 HB2 SER A 19 57.764 12.910 -7.051 1.00 0.00 H new ATOM 0 HB3 SER A 19 56.538 12.741 -8.292 1.00 0.00 H new ATOM 0 HG SER A 19 59.030 12.495 -8.760 1.00 0.00 H new ATOM 721 N GLY A 20 54.832 15.002 -8.921 1.00 0.00 N ATOM 722 CA GLY A 20 53.965 15.315 -10.105 1.00 0.00 C ATOM 723 C GLY A 20 53.269 16.668 -9.981 1.00 0.00 C ATOM 724 O GLY A 20 52.431 16.992 -10.798 1.00 0.00 O ATOM 0 H GLY A 20 54.340 14.644 -8.103 1.00 0.00 H new ATOM 0 HA2 GLY A 20 54.574 15.305 -11.009 1.00 0.00 H new ATOM 0 HA3 GLY A 20 53.214 14.533 -10.218 1.00 0.00 H new ATOM 728 N LYS A 21 53.591 17.467 -8.990 1.00 0.00 N ATOM 729 CA LYS A 21 52.914 18.804 -8.860 1.00 0.00 C ATOM 730 C LYS A 21 53.955 19.919 -8.946 1.00 0.00 C ATOM 731 O LYS A 21 53.875 20.788 -9.791 1.00 0.00 O ATOM 732 CB LYS A 21 52.159 18.874 -7.520 1.00 0.00 C ATOM 733 CG LYS A 21 50.776 18.217 -7.660 1.00 0.00 C ATOM 734 CD LYS A 21 50.230 17.820 -6.279 1.00 0.00 C ATOM 735 CE LYS A 21 50.199 19.031 -5.340 1.00 0.00 C ATOM 736 NZ LYS A 21 49.433 20.142 -5.973 1.00 0.00 N ATOM 0 H LYS A 21 54.285 17.257 -8.272 1.00 0.00 H new ATOM 0 HA LYS A 21 52.198 18.931 -9.672 1.00 0.00 H new ATOM 0 HB2 LYS A 21 52.733 18.370 -6.743 1.00 0.00 H new ATOM 0 HB3 LYS A 21 52.047 19.913 -7.210 1.00 0.00 H new ATOM 0 HG2 LYS A 21 50.086 18.907 -8.146 1.00 0.00 H new ATOM 0 HG3 LYS A 21 50.848 17.335 -8.297 1.00 0.00 H new ATOM 0 HD2 LYS A 21 49.226 17.409 -6.384 1.00 0.00 H new ATOM 0 HD3 LYS A 21 50.852 17.035 -5.848 1.00 0.00 H new ATOM 0 HE2 LYS A 21 49.740 18.755 -4.391 1.00 0.00 H new ATOM 0 HE3 LYS A 21 51.215 19.357 -5.119 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 49.181 20.846 -5.250 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 50.017 20.592 -6.707 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 48.566 19.764 -6.405 1.00 0.00 H new ATOM 750 N GLU A 22 54.910 19.925 -8.066 1.00 0.00 N ATOM 751 CA GLU A 22 55.933 21.012 -8.079 1.00 0.00 C ATOM 752 C GLU A 22 57.129 20.634 -8.959 1.00 0.00 C ATOM 753 O GLU A 22 58.183 21.229 -8.853 1.00 0.00 O ATOM 754 CB GLU A 22 56.419 21.245 -6.648 1.00 0.00 C ATOM 755 CG GLU A 22 55.271 21.795 -5.802 1.00 0.00 C ATOM 756 CD GLU A 22 55.759 22.027 -4.371 1.00 0.00 C ATOM 757 OE1 GLU A 22 56.855 21.588 -4.061 1.00 0.00 O ATOM 758 OE2 GLU A 22 55.028 22.636 -3.608 1.00 0.00 O ATOM 0 H GLU A 22 55.031 19.225 -7.334 1.00 0.00 H new ATOM 0 HA GLU A 22 55.479 21.916 -8.486 1.00 0.00 H new ATOM 0 HB2 GLU A 22 56.785 20.311 -6.221 1.00 0.00 H new ATOM 0 HB3 GLU A 22 57.254 21.945 -6.646 1.00 0.00 H new ATOM 0 HG2 GLU A 22 54.905 22.729 -6.229 1.00 0.00 H new ATOM 0 HG3 GLU A 22 54.436 21.095 -5.804 1.00 0.00 H new ATOM 765 N GLY A 23 57.005 19.657 -9.823 1.00 0.00 N ATOM 766 CA GLY A 23 58.188 19.302 -10.662 1.00 0.00 C ATOM 767 C GLY A 23 57.813 18.427 -11.859 1.00 0.00 C ATOM 768 O GLY A 23 56.677 18.359 -12.283 1.00 0.00 O ATOM 0 H GLY A 23 56.162 19.105 -9.981 1.00 0.00 H new ATOM 0 HA2 GLY A 23 58.664 20.215 -11.018 1.00 0.00 H new ATOM 0 HA3 GLY A 23 58.921 18.779 -10.048 1.00 0.00 H new ATOM 772 N ASP A 24 58.806 17.777 -12.408 1.00 0.00 N ATOM 773 CA ASP A 24 58.598 16.905 -13.598 1.00 0.00 C ATOM 774 C ASP A 24 57.604 15.795 -13.265 1.00 0.00 C ATOM 775 O ASP A 24 57.558 15.292 -12.160 1.00 0.00 O ATOM 776 CB ASP A 24 59.933 16.287 -14.009 1.00 0.00 C ATOM 777 CG ASP A 24 60.837 17.375 -14.589 1.00 0.00 C ATOM 778 OD1 ASP A 24 60.312 18.399 -14.995 1.00 0.00 O ATOM 779 OD2 ASP A 24 62.038 17.168 -14.616 1.00 0.00 O ATOM 0 H ASP A 24 59.769 17.816 -12.074 1.00 0.00 H new ATOM 0 HA ASP A 24 58.201 17.504 -14.418 1.00 0.00 H new ATOM 0 HB2 ASP A 24 60.412 15.822 -13.147 1.00 0.00 H new ATOM 0 HB3 ASP A 24 59.771 15.501 -14.747 1.00 0.00 H new ATOM 784 N LYS A 25 56.786 15.439 -14.211 1.00 0.00 N ATOM 785 CA LYS A 25 55.756 14.395 -13.967 1.00 0.00 C ATOM 786 C LYS A 25 56.385 13.125 -13.373 1.00 0.00 C ATOM 787 O LYS A 25 55.896 12.611 -12.385 1.00 0.00 O ATOM 788 CB LYS A 25 55.070 14.048 -15.300 1.00 0.00 C ATOM 789 CG LYS A 25 54.010 15.105 -15.648 1.00 0.00 C ATOM 790 CD LYS A 25 54.691 16.427 -16.012 1.00 0.00 C ATOM 791 CE LYS A 25 53.659 17.383 -16.612 1.00 0.00 C ATOM 792 NZ LYS A 25 54.248 18.748 -16.718 1.00 0.00 N ATOM 0 H LYS A 25 56.787 15.830 -15.153 1.00 0.00 H new ATOM 0 HA LYS A 25 55.029 14.783 -13.254 1.00 0.00 H new ATOM 0 HB2 LYS A 25 55.813 13.993 -16.095 1.00 0.00 H new ATOM 0 HB3 LYS A 25 54.604 13.065 -15.231 1.00 0.00 H new ATOM 0 HG2 LYS A 25 53.399 14.759 -16.482 1.00 0.00 H new ATOM 0 HG3 LYS A 25 53.339 15.252 -14.801 1.00 0.00 H new ATOM 0 HD2 LYS A 25 55.143 16.872 -15.125 1.00 0.00 H new ATOM 0 HD3 LYS A 25 55.496 16.250 -16.725 1.00 0.00 H new ATOM 0 HE2 LYS A 25 53.351 17.031 -17.596 1.00 0.00 H new ATOM 0 HE3 LYS A 25 52.765 17.408 -15.988 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 53.546 19.398 -17.126 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 54.521 19.083 -15.772 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 55.088 18.717 -17.330 1.00 0.00 H new ATOM 806 N TYR A 26 57.429 12.580 -13.967 1.00 0.00 N ATOM 807 CA TYR A 26 58.029 11.307 -13.429 1.00 0.00 C ATOM 808 C TYR A 26 59.443 11.533 -12.869 1.00 0.00 C ATOM 809 O TYR A 26 60.185 10.591 -12.685 1.00 0.00 O ATOM 810 CB TYR A 26 58.108 10.295 -14.579 1.00 0.00 C ATOM 811 CG TYR A 26 58.465 8.926 -14.047 1.00 0.00 C ATOM 812 CD1 TYR A 26 57.469 8.113 -13.495 1.00 0.00 C ATOM 813 CD2 TYR A 26 59.788 8.468 -14.105 1.00 0.00 C ATOM 814 CE1 TYR A 26 57.794 6.844 -13.001 1.00 0.00 C ATOM 815 CE2 TYR A 26 60.114 7.200 -13.610 1.00 0.00 C ATOM 816 CZ TYR A 26 59.117 6.388 -13.058 1.00 0.00 C ATOM 817 OH TYR A 26 59.440 5.139 -12.567 1.00 0.00 O ATOM 0 H TYR A 26 57.889 12.958 -14.795 1.00 0.00 H new ATOM 0 HA TYR A 26 57.401 10.943 -12.615 1.00 0.00 H new ATOM 0 HB2 TYR A 26 57.152 10.252 -15.101 1.00 0.00 H new ATOM 0 HB3 TYR A 26 58.854 10.617 -15.305 1.00 0.00 H new ATOM 0 HD1 TYR A 26 56.449 8.465 -13.450 1.00 0.00 H new ATOM 0 HD2 TYR A 26 60.557 9.094 -14.532 1.00 0.00 H new ATOM 0 HE1 TYR A 26 57.024 6.217 -12.576 1.00 0.00 H new ATOM 0 HE2 TYR A 26 61.134 6.849 -13.654 1.00 0.00 H new ATOM 0 HH TYR A 26 59.211 5.092 -11.615 1.00 0.00 H new ATOM 827 N LYS A 27 59.833 12.752 -12.582 1.00 0.00 N ATOM 828 CA LYS A 27 61.210 12.977 -12.026 1.00 0.00 C ATOM 829 C LYS A 27 61.153 13.997 -10.893 1.00 0.00 C ATOM 830 O LYS A 27 60.348 14.906 -10.874 1.00 0.00 O ATOM 831 CB LYS A 27 62.158 13.447 -13.150 1.00 0.00 C ATOM 832 CG LYS A 27 63.515 12.740 -13.011 1.00 0.00 C ATOM 833 CD LYS A 27 64.445 13.181 -14.139 1.00 0.00 C ATOM 834 CE LYS A 27 65.623 12.210 -14.247 1.00 0.00 C ATOM 835 NZ LYS A 27 66.399 12.504 -15.485 1.00 0.00 N ATOM 0 H LYS A 27 59.268 13.592 -12.706 1.00 0.00 H new ATOM 0 HA LYS A 27 61.596 12.041 -11.622 1.00 0.00 H new ATOM 0 HB2 LYS A 27 61.720 13.227 -14.124 1.00 0.00 H new ATOM 0 HB3 LYS A 27 62.293 14.527 -13.098 1.00 0.00 H new ATOM 0 HG2 LYS A 27 63.962 12.977 -12.045 1.00 0.00 H new ATOM 0 HG3 LYS A 27 63.377 11.659 -13.042 1.00 0.00 H new ATOM 0 HD2 LYS A 27 63.899 13.212 -15.082 1.00 0.00 H new ATOM 0 HD3 LYS A 27 64.810 14.190 -13.949 1.00 0.00 H new ATOM 0 HE2 LYS A 27 66.266 12.303 -13.372 1.00 0.00 H new ATOM 0 HE3 LYS A 27 65.260 11.182 -14.268 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 67.199 11.844 -15.558 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 65.783 12.394 -16.315 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 66.757 13.480 -15.447 1.00 0.00 H new ATOM 849 N LEU A 28 62.007 13.803 -9.935 1.00 0.00 N ATOM 850 CA LEU A 28 62.062 14.682 -8.738 1.00 0.00 C ATOM 851 C LEU A 28 63.090 15.803 -8.984 1.00 0.00 C ATOM 852 O LEU A 28 63.875 15.743 -9.900 1.00 0.00 O ATOM 853 CB LEU A 28 62.485 13.788 -7.557 1.00 0.00 C ATOM 854 CG LEU A 28 61.833 14.194 -6.227 1.00 0.00 C ATOM 855 CD1 LEU A 28 60.306 14.040 -6.302 1.00 0.00 C ATOM 856 CD2 LEU A 28 62.366 13.270 -5.123 1.00 0.00 C ATOM 0 H LEU A 28 62.692 13.047 -9.931 1.00 0.00 H new ATOM 0 HA LEU A 28 61.102 15.153 -8.527 1.00 0.00 H new ATOM 0 HB2 LEU A 28 62.224 12.754 -7.781 1.00 0.00 H new ATOM 0 HB3 LEU A 28 63.569 13.828 -7.450 1.00 0.00 H new ATOM 0 HG LEU A 28 62.072 15.236 -6.016 1.00 0.00 H new ATOM 0 HD11 LEU A 28 59.864 14.333 -5.350 1.00 0.00 H new ATOM 0 HD12 LEU A 28 59.915 14.677 -7.095 1.00 0.00 H new ATOM 0 HD13 LEU A 28 60.055 13.001 -6.514 1.00 0.00 H new ATOM 0 HD21 LEU A 28 61.914 13.543 -4.170 1.00 0.00 H new ATOM 0 HD22 LEU A 28 62.115 12.236 -5.361 1.00 0.00 H new ATOM 0 HD23 LEU A 28 63.449 13.373 -5.054 1.00 0.00 H new ATOM 868 N SER A 29 63.076 16.822 -8.172 1.00 0.00 N ATOM 869 CA SER A 29 64.036 17.962 -8.331 1.00 0.00 C ATOM 870 C SER A 29 64.681 18.286 -6.978 1.00 0.00 C ATOM 871 O SER A 29 64.199 17.878 -5.941 1.00 0.00 O ATOM 872 CB SER A 29 63.279 19.190 -8.841 1.00 0.00 C ATOM 873 OG SER A 29 62.856 18.960 -10.179 1.00 0.00 O ATOM 0 H SER A 29 62.430 16.919 -7.389 1.00 0.00 H new ATOM 0 HA SER A 29 64.813 17.686 -9.044 1.00 0.00 H new ATOM 0 HB2 SER A 29 62.417 19.390 -8.204 1.00 0.00 H new ATOM 0 HB3 SER A 29 63.920 20.071 -8.796 1.00 0.00 H new ATOM 0 HG SER A 29 62.369 19.745 -10.508 1.00 0.00 H new ATOM 879 N LYS A 30 65.762 19.031 -6.975 1.00 0.00 N ATOM 880 CA LYS A 30 66.417 19.387 -5.670 1.00 0.00 C ATOM 881 C LYS A 30 65.383 19.904 -4.653 1.00 0.00 C ATOM 882 O LYS A 30 65.463 19.603 -3.480 1.00 0.00 O ATOM 883 CB LYS A 30 67.489 20.463 -5.942 1.00 0.00 C ATOM 884 CG LYS A 30 68.059 21.080 -4.645 1.00 0.00 C ATOM 885 CD LYS A 30 68.918 20.059 -3.904 1.00 0.00 C ATOM 886 CE LYS A 30 69.658 20.753 -2.762 1.00 0.00 C ATOM 887 NZ LYS A 30 70.614 21.749 -3.322 1.00 0.00 N ATOM 0 H LYS A 30 66.216 19.405 -7.808 1.00 0.00 H new ATOM 0 HA LYS A 30 66.878 18.497 -5.241 1.00 0.00 H new ATOM 0 HB2 LYS A 30 68.303 20.022 -6.517 1.00 0.00 H new ATOM 0 HB3 LYS A 30 67.057 21.253 -6.556 1.00 0.00 H new ATOM 0 HG2 LYS A 30 68.655 21.961 -4.885 1.00 0.00 H new ATOM 0 HG3 LYS A 30 67.243 21.412 -4.003 1.00 0.00 H new ATOM 0 HD2 LYS A 30 68.293 19.257 -3.512 1.00 0.00 H new ATOM 0 HD3 LYS A 30 69.631 19.601 -4.589 1.00 0.00 H new ATOM 0 HE2 LYS A 30 68.946 21.248 -2.101 1.00 0.00 H new ATOM 0 HE3 LYS A 30 70.193 20.018 -2.161 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 71.429 21.845 -2.683 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 70.942 21.429 -4.256 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 70.139 22.669 -3.419 1.00 0.00 H new ATOM 901 N LYS A 31 64.432 20.688 -5.056 1.00 0.00 N ATOM 902 CA LYS A 31 63.443 21.197 -4.056 1.00 0.00 C ATOM 903 C LYS A 31 62.376 20.141 -3.771 1.00 0.00 C ATOM 904 O LYS A 31 61.851 20.079 -2.678 1.00 0.00 O ATOM 905 CB LYS A 31 62.783 22.479 -4.567 1.00 0.00 C ATOM 906 CG LYS A 31 61.700 22.941 -3.583 1.00 0.00 C ATOM 907 CD LYS A 31 61.027 24.192 -4.125 1.00 0.00 C ATOM 908 CE LYS A 31 59.813 24.514 -3.257 1.00 0.00 C ATOM 909 NZ LYS A 31 59.173 25.771 -3.735 1.00 0.00 N ATOM 0 H LYS A 31 64.290 20.999 -6.017 1.00 0.00 H new ATOM 0 HA LYS A 31 63.975 21.416 -3.130 1.00 0.00 H new ATOM 0 HB2 LYS A 31 63.533 23.261 -4.688 1.00 0.00 H new ATOM 0 HB3 LYS A 31 62.343 22.305 -5.549 1.00 0.00 H new ATOM 0 HG2 LYS A 31 60.963 22.151 -3.439 1.00 0.00 H new ATOM 0 HG3 LYS A 31 62.142 23.146 -2.608 1.00 0.00 H new ATOM 0 HD2 LYS A 31 61.726 25.028 -4.121 1.00 0.00 H new ATOM 0 HD3 LYS A 31 60.721 24.037 -5.160 1.00 0.00 H new ATOM 0 HE2 LYS A 31 59.098 23.693 -3.296 1.00 0.00 H new ATOM 0 HE3 LYS A 31 60.117 24.622 -2.216 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 58.347 25.987 -3.142 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 59.856 26.553 -3.675 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 58.869 25.652 -4.722 1.00 0.00 H new ATOM 923 N GLU A 32 62.034 19.317 -4.710 1.00 0.00 N ATOM 924 CA GLU A 32 60.988 18.302 -4.412 1.00 0.00 C ATOM 925 C GLU A 32 61.518 17.241 -3.438 1.00 0.00 C ATOM 926 O GLU A 32 60.805 16.802 -2.570 1.00 0.00 O ATOM 927 CB GLU A 32 60.488 17.651 -5.683 1.00 0.00 C ATOM 928 CG GLU A 32 59.672 18.655 -6.489 1.00 0.00 C ATOM 929 CD GLU A 32 58.982 17.931 -7.641 1.00 0.00 C ATOM 930 OE1 GLU A 32 59.571 17.003 -8.169 1.00 0.00 O ATOM 931 OE2 GLU A 32 57.880 18.324 -7.987 1.00 0.00 O ATOM 0 H GLU A 32 62.421 19.297 -5.654 1.00 0.00 H new ATOM 0 HA GLU A 32 60.150 18.814 -3.939 1.00 0.00 H new ATOM 0 HB2 GLU A 32 61.330 17.294 -6.275 1.00 0.00 H new ATOM 0 HB3 GLU A 32 59.877 16.782 -5.441 1.00 0.00 H new ATOM 0 HG2 GLU A 32 58.931 19.136 -5.850 1.00 0.00 H new ATOM 0 HG3 GLU A 32 60.320 19.442 -6.874 1.00 0.00 H new ATOM 938 N LEU A 33 62.755 16.825 -3.555 1.00 0.00 N ATOM 939 CA LEU A 33 63.269 15.801 -2.585 1.00 0.00 C ATOM 940 C LEU A 33 63.256 16.373 -1.177 1.00 0.00 C ATOM 941 O LEU A 33 62.858 15.733 -0.236 1.00 0.00 O ATOM 942 CB LEU A 33 64.709 15.376 -2.923 1.00 0.00 C ATOM 943 CG LEU A 33 65.725 16.522 -2.750 1.00 0.00 C ATOM 944 CD1 LEU A 33 66.391 16.504 -1.348 1.00 0.00 C ATOM 945 CD2 LEU A 33 66.826 16.347 -3.776 1.00 0.00 C ATOM 0 H LEU A 33 63.420 17.139 -4.262 1.00 0.00 H new ATOM 0 HA LEU A 33 62.618 14.930 -2.653 1.00 0.00 H new ATOM 0 HB2 LEU A 33 64.997 14.542 -2.283 1.00 0.00 H new ATOM 0 HB3 LEU A 33 64.745 15.016 -3.951 1.00 0.00 H new ATOM 0 HG LEU A 33 65.188 17.463 -2.873 1.00 0.00 H new ATOM 0 HD11 LEU A 33 67.099 17.329 -1.271 1.00 0.00 H new ATOM 0 HD12 LEU A 33 65.625 16.611 -0.580 1.00 0.00 H new ATOM 0 HD13 LEU A 33 66.917 15.560 -1.207 1.00 0.00 H new ATOM 0 HD21 LEU A 33 67.555 17.150 -3.668 1.00 0.00 H new ATOM 0 HD22 LEU A 33 67.318 15.387 -3.621 1.00 0.00 H new ATOM 0 HD23 LEU A 33 66.398 16.378 -4.778 1.00 0.00 H new ATOM 957 N LYS A 34 63.716 17.582 -1.023 1.00 0.00 N ATOM 958 CA LYS A 34 63.748 18.194 0.339 1.00 0.00 C ATOM 959 C LYS A 34 62.339 18.279 0.944 1.00 0.00 C ATOM 960 O LYS A 34 62.148 18.105 2.129 1.00 0.00 O ATOM 961 CB LYS A 34 64.350 19.597 0.258 1.00 0.00 C ATOM 962 CG LYS A 34 64.605 20.111 1.674 1.00 0.00 C ATOM 963 CD LYS A 34 65.351 21.440 1.620 1.00 0.00 C ATOM 964 CE LYS A 34 65.615 21.931 3.044 1.00 0.00 C ATOM 965 NZ LYS A 34 64.349 22.464 3.625 1.00 0.00 N ATOM 0 H LYS A 34 64.070 18.173 -1.775 1.00 0.00 H new ATOM 0 HA LYS A 34 64.361 17.561 0.981 1.00 0.00 H new ATOM 0 HB2 LYS A 34 65.281 19.575 -0.308 1.00 0.00 H new ATOM 0 HB3 LYS A 34 63.672 20.268 -0.270 1.00 0.00 H new ATOM 0 HG2 LYS A 34 63.659 20.237 2.200 1.00 0.00 H new ATOM 0 HG3 LYS A 34 65.187 19.380 2.236 1.00 0.00 H new ATOM 0 HD2 LYS A 34 66.293 21.320 1.084 1.00 0.00 H new ATOM 0 HD3 LYS A 34 64.764 22.177 1.072 1.00 0.00 H new ATOM 0 HE2 LYS A 34 65.995 21.114 3.658 1.00 0.00 H new ATOM 0 HE3 LYS A 34 66.380 22.707 3.037 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 64.551 22.921 4.537 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 63.934 23.160 2.973 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 63.678 21.683 3.770 1.00 0.00 H new ATOM 979 N ASP A 35 61.365 18.595 0.142 1.00 0.00 N ATOM 980 CA ASP A 35 59.965 18.748 0.649 1.00 0.00 C ATOM 981 C ASP A 35 59.344 17.392 1.015 1.00 0.00 C ATOM 982 O ASP A 35 58.662 17.250 2.011 1.00 0.00 O ATOM 983 CB ASP A 35 59.122 19.398 -0.450 1.00 0.00 C ATOM 984 CG ASP A 35 59.547 20.857 -0.624 1.00 0.00 C ATOM 985 OD1 ASP A 35 60.046 21.427 0.331 1.00 0.00 O ATOM 986 OD2 ASP A 35 59.369 21.379 -1.713 1.00 0.00 O ATOM 0 H ASP A 35 61.476 18.757 -0.859 1.00 0.00 H new ATOM 0 HA ASP A 35 59.987 19.364 1.548 1.00 0.00 H new ATOM 0 HB2 ASP A 35 59.248 18.857 -1.388 1.00 0.00 H new ATOM 0 HB3 ASP A 35 58.064 19.345 -0.191 1.00 0.00 H new ATOM 991 N LEU A 36 59.553 16.415 0.190 1.00 0.00 N ATOM 992 CA LEU A 36 58.970 15.065 0.420 1.00 0.00 C ATOM 993 C LEU A 36 59.517 14.450 1.714 1.00 0.00 C ATOM 994 O LEU A 36 58.781 13.950 2.541 1.00 0.00 O ATOM 995 CB LEU A 36 59.380 14.198 -0.778 1.00 0.00 C ATOM 996 CG LEU A 36 58.794 12.783 -0.684 1.00 0.00 C ATOM 997 CD1 LEU A 36 57.284 12.820 -0.949 1.00 0.00 C ATOM 998 CD2 LEU A 36 59.472 11.907 -1.740 1.00 0.00 C ATOM 0 H LEU A 36 60.117 16.493 -0.656 1.00 0.00 H new ATOM 0 HA LEU A 36 57.886 15.128 0.518 1.00 0.00 H new ATOM 0 HB2 LEU A 36 59.043 14.670 -1.701 1.00 0.00 H new ATOM 0 HB3 LEU A 36 60.467 14.139 -0.829 1.00 0.00 H new ATOM 0 HG LEU A 36 58.966 12.379 0.314 1.00 0.00 H new ATOM 0 HD11 LEU A 36 56.878 11.811 -0.880 1.00 0.00 H new ATOM 0 HD12 LEU A 36 56.800 13.457 -0.209 1.00 0.00 H new ATOM 0 HD13 LEU A 36 57.099 13.218 -1.947 1.00 0.00 H new ATOM 0 HD21 LEU A 36 59.068 10.896 -1.688 1.00 0.00 H new ATOM 0 HD22 LEU A 36 59.286 12.322 -2.731 1.00 0.00 H new ATOM 0 HD23 LEU A 36 60.546 11.878 -1.554 1.00 0.00 H new ATOM 1010 N LEU A 37 60.807 14.459 1.870 1.00 0.00 N ATOM 1011 CA LEU A 37 61.438 13.852 3.076 1.00 0.00 C ATOM 1012 C LEU A 37 61.172 14.670 4.350 1.00 0.00 C ATOM 1013 O LEU A 37 60.945 14.127 5.408 1.00 0.00 O ATOM 1014 CB LEU A 37 62.961 13.796 2.843 1.00 0.00 C ATOM 1015 CG LEU A 37 63.334 12.569 1.984 1.00 0.00 C ATOM 1016 CD1 LEU A 37 63.077 11.258 2.765 1.00 0.00 C ATOM 1017 CD2 LEU A 37 62.511 12.569 0.687 1.00 0.00 C ATOM 0 H LEU A 37 61.464 14.867 1.204 1.00 0.00 H new ATOM 0 HA LEU A 37 61.008 12.861 3.220 1.00 0.00 H new ATOM 0 HB2 LEU A 37 63.292 14.708 2.347 1.00 0.00 H new ATOM 0 HB3 LEU A 37 63.479 13.748 3.801 1.00 0.00 H new ATOM 0 HG LEU A 37 64.395 12.628 1.740 1.00 0.00 H new ATOM 0 HD11 LEU A 37 63.346 10.405 2.142 1.00 0.00 H new ATOM 0 HD12 LEU A 37 63.681 11.250 3.672 1.00 0.00 H new ATOM 0 HD13 LEU A 37 62.022 11.194 3.032 1.00 0.00 H new ATOM 0 HD21 LEU A 37 62.779 11.700 0.086 1.00 0.00 H new ATOM 0 HD22 LEU A 37 61.449 12.528 0.930 1.00 0.00 H new ATOM 0 HD23 LEU A 37 62.720 13.479 0.124 1.00 0.00 H new ATOM 1029 N GLN A 38 61.265 15.969 4.269 1.00 0.00 N ATOM 1030 CA GLN A 38 61.098 16.814 5.491 1.00 0.00 C ATOM 1031 C GLN A 38 59.661 16.823 6.010 1.00 0.00 C ATOM 1032 O GLN A 38 59.411 16.823 7.195 1.00 0.00 O ATOM 1033 CB GLN A 38 61.487 18.255 5.141 1.00 0.00 C ATOM 1034 CG GLN A 38 60.389 18.957 4.336 1.00 0.00 C ATOM 1035 CD GLN A 38 60.929 20.286 3.802 1.00 0.00 C ATOM 1036 OE1 GLN A 38 62.158 20.630 4.073 1.00 0.00 O flip ATOM 1037 NE2 GLN A 38 60.225 21.023 3.141 1.00 0.00 N flip ATOM 0 H GLN A 38 61.450 16.485 3.409 1.00 0.00 H new ATOM 0 HA GLN A 38 61.733 16.394 6.271 1.00 0.00 H new ATOM 0 HB2 GLN A 38 61.680 18.813 6.057 1.00 0.00 H new ATOM 0 HB3 GLN A 38 62.414 18.253 4.568 1.00 0.00 H new ATOM 0 HG2 GLN A 38 60.066 18.324 3.510 1.00 0.00 H new ATOM 0 HG3 GLN A 38 59.516 19.132 4.964 1.00 0.00 H new ATOM 0 HE21 GLN A 38 59.264 20.755 2.928 1.00 0.00 H new ATOM 0 HE22 GLN A 38 60.595 21.910 2.798 1.00 0.00 H new ATOM 1046 N THR A 39 58.719 16.909 5.117 1.00 0.00 N ATOM 1047 CA THR A 39 57.300 17.026 5.539 1.00 0.00 C ATOM 1048 C THR A 39 56.933 15.945 6.544 1.00 0.00 C ATOM 1049 O THR A 39 56.316 16.221 7.554 1.00 0.00 O ATOM 1050 CB THR A 39 56.396 16.904 4.308 1.00 0.00 C ATOM 1051 OG1 THR A 39 56.714 17.939 3.387 1.00 0.00 O ATOM 1052 CG2 THR A 39 54.930 17.032 4.729 1.00 0.00 C ATOM 0 H THR A 39 58.872 16.903 4.109 1.00 0.00 H new ATOM 0 HA THR A 39 57.161 17.996 6.016 1.00 0.00 H new ATOM 0 HB THR A 39 56.553 15.933 3.839 1.00 0.00 H new ATOM 0 HG1 THR A 39 57.206 17.562 2.628 1.00 0.00 H new ATOM 0 HG21 THR A 39 54.290 16.945 3.851 1.00 0.00 H new ATOM 0 HG22 THR A 39 54.684 16.240 5.437 1.00 0.00 H new ATOM 0 HG23 THR A 39 54.770 18.002 5.199 1.00 0.00 H new ATOM 1060 N GLU A 40 57.256 14.713 6.264 1.00 0.00 N ATOM 1061 CA GLU A 40 56.859 13.609 7.200 1.00 0.00 C ATOM 1062 C GLU A 40 58.026 13.194 8.094 1.00 0.00 C ATOM 1063 O GLU A 40 57.819 12.651 9.163 1.00 0.00 O ATOM 1064 CB GLU A 40 56.398 12.410 6.375 1.00 0.00 C ATOM 1065 CG GLU A 40 55.091 12.763 5.662 1.00 0.00 C ATOM 1066 CD GLU A 40 54.621 11.568 4.833 1.00 0.00 C ATOM 1067 OE1 GLU A 40 55.372 10.612 4.729 1.00 0.00 O ATOM 1068 OE2 GLU A 40 53.518 11.628 4.316 1.00 0.00 O ATOM 0 H GLU A 40 57.773 14.418 5.436 1.00 0.00 H new ATOM 0 HA GLU A 40 56.053 13.965 7.842 1.00 0.00 H new ATOM 0 HB2 GLU A 40 57.162 12.139 5.646 1.00 0.00 H new ATOM 0 HB3 GLU A 40 56.252 11.544 7.020 1.00 0.00 H new ATOM 0 HG2 GLU A 40 54.328 13.035 6.392 1.00 0.00 H new ATOM 0 HG3 GLU A 40 55.239 13.630 5.018 1.00 0.00 H new ATOM 1075 N LEU A 41 59.244 13.450 7.686 1.00 0.00 N ATOM 1076 CA LEU A 41 60.424 13.075 8.535 1.00 0.00 C ATOM 1077 C LEU A 41 61.204 14.348 8.868 1.00 0.00 C ATOM 1078 O LEU A 41 62.406 14.333 9.043 1.00 0.00 O ATOM 1079 CB LEU A 41 61.305 12.065 7.788 1.00 0.00 C ATOM 1080 CG LEU A 41 60.487 10.806 7.458 1.00 0.00 C ATOM 1081 CD1 LEU A 41 61.366 9.828 6.671 1.00 0.00 C ATOM 1082 CD2 LEU A 41 60.000 10.131 8.756 1.00 0.00 C ATOM 0 H LEU A 41 59.475 13.903 6.802 1.00 0.00 H new ATOM 0 HA LEU A 41 60.093 12.605 9.461 1.00 0.00 H new ATOM 0 HB2 LEU A 41 61.689 12.512 6.871 1.00 0.00 H new ATOM 0 HB3 LEU A 41 62.168 11.800 8.399 1.00 0.00 H new ATOM 0 HG LEU A 41 59.619 11.088 6.862 1.00 0.00 H new ATOM 0 HD11 LEU A 41 60.792 8.933 6.434 1.00 0.00 H new ATOM 0 HD12 LEU A 41 61.699 10.301 5.747 1.00 0.00 H new ATOM 0 HD13 LEU A 41 62.233 9.554 7.272 1.00 0.00 H new ATOM 0 HD21 LEU A 41 59.422 9.241 8.508 1.00 0.00 H new ATOM 0 HD22 LEU A 41 60.860 9.848 9.364 1.00 0.00 H new ATOM 0 HD23 LEU A 41 59.374 10.826 9.315 1.00 0.00 H new ATOM 1094 N SER A 42 60.506 15.449 8.969 1.00 0.00 N ATOM 1095 CA SER A 42 61.167 16.742 9.306 1.00 0.00 C ATOM 1096 C SER A 42 62.055 16.559 10.534 1.00 0.00 C ATOM 1097 O SER A 42 63.246 16.776 10.492 1.00 0.00 O ATOM 1098 CB SER A 42 60.074 17.785 9.639 1.00 0.00 C ATOM 1099 OG SER A 42 58.895 17.105 10.051 1.00 0.00 O ATOM 0 H SER A 42 59.497 15.507 8.831 1.00 0.00 H new ATOM 0 HA SER A 42 61.771 17.075 8.462 1.00 0.00 H new ATOM 0 HB2 SER A 42 60.419 18.453 10.429 1.00 0.00 H new ATOM 0 HB3 SER A 42 59.866 18.404 8.766 1.00 0.00 H new ATOM 0 HG SER A 42 58.198 17.760 10.265 1.00 0.00 H new ATOM 1105 N SER A 43 61.459 16.201 11.633 1.00 0.00 N ATOM 1106 CA SER A 43 62.224 16.046 12.897 1.00 0.00 C ATOM 1107 C SER A 43 63.159 14.834 12.868 1.00 0.00 C ATOM 1108 O SER A 43 64.091 14.771 13.644 1.00 0.00 O ATOM 1109 CB SER A 43 61.239 15.884 14.054 1.00 0.00 C ATOM 1110 OG SER A 43 60.517 14.671 13.887 1.00 0.00 O ATOM 0 H SER A 43 60.461 16.007 11.710 1.00 0.00 H new ATOM 0 HA SER A 43 62.840 16.936 13.023 1.00 0.00 H new ATOM 0 HB2 SER A 43 61.774 15.875 15.004 1.00 0.00 H new ATOM 0 HB3 SER A 43 60.551 16.729 14.083 1.00 0.00 H new ATOM 0 HG SER A 43 59.885 14.562 14.628 1.00 0.00 H new ATOM 1116 N PHE A 44 62.934 13.850 12.021 1.00 0.00 N ATOM 1117 CA PHE A 44 63.853 12.665 12.046 1.00 0.00 C ATOM 1118 C PHE A 44 65.055 12.909 11.125 1.00 0.00 C ATOM 1119 O PHE A 44 65.946 13.653 11.455 1.00 0.00 O ATOM 1120 CB PHE A 44 63.109 11.394 11.589 1.00 0.00 C ATOM 1121 CG PHE A 44 64.068 10.202 11.425 1.00 0.00 C ATOM 1122 CD1 PHE A 44 65.325 10.156 12.086 1.00 0.00 C ATOM 1123 CD2 PHE A 44 63.687 9.112 10.608 1.00 0.00 C ATOM 1124 CE1 PHE A 44 66.161 9.045 11.920 1.00 0.00 C ATOM 1125 CE2 PHE A 44 64.535 8.011 10.458 1.00 0.00 C ATOM 1126 CZ PHE A 44 65.767 7.978 11.110 1.00 0.00 C ATOM 0 H PHE A 44 62.179 13.816 11.336 1.00 0.00 H new ATOM 0 HA PHE A 44 64.202 12.525 13.069 1.00 0.00 H new ATOM 0 HB2 PHE A 44 62.337 11.143 12.316 1.00 0.00 H new ATOM 0 HB3 PHE A 44 62.604 11.588 10.643 1.00 0.00 H new ATOM 0 HD1 PHE A 44 65.635 10.977 12.716 1.00 0.00 H new ATOM 0 HD2 PHE A 44 62.736 9.131 10.097 1.00 0.00 H new ATOM 0 HE1 PHE A 44 67.117 9.013 12.422 1.00 0.00 H new ATOM 0 HE2 PHE A 44 64.235 7.182 9.834 1.00 0.00 H new ATOM 0 HZ PHE A 44 66.418 7.125 10.988 1.00 0.00 H new ATOM 1136 N LEU A 45 65.021 12.271 9.968 1.00 0.00 N ATOM 1137 CA LEU A 45 66.057 12.448 8.871 1.00 0.00 C ATOM 1138 C LEU A 45 66.905 13.722 9.122 1.00 0.00 C ATOM 1139 O LEU A 45 66.350 14.681 9.630 1.00 0.00 O ATOM 1140 CB LEU A 45 65.423 12.425 7.458 1.00 0.00 C ATOM 1141 CG LEU A 45 65.831 11.105 6.739 1.00 0.00 C ATOM 1142 CD1 LEU A 45 65.156 9.886 7.432 1.00 0.00 C ATOM 1143 CD2 LEU A 45 65.465 11.159 5.233 1.00 0.00 C ATOM 0 H LEU A 45 64.287 11.605 9.726 1.00 0.00 H new ATOM 0 HA LEU A 45 66.732 11.593 8.906 1.00 0.00 H new ATOM 0 HB2 LEU A 45 64.338 12.493 7.531 1.00 0.00 H new ATOM 0 HB3 LEU A 45 65.758 13.287 6.881 1.00 0.00 H new ATOM 0 HG LEU A 45 66.912 10.990 6.813 1.00 0.00 H new ATOM 0 HD11 LEU A 45 65.449 8.969 6.921 1.00 0.00 H new ATOM 0 HD12 LEU A 45 65.473 9.838 8.474 1.00 0.00 H new ATOM 0 HD13 LEU A 45 64.072 9.996 7.388 1.00 0.00 H new ATOM 0 HD21 LEU A 45 65.760 10.226 4.753 1.00 0.00 H new ATOM 0 HD22 LEU A 45 64.389 11.299 5.125 1.00 0.00 H new ATOM 0 HD23 LEU A 45 65.988 11.991 4.761 1.00 0.00 H new ATOM 1155 N ASP A 46 68.130 13.882 8.688 1.00 0.00 N ATOM 1156 CA ASP A 46 68.778 15.237 8.891 1.00 0.00 C ATOM 1157 C ASP A 46 68.554 16.105 7.628 1.00 0.00 C ATOM 1158 O ASP A 46 69.267 15.968 6.654 1.00 0.00 O ATOM 1159 CB ASP A 46 70.279 15.083 9.131 1.00 0.00 C ATOM 1160 CG ASP A 46 70.543 13.915 10.081 1.00 0.00 C ATOM 1161 OD1 ASP A 46 69.602 13.215 10.417 1.00 0.00 O ATOM 1162 OD2 ASP A 46 71.688 13.737 10.455 1.00 0.00 O ATOM 0 H ASP A 46 68.698 13.175 8.221 1.00 0.00 H new ATOM 0 HA ASP A 46 68.327 15.714 9.761 1.00 0.00 H new ATOM 0 HB2 ASP A 46 70.791 14.914 8.184 1.00 0.00 H new ATOM 0 HB3 ASP A 46 70.684 16.003 9.552 1.00 0.00 H new ATOM 1167 N VAL A 47 67.589 17.006 7.635 1.00 0.00 N ATOM 1168 CA VAL A 47 67.349 17.889 6.430 1.00 0.00 C ATOM 1169 C VAL A 47 67.312 19.351 6.886 1.00 0.00 C ATOM 1170 O VAL A 47 68.255 20.101 6.724 1.00 0.00 O ATOM 1171 CB VAL A 47 65.990 17.551 5.760 1.00 0.00 C ATOM 1172 CG1 VAL A 47 65.612 18.631 4.735 1.00 0.00 C ATOM 1173 CG2 VAL A 47 66.071 16.211 5.019 1.00 0.00 C ATOM 0 H VAL A 47 66.958 17.170 8.419 1.00 0.00 H new ATOM 0 HA VAL A 47 68.152 17.723 5.712 1.00 0.00 H new ATOM 0 HB VAL A 47 65.241 17.500 6.550 1.00 0.00 H new ATOM 0 HG11 VAL A 47 64.657 18.378 4.275 1.00 0.00 H new ATOM 0 HG12 VAL A 47 65.529 19.595 5.236 1.00 0.00 H new ATOM 0 HG13 VAL A 47 66.382 18.687 3.965 1.00 0.00 H new ATOM 0 HG21 VAL A 47 65.109 15.992 4.556 1.00 0.00 H new ATOM 0 HG22 VAL A 47 66.840 16.267 4.248 1.00 0.00 H new ATOM 0 HG23 VAL A 47 66.322 15.419 5.725 1.00 0.00 H new ATOM 1183 N GLN A 48 66.196 19.753 7.420 1.00 0.00 N ATOM 1184 CA GLN A 48 66.013 21.158 7.866 1.00 0.00 C ATOM 1185 C GLN A 48 67.005 21.535 8.975 1.00 0.00 C ATOM 1186 O GLN A 48 67.535 22.628 8.994 1.00 0.00 O ATOM 1187 CB GLN A 48 64.566 21.324 8.352 1.00 0.00 C ATOM 1188 CG GLN A 48 63.627 21.451 7.149 1.00 0.00 C ATOM 1189 CD GLN A 48 62.188 21.592 7.643 1.00 0.00 C ATOM 1190 OE1 GLN A 48 61.673 22.687 7.751 1.00 0.00 O ATOM 1191 NE2 GLN A 48 61.514 20.518 7.953 1.00 0.00 N ATOM 0 H GLN A 48 65.385 19.153 7.569 1.00 0.00 H new ATOM 0 HA GLN A 48 66.209 21.829 7.029 1.00 0.00 H new ATOM 0 HB2 GLN A 48 64.277 20.468 8.962 1.00 0.00 H new ATOM 0 HB3 GLN A 48 64.484 22.208 8.984 1.00 0.00 H new ATOM 0 HG2 GLN A 48 63.903 22.317 6.547 1.00 0.00 H new ATOM 0 HG3 GLN A 48 63.719 20.575 6.507 1.00 0.00 H new ATOM 0 HE21 GLN A 48 61.948 19.599 7.862 1.00 0.00 H new ATOM 0 HE22 GLN A 48 60.553 20.597 8.287 1.00 0.00 H new ATOM 1200 N LYS A 49 67.262 20.653 9.894 1.00 0.00 N ATOM 1201 CA LYS A 49 68.225 20.986 10.991 1.00 0.00 C ATOM 1202 C LYS A 49 69.599 21.152 10.352 1.00 0.00 C ATOM 1203 O LYS A 49 70.495 21.751 10.912 1.00 0.00 O ATOM 1204 CB LYS A 49 68.264 19.882 12.085 1.00 0.00 C ATOM 1205 CG LYS A 49 67.117 18.887 11.902 1.00 0.00 C ATOM 1206 CD LYS A 49 65.771 19.576 12.149 1.00 0.00 C ATOM 1207 CE LYS A 49 64.664 18.717 11.548 1.00 0.00 C ATOM 1208 NZ LYS A 49 63.335 19.316 11.869 1.00 0.00 N ATOM 0 H LYS A 49 66.853 19.720 9.939 1.00 0.00 H new ATOM 0 HA LYS A 49 67.910 21.903 11.490 1.00 0.00 H new ATOM 0 HB2 LYS A 49 69.217 19.355 12.041 1.00 0.00 H new ATOM 0 HB3 LYS A 49 68.198 20.341 13.072 1.00 0.00 H new ATOM 0 HG2 LYS A 49 67.142 18.474 10.894 1.00 0.00 H new ATOM 0 HG3 LYS A 49 67.238 18.052 12.592 1.00 0.00 H new ATOM 0 HD2 LYS A 49 65.606 19.711 13.218 1.00 0.00 H new ATOM 0 HD3 LYS A 49 65.766 20.568 11.698 1.00 0.00 H new ATOM 0 HE2 LYS A 49 64.791 18.646 10.468 1.00 0.00 H new ATOM 0 HE3 LYS A 49 64.722 17.703 11.943 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 62.647 19.048 11.137 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 63.011 18.966 12.793 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 63.420 20.352 11.901 1.00 0.00 H new ATOM 1222 N ASP A 50 69.755 20.642 9.170 1.00 0.00 N ATOM 1223 CA ASP A 50 71.047 20.776 8.456 1.00 0.00 C ATOM 1224 C ASP A 50 70.760 20.886 6.965 1.00 0.00 C ATOM 1225 O ASP A 50 70.736 19.904 6.254 1.00 0.00 O ATOM 1226 CB ASP A 50 71.917 19.547 8.730 1.00 0.00 C ATOM 1227 CG ASP A 50 72.488 19.629 10.148 1.00 0.00 C ATOM 1228 OD1 ASP A 50 72.651 20.733 10.639 1.00 0.00 O ATOM 1229 OD2 ASP A 50 72.754 18.583 10.718 1.00 0.00 O ATOM 0 H ASP A 50 69.033 20.131 8.661 1.00 0.00 H new ATOM 0 HA ASP A 50 71.578 21.663 8.800 1.00 0.00 H new ATOM 0 HB2 ASP A 50 71.326 18.638 8.617 1.00 0.00 H new ATOM 0 HB3 ASP A 50 72.727 19.493 8.003 1.00 0.00 H new ATOM 1234 N ALA A 51 70.554 22.077 6.475 1.00 0.00 N ATOM 1235 CA ALA A 51 70.283 22.227 5.024 1.00 0.00 C ATOM 1236 C ALA A 51 71.456 21.592 4.287 1.00 0.00 C ATOM 1237 O ALA A 51 71.310 20.993 3.242 1.00 0.00 O ATOM 1238 CB ALA A 51 70.158 23.709 4.681 1.00 0.00 C ATOM 0 H ALA A 51 70.562 22.943 7.013 1.00 0.00 H new ATOM 0 HA ALA A 51 69.351 21.742 4.735 1.00 0.00 H new ATOM 0 HB1 ALA A 51 69.959 23.820 3.615 1.00 0.00 H new ATOM 0 HB2 ALA A 51 69.338 24.146 5.251 1.00 0.00 H new ATOM 0 HB3 ALA A 51 71.087 24.220 4.932 1.00 0.00 H new ATOM 1244 N ASP A 52 72.610 21.672 4.878 1.00 0.00 N ATOM 1245 CA ASP A 52 73.808 21.030 4.289 1.00 0.00 C ATOM 1246 C ASP A 52 73.540 19.528 4.185 1.00 0.00 C ATOM 1247 O ASP A 52 73.939 18.881 3.245 1.00 0.00 O ATOM 1248 CB ASP A 52 75.005 21.249 5.220 1.00 0.00 C ATOM 1249 CG ASP A 52 75.415 22.722 5.194 1.00 0.00 C ATOM 1250 OD1 ASP A 52 75.096 23.387 4.224 1.00 0.00 O ATOM 1251 OD2 ASP A 52 76.037 23.160 6.148 1.00 0.00 O ATOM 0 H ASP A 52 72.775 22.162 5.757 1.00 0.00 H new ATOM 0 HA ASP A 52 74.020 21.455 3.308 1.00 0.00 H new ATOM 0 HB2 ASP A 52 74.747 20.951 6.236 1.00 0.00 H new ATOM 0 HB3 ASP A 52 75.841 20.623 4.907 1.00 0.00 H new ATOM 1256 N ALA A 53 72.909 18.966 5.177 1.00 0.00 N ATOM 1257 CA ALA A 53 72.674 17.492 5.153 1.00 0.00 C ATOM 1258 C ALA A 53 71.875 17.102 3.901 1.00 0.00 C ATOM 1259 O ALA A 53 72.159 16.099 3.276 1.00 0.00 O ATOM 1260 CB ALA A 53 71.941 17.038 6.423 1.00 0.00 C ATOM 0 H ALA A 53 72.548 19.455 5.996 1.00 0.00 H new ATOM 0 HA ALA A 53 73.640 16.989 5.121 1.00 0.00 H new ATOM 0 HB1 ALA A 53 71.780 15.961 6.385 1.00 0.00 H new ATOM 0 HB2 ALA A 53 72.543 17.284 7.298 1.00 0.00 H new ATOM 0 HB3 ALA A 53 70.979 17.546 6.489 1.00 0.00 H new ATOM 1266 N VAL A 54 70.901 17.874 3.509 1.00 0.00 N ATOM 1267 CA VAL A 54 70.134 17.509 2.280 1.00 0.00 C ATOM 1268 C VAL A 54 71.105 17.474 1.088 1.00 0.00 C ATOM 1269 O VAL A 54 71.009 16.640 0.217 1.00 0.00 O ATOM 1270 CB VAL A 54 68.984 18.534 2.044 1.00 0.00 C ATOM 1271 CG1 VAL A 54 69.393 19.636 1.045 1.00 0.00 C ATOM 1272 CG2 VAL A 54 67.742 17.811 1.497 1.00 0.00 C ATOM 0 H VAL A 54 70.604 18.730 3.976 1.00 0.00 H new ATOM 0 HA VAL A 54 69.679 16.525 2.396 1.00 0.00 H new ATOM 0 HB VAL A 54 68.764 19.000 3.004 1.00 0.00 H new ATOM 0 HG11 VAL A 54 68.563 20.330 0.909 1.00 0.00 H new ATOM 0 HG12 VAL A 54 70.257 20.176 1.432 1.00 0.00 H new ATOM 0 HG13 VAL A 54 69.648 19.182 0.087 1.00 0.00 H new ATOM 0 HG21 VAL A 54 66.942 18.534 1.335 1.00 0.00 H new ATOM 0 HG22 VAL A 54 67.990 17.326 0.553 1.00 0.00 H new ATOM 0 HG23 VAL A 54 67.412 17.060 2.215 1.00 0.00 H new ATOM 1282 N ASP A 55 72.014 18.406 1.047 1.00 0.00 N ATOM 1283 CA ASP A 55 72.991 18.490 -0.082 1.00 0.00 C ATOM 1284 C ASP A 55 73.884 17.247 -0.131 1.00 0.00 C ATOM 1285 O ASP A 55 74.188 16.745 -1.189 1.00 0.00 O ATOM 1286 CB ASP A 55 73.876 19.723 0.112 1.00 0.00 C ATOM 1287 CG ASP A 55 73.049 20.989 -0.115 1.00 0.00 C ATOM 1288 OD1 ASP A 55 72.020 20.895 -0.764 1.00 0.00 O ATOM 1289 OD2 ASP A 55 73.457 22.032 0.369 1.00 0.00 O ATOM 0 H ASP A 55 72.126 19.128 1.759 1.00 0.00 H new ATOM 0 HA ASP A 55 72.433 18.558 -1.016 1.00 0.00 H new ATOM 0 HB2 ASP A 55 74.297 19.727 1.118 1.00 0.00 H new ATOM 0 HB3 ASP A 55 74.714 19.694 -0.584 1.00 0.00 H new ATOM 1294 N LYS A 56 74.315 16.748 0.996 1.00 0.00 N ATOM 1295 CA LYS A 56 75.187 15.540 0.983 1.00 0.00 C ATOM 1296 C LYS A 56 74.403 14.381 0.369 1.00 0.00 C ATOM 1297 O LYS A 56 74.927 13.597 -0.393 1.00 0.00 O ATOM 1298 CB LYS A 56 75.610 15.196 2.426 1.00 0.00 C ATOM 1299 CG LYS A 56 76.889 15.960 2.807 1.00 0.00 C ATOM 1300 CD LYS A 56 76.604 17.461 2.891 1.00 0.00 C ATOM 1301 CE LYS A 56 77.895 18.208 3.236 1.00 0.00 C ATOM 1302 NZ LYS A 56 78.921 17.937 2.189 1.00 0.00 N ATOM 0 H LYS A 56 74.102 17.123 1.920 1.00 0.00 H new ATOM 0 HA LYS A 56 76.084 15.726 0.393 1.00 0.00 H new ATOM 0 HB2 LYS A 56 74.807 15.451 3.118 1.00 0.00 H new ATOM 0 HB3 LYS A 56 75.779 14.123 2.516 1.00 0.00 H new ATOM 0 HG2 LYS A 56 77.265 15.600 3.765 1.00 0.00 H new ATOM 0 HG3 LYS A 56 77.668 15.771 2.068 1.00 0.00 H new ATOM 0 HD2 LYS A 56 76.206 17.820 1.942 1.00 0.00 H new ATOM 0 HD3 LYS A 56 75.845 17.656 3.649 1.00 0.00 H new ATOM 0 HE2 LYS A 56 77.702 19.279 3.302 1.00 0.00 H new ATOM 0 HE3 LYS A 56 78.262 17.889 4.211 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 79.625 18.703 2.186 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 79.394 17.033 2.392 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 78.461 17.886 1.257 1.00 0.00 H new ATOM 1316 N ILE A 57 73.151 14.280 0.695 1.00 0.00 N ATOM 1317 CA ILE A 57 72.309 13.189 0.137 1.00 0.00 C ATOM 1318 C ILE A 57 72.188 13.329 -1.394 1.00 0.00 C ATOM 1319 O ILE A 57 72.335 12.369 -2.124 1.00 0.00 O ATOM 1320 CB ILE A 57 70.928 13.268 0.807 1.00 0.00 C ATOM 1321 CG1 ILE A 57 71.008 12.804 2.282 1.00 0.00 C ATOM 1322 CG2 ILE A 57 69.918 12.417 0.045 1.00 0.00 C ATOM 1323 CD1 ILE A 57 71.572 11.378 2.400 1.00 0.00 C ATOM 0 H ILE A 57 72.667 14.913 1.332 1.00 0.00 H new ATOM 0 HA ILE A 57 72.764 12.219 0.338 1.00 0.00 H new ATOM 0 HB ILE A 57 70.599 14.307 0.788 1.00 0.00 H new ATOM 0 HG12 ILE A 57 71.637 13.492 2.846 1.00 0.00 H new ATOM 0 HG13 ILE A 57 70.015 12.841 2.729 1.00 0.00 H new ATOM 0 HG21 ILE A 57 68.945 12.484 0.532 1.00 0.00 H new ATOM 0 HG22 ILE A 57 69.836 12.780 -0.980 1.00 0.00 H new ATOM 0 HG23 ILE A 57 70.250 11.379 0.037 1.00 0.00 H new ATOM 0 HD11 ILE A 57 71.613 11.089 3.450 1.00 0.00 H new ATOM 0 HD12 ILE A 57 70.928 10.686 1.857 1.00 0.00 H new ATOM 0 HD13 ILE A 57 72.576 11.348 1.976 1.00 0.00 H new ATOM 1335 N MET A 58 71.916 14.507 -1.882 1.00 0.00 N ATOM 1336 CA MET A 58 71.779 14.693 -3.361 1.00 0.00 C ATOM 1337 C MET A 58 73.077 14.293 -4.038 1.00 0.00 C ATOM 1338 O MET A 58 73.076 13.683 -5.083 1.00 0.00 O ATOM 1339 CB MET A 58 71.473 16.165 -3.687 1.00 0.00 C ATOM 1340 CG MET A 58 69.974 16.381 -3.735 1.00 0.00 C ATOM 1341 SD MET A 58 69.319 15.569 -5.217 1.00 0.00 S ATOM 1342 CE MET A 58 69.434 16.967 -6.357 1.00 0.00 C ATOM 0 H MET A 58 71.782 15.351 -1.325 1.00 0.00 H new ATOM 0 HA MET A 58 70.961 14.070 -3.722 1.00 0.00 H new ATOM 0 HB2 MET A 58 71.919 16.814 -2.933 1.00 0.00 H new ATOM 0 HB3 MET A 58 71.919 16.435 -4.644 1.00 0.00 H new ATOM 0 HG2 MET A 58 69.504 15.972 -2.841 1.00 0.00 H new ATOM 0 HG3 MET A 58 69.746 17.447 -3.756 1.00 0.00 H new ATOM 0 HE1 MET A 58 68.913 16.725 -7.283 1.00 0.00 H new ATOM 0 HE2 MET A 58 68.977 17.846 -5.902 1.00 0.00 H new ATOM 0 HE3 MET A 58 70.482 17.174 -6.574 1.00 0.00 H new ATOM 1352 N LYS A 59 74.171 14.621 -3.464 1.00 0.00 N ATOM 1353 CA LYS A 59 75.457 14.242 -4.101 1.00 0.00 C ATOM 1354 C LYS A 59 75.494 12.722 -4.212 1.00 0.00 C ATOM 1355 O LYS A 59 75.806 12.156 -5.239 1.00 0.00 O ATOM 1356 CB LYS A 59 76.618 14.745 -3.237 1.00 0.00 C ATOM 1357 CG LYS A 59 77.968 14.360 -3.870 1.00 0.00 C ATOM 1358 CD LYS A 59 78.189 15.108 -5.216 1.00 0.00 C ATOM 1359 CE LYS A 59 78.081 14.135 -6.401 1.00 0.00 C ATOM 1360 NZ LYS A 59 79.141 13.091 -6.287 1.00 0.00 N ATOM 0 H LYS A 59 74.246 15.133 -2.585 1.00 0.00 H new ATOM 0 HA LYS A 59 75.548 14.687 -5.092 1.00 0.00 H new ATOM 0 HB2 LYS A 59 76.556 15.828 -3.129 1.00 0.00 H new ATOM 0 HB3 LYS A 59 76.545 14.320 -2.236 1.00 0.00 H new ATOM 0 HG2 LYS A 59 78.778 14.599 -3.180 1.00 0.00 H new ATOM 0 HG3 LYS A 59 78.000 13.284 -4.039 1.00 0.00 H new ATOM 0 HD2 LYS A 59 77.450 15.902 -5.322 1.00 0.00 H new ATOM 0 HD3 LYS A 59 79.170 15.583 -5.217 1.00 0.00 H new ATOM 0 HE2 LYS A 59 77.096 13.668 -6.413 1.00 0.00 H new ATOM 0 HE3 LYS A 59 78.189 14.677 -7.341 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 79.404 12.758 -7.237 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 79.977 13.495 -5.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 78.782 12.291 -5.727 1.00 0.00 H new ATOM 1374 N GLU A 60 75.155 12.063 -3.154 1.00 0.00 N ATOM 1375 CA GLU A 60 75.141 10.585 -3.159 1.00 0.00 C ATOM 1376 C GLU A 60 74.098 10.095 -4.168 1.00 0.00 C ATOM 1377 O GLU A 60 74.236 9.043 -4.760 1.00 0.00 O ATOM 1378 CB GLU A 60 74.783 10.096 -1.759 1.00 0.00 C ATOM 1379 CG GLU A 60 74.799 8.575 -1.732 1.00 0.00 C ATOM 1380 CD GLU A 60 74.473 8.095 -0.320 1.00 0.00 C ATOM 1381 OE1 GLU A 60 74.322 8.941 0.547 1.00 0.00 O ATOM 1382 OE2 GLU A 60 74.382 6.894 -0.128 1.00 0.00 O ATOM 0 H GLU A 60 74.882 12.492 -2.270 1.00 0.00 H new ATOM 0 HA GLU A 60 76.119 10.197 -3.442 1.00 0.00 H new ATOM 0 HB2 GLU A 60 75.493 10.490 -1.032 1.00 0.00 H new ATOM 0 HB3 GLU A 60 73.798 10.465 -1.475 1.00 0.00 H new ATOM 0 HG2 GLU A 60 74.072 8.179 -2.441 1.00 0.00 H new ATOM 0 HG3 GLU A 60 75.777 8.204 -2.038 1.00 0.00 H new ATOM 1389 N LEU A 61 73.040 10.842 -4.347 1.00 0.00 N ATOM 1390 CA LEU A 61 71.965 10.414 -5.302 1.00 0.00 C ATOM 1391 C LEU A 61 72.197 11.022 -6.681 1.00 0.00 C ATOM 1392 O LEU A 61 71.640 10.576 -7.664 1.00 0.00 O ATOM 1393 CB LEU A 61 70.599 10.904 -4.807 1.00 0.00 C ATOM 1394 CG LEU A 61 70.192 10.232 -3.484 1.00 0.00 C ATOM 1395 CD1 LEU A 61 68.741 10.626 -3.156 1.00 0.00 C ATOM 1396 CD2 LEU A 61 70.288 8.696 -3.593 1.00 0.00 C ATOM 0 H LEU A 61 72.870 11.730 -3.875 1.00 0.00 H new ATOM 0 HA LEU A 61 71.989 9.326 -5.362 1.00 0.00 H new ATOM 0 HB2 LEU A 61 70.629 11.985 -4.671 1.00 0.00 H new ATOM 0 HB3 LEU A 61 69.843 10.699 -5.565 1.00 0.00 H new ATOM 0 HG LEU A 61 70.868 10.564 -2.697 1.00 0.00 H new ATOM 0 HD11 LEU A 61 68.439 10.156 -2.220 1.00 0.00 H new ATOM 0 HD12 LEU A 61 68.672 11.709 -3.057 1.00 0.00 H new ATOM 0 HD13 LEU A 61 68.083 10.292 -3.958 1.00 0.00 H new ATOM 0 HD21 LEU A 61 69.995 8.245 -2.645 1.00 0.00 H new ATOM 0 HD22 LEU A 61 69.623 8.345 -4.382 1.00 0.00 H new ATOM 0 HD23 LEU A 61 71.313 8.411 -3.829 1.00 0.00 H new ATOM 1408 N ASP A 62 73.006 12.032 -6.772 1.00 0.00 N ATOM 1409 CA ASP A 62 73.253 12.650 -8.097 1.00 0.00 C ATOM 1410 C ASP A 62 74.214 11.753 -8.852 1.00 0.00 C ATOM 1411 O ASP A 62 75.161 12.202 -9.469 1.00 0.00 O ATOM 1412 CB ASP A 62 73.857 14.041 -7.909 1.00 0.00 C ATOM 1413 CG ASP A 62 72.787 14.975 -7.344 1.00 0.00 C ATOM 1414 OD1 ASP A 62 71.617 14.651 -7.480 1.00 0.00 O ATOM 1415 OD2 ASP A 62 73.154 15.997 -6.786 1.00 0.00 O ATOM 0 H ASP A 62 73.506 12.456 -5.990 1.00 0.00 H new ATOM 0 HA ASP A 62 72.323 12.756 -8.656 1.00 0.00 H new ATOM 0 HB2 ASP A 62 74.710 13.993 -7.232 1.00 0.00 H new ATOM 0 HB3 ASP A 62 74.226 14.423 -8.861 1.00 0.00 H new ATOM 1420 N GLU A 63 73.990 10.473 -8.777 1.00 0.00 N ATOM 1421 CA GLU A 63 74.908 9.533 -9.461 1.00 0.00 C ATOM 1422 C GLU A 63 74.905 9.836 -10.948 1.00 0.00 C ATOM 1423 O GLU A 63 75.932 9.850 -11.596 1.00 0.00 O ATOM 1424 CB GLU A 63 74.442 8.101 -9.225 1.00 0.00 C ATOM 1425 CG GLU A 63 74.676 7.721 -7.762 1.00 0.00 C ATOM 1426 CD GLU A 63 74.110 6.324 -7.501 1.00 0.00 C ATOM 1427 OE1 GLU A 63 73.550 5.752 -8.423 1.00 0.00 O ATOM 1428 OE2 GLU A 63 74.245 5.850 -6.385 1.00 0.00 O ATOM 0 H GLU A 63 73.215 10.041 -8.274 1.00 0.00 H new ATOM 0 HA GLU A 63 75.917 9.647 -9.066 1.00 0.00 H new ATOM 0 HB2 GLU A 63 73.384 8.007 -9.471 1.00 0.00 H new ATOM 0 HB3 GLU A 63 74.984 7.419 -9.880 1.00 0.00 H new ATOM 0 HG2 GLU A 63 75.742 7.741 -7.536 1.00 0.00 H new ATOM 0 HG3 GLU A 63 74.197 8.447 -7.105 1.00 0.00 H new ATOM 1435 N ASN A 64 73.758 10.110 -11.490 1.00 0.00 N ATOM 1436 CA ASN A 64 73.699 10.448 -12.926 1.00 0.00 C ATOM 1437 C ASN A 64 74.236 11.864 -13.077 1.00 0.00 C ATOM 1438 O ASN A 64 74.602 12.294 -14.153 1.00 0.00 O ATOM 1439 CB ASN A 64 72.249 10.384 -13.414 1.00 0.00 C ATOM 1440 CG ASN A 64 71.785 8.927 -13.436 1.00 0.00 C ATOM 1441 OD1 ASN A 64 70.792 8.585 -12.826 1.00 0.00 O ATOM 1442 ND2 ASN A 64 72.467 8.047 -14.117 1.00 0.00 N ATOM 0 H ASN A 64 72.863 10.114 -11.001 1.00 0.00 H new ATOM 0 HA ASN A 64 74.288 9.746 -13.516 1.00 0.00 H new ATOM 0 HB2 ASN A 64 71.607 10.972 -12.758 1.00 0.00 H new ATOM 0 HB3 ASN A 64 72.170 10.818 -14.411 1.00 0.00 H new ATOM 0 HD21 ASN A 64 72.166 7.073 -14.137 1.00 0.00 H new ATOM 0 HD22 ASN A 64 73.301 8.334 -14.630 1.00 0.00 H new ATOM 1449 N GLY A 65 74.260 12.605 -11.996 1.00 0.00 N ATOM 1450 CA GLY A 65 74.745 14.008 -12.068 1.00 0.00 C ATOM 1451 C GLY A 65 73.695 14.826 -12.803 1.00 0.00 C ATOM 1452 O GLY A 65 74.007 15.730 -13.554 1.00 0.00 O ATOM 0 H GLY A 65 73.964 12.295 -11.071 1.00 0.00 H new ATOM 0 HA2 GLY A 65 74.909 14.407 -11.067 1.00 0.00 H new ATOM 0 HA3 GLY A 65 75.701 14.055 -12.590 1.00 0.00 H new ATOM 1456 N ASP A 66 72.439 14.479 -12.630 1.00 0.00 N ATOM 1457 CA ASP A 66 71.352 15.209 -13.369 1.00 0.00 C ATOM 1458 C ASP A 66 70.765 16.369 -12.540 1.00 0.00 C ATOM 1459 O ASP A 66 69.979 17.151 -13.035 1.00 0.00 O ATOM 1460 CB ASP A 66 70.238 14.213 -13.697 1.00 0.00 C ATOM 1461 CG ASP A 66 69.687 13.616 -12.400 1.00 0.00 C ATOM 1462 OD1 ASP A 66 70.341 13.759 -11.379 1.00 0.00 O ATOM 1463 OD2 ASP A 66 68.624 13.020 -12.450 1.00 0.00 O ATOM 0 H ASP A 66 72.120 13.730 -12.016 1.00 0.00 H new ATOM 0 HA ASP A 66 71.781 15.636 -14.275 1.00 0.00 H new ATOM 0 HB2 ASP A 66 69.440 14.712 -14.247 1.00 0.00 H new ATOM 0 HB3 ASP A 66 70.622 13.421 -14.340 1.00 0.00 H new ATOM 1468 N GLY A 67 71.128 16.486 -11.285 1.00 0.00 N ATOM 1469 CA GLY A 67 70.570 17.597 -10.440 1.00 0.00 C ATOM 1470 C GLY A 67 69.106 17.293 -10.081 1.00 0.00 C ATOM 1471 O GLY A 67 68.372 18.142 -9.542 1.00 0.00 O ATOM 0 H GLY A 67 71.783 15.866 -10.809 1.00 0.00 H new ATOM 0 HA2 GLY A 67 71.162 17.707 -9.531 1.00 0.00 H new ATOM 0 HA3 GLY A 67 70.633 18.543 -10.978 1.00 0.00 H new ATOM 1475 N GLU A 68 68.665 16.077 -10.342 1.00 0.00 N ATOM 1476 CA GLU A 68 67.266 15.677 -10.022 1.00 0.00 C ATOM 1477 C GLU A 68 67.346 14.319 -9.319 1.00 0.00 C ATOM 1478 O GLU A 68 68.411 13.738 -9.247 1.00 0.00 O ATOM 1479 CB GLU A 68 66.497 15.546 -11.340 1.00 0.00 C ATOM 1480 CG GLU A 68 66.189 16.939 -11.893 1.00 0.00 C ATOM 1481 CD GLU A 68 65.647 16.820 -13.319 1.00 0.00 C ATOM 1482 OE1 GLU A 68 64.452 16.619 -13.463 1.00 0.00 O ATOM 1483 OE2 GLU A 68 66.436 16.934 -14.242 1.00 0.00 O ATOM 0 H GLU A 68 69.230 15.342 -10.769 1.00 0.00 H new ATOM 0 HA GLU A 68 66.761 16.404 -9.386 1.00 0.00 H new ATOM 0 HB2 GLU A 68 67.085 14.979 -12.061 1.00 0.00 H new ATOM 0 HB3 GLU A 68 65.571 14.994 -11.179 1.00 0.00 H new ATOM 0 HG2 GLU A 68 65.459 17.440 -11.257 1.00 0.00 H new ATOM 0 HG3 GLU A 68 67.091 17.551 -11.886 1.00 0.00 H new ATOM 1490 N VAL A 69 66.264 13.795 -8.809 1.00 0.00 N ATOM 1491 CA VAL A 69 66.331 12.458 -8.128 1.00 0.00 C ATOM 1492 C VAL A 69 65.255 11.552 -8.718 1.00 0.00 C ATOM 1493 O VAL A 69 64.099 11.898 -8.773 1.00 0.00 O ATOM 1494 CB VAL A 69 66.131 12.666 -6.622 1.00 0.00 C ATOM 1495 CG1 VAL A 69 66.529 11.425 -5.840 1.00 0.00 C ATOM 1496 CG2 VAL A 69 67.004 13.834 -6.180 1.00 0.00 C ATOM 0 H VAL A 69 65.340 14.227 -8.831 1.00 0.00 H new ATOM 0 HA VAL A 69 67.300 11.983 -8.284 1.00 0.00 H new ATOM 0 HB VAL A 69 65.078 12.869 -6.428 1.00 0.00 H new ATOM 0 HG11 VAL A 69 66.377 11.601 -4.775 1.00 0.00 H new ATOM 0 HG12 VAL A 69 65.917 10.582 -6.159 1.00 0.00 H new ATOM 0 HG13 VAL A 69 67.580 11.200 -6.024 1.00 0.00 H new ATOM 0 HG21 VAL A 69 66.876 13.999 -5.110 1.00 0.00 H new ATOM 0 HG22 VAL A 69 68.049 13.607 -6.390 1.00 0.00 H new ATOM 0 HG23 VAL A 69 66.712 14.733 -6.723 1.00 0.00 H new ATOM 1506 N ASP A 70 65.636 10.386 -9.163 1.00 0.00 N ATOM 1507 CA ASP A 70 64.646 9.443 -9.761 1.00 0.00 C ATOM 1508 C ASP A 70 64.136 8.502 -8.670 1.00 0.00 C ATOM 1509 O ASP A 70 64.787 8.271 -7.671 1.00 0.00 O ATOM 1510 CB ASP A 70 65.311 8.629 -10.872 1.00 0.00 C ATOM 1511 CG ASP A 70 65.694 9.556 -12.024 1.00 0.00 C ATOM 1512 OD1 ASP A 70 65.268 10.698 -12.003 1.00 0.00 O ATOM 1513 OD2 ASP A 70 66.413 9.111 -12.903 1.00 0.00 O ATOM 0 H ASP A 70 66.596 10.043 -9.138 1.00 0.00 H new ATOM 0 HA ASP A 70 63.813 10.005 -10.184 1.00 0.00 H new ATOM 0 HB2 ASP A 70 66.197 8.125 -10.487 1.00 0.00 H new ATOM 0 HB3 ASP A 70 64.631 7.854 -11.226 1.00 0.00 H new ATOM 1518 N PHE A 71 62.957 7.972 -8.852 1.00 0.00 N ATOM 1519 CA PHE A 71 62.374 7.062 -7.830 1.00 0.00 C ATOM 1520 C PHE A 71 63.370 5.942 -7.508 1.00 0.00 C ATOM 1521 O PHE A 71 63.319 5.340 -6.457 1.00 0.00 O ATOM 1522 CB PHE A 71 61.068 6.482 -8.380 1.00 0.00 C ATOM 1523 CG PHE A 71 60.264 5.848 -7.263 1.00 0.00 C ATOM 1524 CD1 PHE A 71 59.799 6.629 -6.196 1.00 0.00 C ATOM 1525 CD2 PHE A 71 59.979 4.480 -7.298 1.00 0.00 C ATOM 1526 CE1 PHE A 71 59.054 6.040 -5.168 1.00 0.00 C ATOM 1527 CE2 PHE A 71 59.233 3.890 -6.271 1.00 0.00 C ATOM 1528 CZ PHE A 71 58.771 4.670 -5.205 1.00 0.00 C ATOM 0 H PHE A 71 62.370 8.133 -9.671 1.00 0.00 H new ATOM 0 HA PHE A 71 62.166 7.609 -6.910 1.00 0.00 H new ATOM 0 HB2 PHE A 71 60.484 7.270 -8.856 1.00 0.00 H new ATOM 0 HB3 PHE A 71 61.286 5.739 -9.147 1.00 0.00 H new ATOM 0 HD1 PHE A 71 60.016 7.687 -6.167 1.00 0.00 H new ATOM 0 HD2 PHE A 71 60.335 3.877 -8.120 1.00 0.00 H new ATOM 0 HE1 PHE A 71 58.697 6.643 -4.346 1.00 0.00 H new ATOM 0 HE2 PHE A 71 59.014 2.833 -6.301 1.00 0.00 H new ATOM 0 HZ PHE A 71 58.197 4.215 -4.412 1.00 0.00 H new ATOM 1538 N GLN A 72 64.287 5.675 -8.395 1.00 0.00 N ATOM 1539 CA GLN A 72 65.308 4.617 -8.129 1.00 0.00 C ATOM 1540 C GLN A 72 66.372 5.196 -7.188 1.00 0.00 C ATOM 1541 O GLN A 72 67.042 4.491 -6.455 1.00 0.00 O ATOM 1542 CB GLN A 72 65.962 4.197 -9.453 1.00 0.00 C ATOM 1543 CG GLN A 72 66.696 2.861 -9.283 1.00 0.00 C ATOM 1544 CD GLN A 72 67.967 3.075 -8.458 1.00 0.00 C ATOM 1545 OE1 GLN A 72 68.212 2.366 -7.502 1.00 0.00 O ATOM 1546 NE2 GLN A 72 68.792 4.032 -8.787 1.00 0.00 N ATOM 0 H GLN A 72 64.376 6.144 -9.296 1.00 0.00 H new ATOM 0 HA GLN A 72 64.840 3.746 -7.671 1.00 0.00 H new ATOM 0 HB2 GLN A 72 65.202 4.106 -10.229 1.00 0.00 H new ATOM 0 HB3 GLN A 72 66.662 4.965 -9.781 1.00 0.00 H new ATOM 0 HG2 GLN A 72 66.047 2.138 -8.789 1.00 0.00 H new ATOM 0 HG3 GLN A 72 66.949 2.447 -10.259 1.00 0.00 H new ATOM 0 HE21 GLN A 72 68.588 4.628 -9.589 1.00 0.00 H new ATOM 0 HE22 GLN A 72 69.641 4.184 -8.242 1.00 0.00 H new ATOM 1555 N GLU A 73 66.491 6.492 -7.195 1.00 0.00 N ATOM 1556 CA GLU A 73 67.467 7.164 -6.311 1.00 0.00 C ATOM 1557 C GLU A 73 66.834 7.387 -4.938 1.00 0.00 C ATOM 1558 O GLU A 73 67.407 7.087 -3.913 1.00 0.00 O ATOM 1559 CB GLU A 73 67.837 8.517 -6.907 1.00 0.00 C ATOM 1560 CG GLU A 73 68.679 8.332 -8.174 1.00 0.00 C ATOM 1561 CD GLU A 73 69.197 9.699 -8.638 1.00 0.00 C ATOM 1562 OE1 GLU A 73 69.135 10.628 -7.852 1.00 0.00 O ATOM 1563 OE2 GLU A 73 69.648 9.795 -9.768 1.00 0.00 O ATOM 0 H GLU A 73 65.944 7.119 -7.785 1.00 0.00 H new ATOM 0 HA GLU A 73 68.358 6.544 -6.214 1.00 0.00 H new ATOM 0 HB2 GLU A 73 66.932 9.077 -7.143 1.00 0.00 H new ATOM 0 HB3 GLU A 73 68.393 9.103 -6.176 1.00 0.00 H new ATOM 0 HG2 GLU A 73 69.515 7.661 -7.975 1.00 0.00 H new ATOM 0 HG3 GLU A 73 68.080 7.871 -8.959 1.00 0.00 H new ATOM 1570 N PHE A 74 65.643 7.933 -4.931 1.00 0.00 N ATOM 1571 CA PHE A 74 64.930 8.213 -3.650 1.00 0.00 C ATOM 1572 C PHE A 74 64.700 6.926 -2.852 1.00 0.00 C ATOM 1573 O PHE A 74 64.975 6.860 -1.674 1.00 0.00 O ATOM 1574 CB PHE A 74 63.580 8.881 -3.963 1.00 0.00 C ATOM 1575 CG PHE A 74 62.695 8.922 -2.725 1.00 0.00 C ATOM 1576 CD1 PHE A 74 63.202 9.370 -1.495 1.00 0.00 C ATOM 1577 CD2 PHE A 74 61.359 8.501 -2.812 1.00 0.00 C ATOM 1578 CE1 PHE A 74 62.377 9.394 -0.365 1.00 0.00 C ATOM 1579 CE2 PHE A 74 60.537 8.528 -1.679 1.00 0.00 C ATOM 1580 CZ PHE A 74 61.047 8.973 -0.456 1.00 0.00 C ATOM 0 H PHE A 74 65.129 8.199 -5.771 1.00 0.00 H new ATOM 0 HA PHE A 74 65.546 8.878 -3.044 1.00 0.00 H new ATOM 0 HB2 PHE A 74 63.747 9.894 -4.329 1.00 0.00 H new ATOM 0 HB3 PHE A 74 63.074 8.334 -4.759 1.00 0.00 H new ATOM 0 HD1 PHE A 74 64.229 9.696 -1.421 1.00 0.00 H new ATOM 0 HD2 PHE A 74 60.964 8.155 -3.756 1.00 0.00 H new ATOM 0 HE1 PHE A 74 62.769 9.739 0.580 1.00 0.00 H new ATOM 0 HE2 PHE A 74 59.509 8.205 -1.750 1.00 0.00 H new ATOM 0 HZ PHE A 74 60.414 8.992 0.419 1.00 0.00 H new ATOM 1590 N VAL A 75 64.178 5.917 -3.477 1.00 0.00 N ATOM 1591 CA VAL A 75 63.905 4.645 -2.753 1.00 0.00 C ATOM 1592 C VAL A 75 65.214 4.086 -2.186 1.00 0.00 C ATOM 1593 O VAL A 75 65.257 3.605 -1.075 1.00 0.00 O ATOM 1594 CB VAL A 75 63.240 3.654 -3.709 1.00 0.00 C ATOM 1595 CG1 VAL A 75 63.186 2.260 -3.074 1.00 0.00 C ATOM 1596 CG2 VAL A 75 61.816 4.134 -4.021 1.00 0.00 C ATOM 0 H VAL A 75 63.925 5.914 -4.465 1.00 0.00 H new ATOM 0 HA VAL A 75 63.227 4.823 -1.919 1.00 0.00 H new ATOM 0 HB VAL A 75 63.821 3.597 -4.629 1.00 0.00 H new ATOM 0 HG11 VAL A 75 62.710 1.564 -3.765 1.00 0.00 H new ATOM 0 HG12 VAL A 75 64.198 1.920 -2.856 1.00 0.00 H new ATOM 0 HG13 VAL A 75 62.611 2.304 -2.149 1.00 0.00 H new ATOM 0 HG21 VAL A 75 61.336 3.431 -4.702 1.00 0.00 H new ATOM 0 HG22 VAL A 75 61.241 4.193 -3.097 1.00 0.00 H new ATOM 0 HG23 VAL A 75 61.858 5.119 -4.486 1.00 0.00 H new ATOM 1606 N VAL A 76 66.286 4.193 -2.909 1.00 0.00 N ATOM 1607 CA VAL A 76 67.587 3.716 -2.363 1.00 0.00 C ATOM 1608 C VAL A 76 67.912 4.498 -1.070 1.00 0.00 C ATOM 1609 O VAL A 76 68.451 3.960 -0.126 1.00 0.00 O ATOM 1610 CB VAL A 76 68.692 3.954 -3.403 1.00 0.00 C ATOM 1611 CG1 VAL A 76 70.064 3.702 -2.767 1.00 0.00 C ATOM 1612 CG2 VAL A 76 68.497 2.997 -4.594 1.00 0.00 C ATOM 0 H VAL A 76 66.323 4.587 -3.849 1.00 0.00 H new ATOM 0 HA VAL A 76 67.526 2.651 -2.138 1.00 0.00 H new ATOM 0 HB VAL A 76 68.638 4.985 -3.752 1.00 0.00 H new ATOM 0 HG11 VAL A 76 70.845 3.872 -3.508 1.00 0.00 H new ATOM 0 HG12 VAL A 76 70.206 4.382 -1.927 1.00 0.00 H new ATOM 0 HG13 VAL A 76 70.117 2.672 -2.413 1.00 0.00 H new ATOM 0 HG21 VAL A 76 69.282 3.168 -5.330 1.00 0.00 H new ATOM 0 HG22 VAL A 76 68.546 1.966 -4.244 1.00 0.00 H new ATOM 0 HG23 VAL A 76 67.525 3.179 -5.052 1.00 0.00 H new ATOM 1622 N LEU A 77 67.632 5.780 -1.064 1.00 0.00 N ATOM 1623 CA LEU A 77 67.954 6.662 0.116 1.00 0.00 C ATOM 1624 C LEU A 77 67.174 6.263 1.389 1.00 0.00 C ATOM 1625 O LEU A 77 67.753 6.006 2.426 1.00 0.00 O ATOM 1626 CB LEU A 77 67.576 8.108 -0.290 1.00 0.00 C ATOM 1627 CG LEU A 77 67.976 9.196 0.754 1.00 0.00 C ATOM 1628 CD1 LEU A 77 66.808 9.493 1.712 1.00 0.00 C ATOM 1629 CD2 LEU A 77 69.221 8.795 1.560 1.00 0.00 C ATOM 0 H LEU A 77 67.185 6.266 -1.841 1.00 0.00 H new ATOM 0 HA LEU A 77 69.012 6.562 0.359 1.00 0.00 H new ATOM 0 HB2 LEU A 77 68.054 8.342 -1.241 1.00 0.00 H new ATOM 0 HB3 LEU A 77 66.499 8.157 -0.453 1.00 0.00 H new ATOM 0 HG LEU A 77 68.217 10.098 0.191 1.00 0.00 H new ATOM 0 HD11 LEU A 77 67.111 10.255 2.430 1.00 0.00 H new ATOM 0 HD12 LEU A 77 65.952 9.853 1.141 1.00 0.00 H new ATOM 0 HD13 LEU A 77 66.533 8.582 2.243 1.00 0.00 H new ATOM 0 HD21 LEU A 77 69.462 9.583 2.274 1.00 0.00 H new ATOM 0 HD22 LEU A 77 69.024 7.867 2.097 1.00 0.00 H new ATOM 0 HD23 LEU A 77 70.062 8.650 0.882 1.00 0.00 H new ATOM 1641 N VAL A 78 65.872 6.224 1.327 1.00 0.00 N ATOM 1642 CA VAL A 78 65.065 5.868 2.538 1.00 0.00 C ATOM 1643 C VAL A 78 65.441 4.471 3.021 1.00 0.00 C ATOM 1644 O VAL A 78 65.490 4.200 4.201 1.00 0.00 O ATOM 1645 CB VAL A 78 63.579 5.906 2.178 1.00 0.00 C ATOM 1646 CG1 VAL A 78 63.187 7.334 1.786 1.00 0.00 C ATOM 1647 CG2 VAL A 78 63.316 4.963 1.004 1.00 0.00 C ATOM 0 H VAL A 78 65.326 6.423 0.489 1.00 0.00 H new ATOM 0 HA VAL A 78 65.269 6.584 3.334 1.00 0.00 H new ATOM 0 HB VAL A 78 62.987 5.590 3.037 1.00 0.00 H new ATOM 0 HG11 VAL A 78 62.128 7.363 1.529 1.00 0.00 H new ATOM 0 HG12 VAL A 78 63.376 8.006 2.623 1.00 0.00 H new ATOM 0 HG13 VAL A 78 63.778 7.650 0.926 1.00 0.00 H new ATOM 0 HG21 VAL A 78 62.257 4.989 0.746 1.00 0.00 H new ATOM 0 HG22 VAL A 78 63.907 5.279 0.144 1.00 0.00 H new ATOM 0 HG23 VAL A 78 63.596 3.947 1.283 1.00 0.00 H new ATOM 1657 N ALA A 79 65.711 3.597 2.111 1.00 0.00 N ATOM 1658 CA ALA A 79 66.104 2.202 2.462 1.00 0.00 C ATOM 1659 C ALA A 79 67.440 2.173 3.230 1.00 0.00 C ATOM 1660 O ALA A 79 67.629 1.398 4.154 1.00 0.00 O ATOM 1661 CB ALA A 79 66.275 1.435 1.139 1.00 0.00 C ATOM 0 H ALA A 79 65.677 3.787 1.109 1.00 0.00 H new ATOM 0 HA ALA A 79 65.341 1.755 3.099 1.00 0.00 H new ATOM 0 HB1 ALA A 79 66.564 0.405 1.350 1.00 0.00 H new ATOM 0 HB2 ALA A 79 65.334 1.443 0.590 1.00 0.00 H new ATOM 0 HB3 ALA A 79 67.049 1.913 0.539 1.00 0.00 H new ATOM 1667 N ALA A 80 68.384 2.970 2.813 1.00 0.00 N ATOM 1668 CA ALA A 80 69.731 2.951 3.454 1.00 0.00 C ATOM 1669 C ALA A 80 69.787 3.701 4.800 1.00 0.00 C ATOM 1670 O ALA A 80 70.648 3.418 5.613 1.00 0.00 O ATOM 1671 CB ALA A 80 70.752 3.526 2.481 1.00 0.00 C ATOM 0 H ALA A 80 68.280 3.639 2.050 1.00 0.00 H new ATOM 0 HA ALA A 80 69.964 1.912 3.686 1.00 0.00 H new ATOM 0 HB1 ALA A 80 71.740 3.516 2.942 1.00 0.00 H new ATOM 0 HB2 ALA A 80 70.769 2.923 1.573 1.00 0.00 H new ATOM 0 HB3 ALA A 80 70.479 4.551 2.231 1.00 0.00 H new ATOM 1677 N LEU A 81 68.924 4.648 5.078 1.00 0.00 N ATOM 1678 CA LEU A 81 69.039 5.341 6.413 1.00 0.00 C ATOM 1679 C LEU A 81 68.364 4.484 7.502 1.00 0.00 C ATOM 1680 O LEU A 81 68.904 4.265 8.564 1.00 0.00 O ATOM 1681 CB LEU A 81 68.410 6.740 6.351 1.00 0.00 C ATOM 1682 CG LEU A 81 66.962 6.671 5.804 1.00 0.00 C ATOM 1683 CD1 LEU A 81 65.939 6.333 6.924 1.00 0.00 C ATOM 1684 CD2 LEU A 81 66.614 8.024 5.156 1.00 0.00 C ATOM 0 H LEU A 81 68.170 4.967 4.469 1.00 0.00 H new ATOM 0 HA LEU A 81 70.093 5.460 6.663 1.00 0.00 H new ATOM 0 HB2 LEU A 81 68.406 7.186 7.346 1.00 0.00 H new ATOM 0 HB3 LEU A 81 69.013 7.387 5.714 1.00 0.00 H new ATOM 0 HG LEU A 81 66.905 5.872 5.065 1.00 0.00 H new ATOM 0 HD11 LEU A 81 64.935 6.294 6.500 1.00 0.00 H new ATOM 0 HD12 LEU A 81 66.186 5.366 7.363 1.00 0.00 H new ATOM 0 HD13 LEU A 81 65.977 7.102 7.696 1.00 0.00 H new ATOM 0 HD21 LEU A 81 65.597 7.990 4.766 1.00 0.00 H new ATOM 0 HD22 LEU A 81 66.690 8.815 5.902 1.00 0.00 H new ATOM 0 HD23 LEU A 81 67.308 8.226 4.340 1.00 0.00 H new ATOM 1696 N THR A 82 67.194 3.978 7.223 1.00 0.00 N ATOM 1697 CA THR A 82 66.465 3.112 8.205 1.00 0.00 C ATOM 1698 C THR A 82 67.370 1.965 8.673 1.00 0.00 C ATOM 1699 O THR A 82 67.482 1.701 9.854 1.00 0.00 O ATOM 1700 CB THR A 82 65.215 2.544 7.524 1.00 0.00 C ATOM 1701 OG1 THR A 82 64.650 1.539 8.354 1.00 0.00 O ATOM 1702 CG2 THR A 82 65.563 1.935 6.164 1.00 0.00 C ATOM 0 H THR A 82 66.701 4.128 6.343 1.00 0.00 H new ATOM 0 HA THR A 82 66.180 3.704 9.075 1.00 0.00 H new ATOM 0 HB THR A 82 64.503 3.355 7.370 1.00 0.00 H new ATOM 0 HG1 THR A 82 63.949 1.064 7.861 1.00 0.00 H new ATOM 0 HG21 THR A 82 64.659 1.539 5.701 1.00 0.00 H new ATOM 0 HG22 THR A 82 65.994 2.703 5.521 1.00 0.00 H new ATOM 0 HG23 THR A 82 66.284 1.129 6.300 1.00 0.00 H new ATOM 1710 N VAL A 83 68.050 1.311 7.772 1.00 0.00 N ATOM 1711 CA VAL A 83 68.983 0.218 8.191 1.00 0.00 C ATOM 1712 C VAL A 83 69.996 0.781 9.184 1.00 0.00 C ATOM 1713 O VAL A 83 70.340 0.153 10.165 1.00 0.00 O ATOM 1714 CB VAL A 83 69.738 -0.299 6.959 1.00 0.00 C ATOM 1715 CG1 VAL A 83 68.768 -1.096 6.085 1.00 0.00 C ATOM 1716 CG2 VAL A 83 70.286 0.857 6.148 1.00 0.00 C ATOM 0 H VAL A 83 68.003 1.482 6.768 1.00 0.00 H new ATOM 0 HA VAL A 83 68.417 -0.592 8.650 1.00 0.00 H new ATOM 0 HB VAL A 83 70.566 -0.926 7.288 1.00 0.00 H new ATOM 0 HG11 VAL A 83 69.293 -1.469 5.206 1.00 0.00 H new ATOM 0 HG12 VAL A 83 68.372 -1.937 6.655 1.00 0.00 H new ATOM 0 HG13 VAL A 83 67.947 -0.451 5.771 1.00 0.00 H new ATOM 0 HG21 VAL A 83 70.818 0.471 5.278 1.00 0.00 H new ATOM 0 HG22 VAL A 83 69.464 1.492 5.818 1.00 0.00 H new ATOM 0 HG23 VAL A 83 70.971 1.441 6.763 1.00 0.00 H new ATOM 1726 N ALA A 84 70.476 1.968 8.932 1.00 0.00 N ATOM 1727 CA ALA A 84 71.467 2.580 9.857 1.00 0.00 C ATOM 1728 C ALA A 84 70.805 2.808 11.218 1.00 0.00 C ATOM 1729 O ALA A 84 71.462 2.846 12.238 1.00 0.00 O ATOM 1730 CB ALA A 84 71.972 3.915 9.277 1.00 0.00 C ATOM 0 H ALA A 84 70.224 2.539 8.125 1.00 0.00 H new ATOM 0 HA ALA A 84 72.320 1.912 9.978 1.00 0.00 H new ATOM 0 HB1 ALA A 84 72.697 4.357 9.960 1.00 0.00 H new ATOM 0 HB2 ALA A 84 72.445 3.736 8.311 1.00 0.00 H new ATOM 0 HB3 ALA A 84 71.132 4.597 9.149 1.00 0.00 H new ATOM 1736 N CYS A 85 69.509 2.973 11.242 1.00 0.00 N ATOM 1737 CA CYS A 85 68.818 3.210 12.544 1.00 0.00 C ATOM 1738 C CYS A 85 68.827 1.930 13.383 1.00 0.00 C ATOM 1739 O CYS A 85 69.053 1.961 14.576 1.00 0.00 O ATOM 1740 CB CYS A 85 67.372 3.645 12.290 1.00 0.00 C ATOM 1741 SG CYS A 85 66.608 4.131 13.858 1.00 0.00 S ATOM 0 H CYS A 85 68.902 2.954 10.422 1.00 0.00 H new ATOM 0 HA CYS A 85 69.344 3.996 13.086 1.00 0.00 H new ATOM 0 HB2 CYS A 85 67.349 4.478 11.588 1.00 0.00 H new ATOM 0 HB3 CYS A 85 66.809 2.829 11.836 1.00 0.00 H new ATOM 0 HG CYS A 85 65.381 4.503 13.646 1.00 0.00 H new ATOM 1747 N ASN A 86 68.573 0.808 12.772 1.00 0.00 N ATOM 1748 CA ASN A 86 68.553 -0.475 13.531 1.00 0.00 C ATOM 1749 C ASN A 86 69.932 -0.752 14.146 1.00 0.00 C ATOM 1750 O ASN A 86 70.042 -1.188 15.275 1.00 0.00 O ATOM 1751 CB ASN A 86 68.176 -1.605 12.568 1.00 0.00 C ATOM 1752 CG ASN A 86 68.070 -2.925 13.329 1.00 0.00 C ATOM 1753 OD1 ASN A 86 68.212 -3.984 12.750 1.00 0.00 O ATOM 1754 ND2 ASN A 86 67.819 -2.908 14.609 1.00 0.00 N ATOM 0 H ASN A 86 68.377 0.723 11.775 1.00 0.00 H new ATOM 0 HA ASN A 86 67.824 -0.412 14.339 1.00 0.00 H new ATOM 0 HB2 ASN A 86 67.227 -1.379 12.082 1.00 0.00 H new ATOM 0 HB3 ASN A 86 68.925 -1.688 11.781 1.00 0.00 H new ATOM 0 HD21 ASN A 86 67.742 -3.784 15.125 1.00 0.00 H new ATOM 0 HD22 ASN A 86 67.700 -2.018 15.094 1.00 0.00 H new ATOM 1761 N ASN A 87 70.981 -0.510 13.408 1.00 0.00 N ATOM 1762 CA ASN A 87 72.355 -0.766 13.937 1.00 0.00 C ATOM 1763 C ASN A 87 72.681 0.195 15.086 1.00 0.00 C ATOM 1764 O ASN A 87 73.303 -0.180 16.061 1.00 0.00 O ATOM 1765 CB ASN A 87 73.380 -0.581 12.816 1.00 0.00 C ATOM 1766 CG ASN A 87 74.775 -0.924 13.344 1.00 0.00 C ATOM 1767 OD1 ASN A 87 75.490 -0.062 13.816 1.00 0.00 O ATOM 1768 ND2 ASN A 87 75.193 -2.159 13.287 1.00 0.00 N ATOM 0 H ASN A 87 70.947 -0.144 12.456 1.00 0.00 H new ATOM 0 HA ASN A 87 72.396 -1.789 14.312 1.00 0.00 H new ATOM 0 HB2 ASN A 87 73.131 -1.222 11.970 1.00 0.00 H new ATOM 0 HB3 ASN A 87 73.358 0.447 12.454 1.00 0.00 H new ATOM 0 HD21 ASN A 87 76.120 -2.401 13.639 1.00 0.00 H new ATOM 0 HD22 ASN A 87 74.593 -2.883 12.891 1.00 0.00 H new ATOM 1775 N PHE A 88 72.287 1.434 14.973 1.00 0.00 N ATOM 1776 CA PHE A 88 72.601 2.418 16.049 1.00 0.00 C ATOM 1777 C PHE A 88 71.606 2.261 17.199 1.00 0.00 C ATOM 1778 O PHE A 88 71.794 2.801 18.272 1.00 0.00 O ATOM 1779 CB PHE A 88 72.508 3.834 15.471 1.00 0.00 C ATOM 1780 CG PHE A 88 72.932 4.843 16.511 1.00 0.00 C ATOM 1781 CD1 PHE A 88 74.274 5.225 16.603 1.00 0.00 C ATOM 1782 CD2 PHE A 88 71.983 5.399 17.376 1.00 0.00 C ATOM 1783 CE1 PHE A 88 74.671 6.163 17.564 1.00 0.00 C ATOM 1784 CE2 PHE A 88 72.379 6.338 18.337 1.00 0.00 C ATOM 1785 CZ PHE A 88 73.723 6.720 18.432 1.00 0.00 C ATOM 0 H PHE A 88 71.761 1.808 14.183 1.00 0.00 H new ATOM 0 HA PHE A 88 73.608 2.241 16.427 1.00 0.00 H new ATOM 0 HB2 PHE A 88 73.143 3.919 14.589 1.00 0.00 H new ATOM 0 HB3 PHE A 88 71.487 4.038 15.149 1.00 0.00 H new ATOM 0 HD1 PHE A 88 75.004 4.797 15.933 1.00 0.00 H new ATOM 0 HD2 PHE A 88 70.947 5.105 17.303 1.00 0.00 H new ATOM 0 HE1 PHE A 88 75.708 6.457 17.636 1.00 0.00 H new ATOM 0 HE2 PHE A 88 71.647 6.768 19.005 1.00 0.00 H new ATOM 0 HZ PHE A 88 74.028 7.443 19.174 1.00 0.00 H new ATOM 1795 N PHE A 89 70.560 1.510 16.995 1.00 0.00 N ATOM 1796 CA PHE A 89 69.573 1.303 18.087 1.00 0.00 C ATOM 1797 C PHE A 89 70.120 0.266 19.061 1.00 0.00 C ATOM 1798 O PHE A 89 69.823 0.285 20.239 1.00 0.00 O ATOM 1799 CB PHE A 89 68.248 0.801 17.510 1.00 0.00 C ATOM 1800 CG PHE A 89 67.286 0.548 18.645 1.00 0.00 C ATOM 1801 CD1 PHE A 89 66.442 1.572 19.093 1.00 0.00 C ATOM 1802 CD2 PHE A 89 67.240 -0.713 19.250 1.00 0.00 C ATOM 1803 CE1 PHE A 89 65.554 1.334 20.149 1.00 0.00 C ATOM 1804 CE2 PHE A 89 66.351 -0.951 20.305 1.00 0.00 C ATOM 1805 CZ PHE A 89 65.509 0.072 20.756 1.00 0.00 C ATOM 0 H PHE A 89 70.347 1.032 16.120 1.00 0.00 H new ATOM 0 HA PHE A 89 69.402 2.249 18.601 1.00 0.00 H new ATOM 0 HB2 PHE A 89 67.834 1.537 16.821 1.00 0.00 H new ATOM 0 HB3 PHE A 89 68.408 -0.114 16.940 1.00 0.00 H new ATOM 0 HD1 PHE A 89 66.476 2.544 18.624 1.00 0.00 H new ATOM 0 HD2 PHE A 89 67.890 -1.502 18.903 1.00 0.00 H new ATOM 0 HE1 PHE A 89 64.904 2.123 20.496 1.00 0.00 H new ATOM 0 HE2 PHE A 89 66.315 -1.925 20.771 1.00 0.00 H new ATOM 0 HZ PHE A 89 64.825 -0.111 21.571 1.00 0.00 H new ATOM 1815 N TRP A 90 70.908 -0.653 18.571 1.00 0.00 N ATOM 1816 CA TRP A 90 71.466 -1.711 19.458 1.00 0.00 C ATOM 1817 C TRP A 90 72.730 -1.205 20.155 1.00 0.00 C ATOM 1818 O TRP A 90 73.230 -1.830 21.069 1.00 0.00 O ATOM 1819 CB TRP A 90 71.816 -2.949 18.629 1.00 0.00 C ATOM 1820 CG TRP A 90 72.299 -4.030 19.543 1.00 0.00 C ATOM 1821 CD1 TRP A 90 73.598 -4.339 19.765 1.00 0.00 C ATOM 1822 CD2 TRP A 90 71.515 -4.951 20.355 1.00 0.00 C ATOM 1823 NE1 TRP A 90 73.661 -5.383 20.671 1.00 0.00 N ATOM 1824 CE2 TRP A 90 72.403 -5.797 21.062 1.00 0.00 C ATOM 1825 CE3 TRP A 90 70.135 -5.131 20.547 1.00 0.00 C ATOM 1826 CZ2 TRP A 90 71.936 -6.785 21.930 1.00 0.00 C ATOM 1827 CZ3 TRP A 90 69.661 -6.126 21.418 1.00 0.00 C ATOM 1828 CH2 TRP A 90 70.560 -6.951 22.109 1.00 0.00 C ATOM 0 H TRP A 90 71.189 -0.716 17.593 1.00 0.00 H new ATOM 0 HA TRP A 90 70.717 -1.967 20.208 1.00 0.00 H new ATOM 0 HB2 TRP A 90 70.942 -3.289 18.074 1.00 0.00 H new ATOM 0 HB3 TRP A 90 72.585 -2.705 17.896 1.00 0.00 H new ATOM 0 HD1 TRP A 90 74.447 -3.851 19.309 1.00 0.00 H new ATOM 0 HE1 TRP A 90 74.530 -5.796 21.009 1.00 0.00 H new ATOM 0 HE3 TRP A 90 69.434 -4.500 20.021 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 72.633 -7.417 22.460 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 68.598 -6.256 21.556 1.00 0.00 H new ATOM 0 HH2 TRP A 90 70.190 -7.713 22.778 1.00 0.00 H new ATOM 1889 N SER B 2 53.344 8.726 10.022 1.00 0.00 N ATOM 1890 CA SER B 2 53.177 9.367 8.688 1.00 0.00 C ATOM 1891 C SER B 2 53.320 8.305 7.596 1.00 0.00 C ATOM 1892 O SER B 2 53.863 7.243 7.821 1.00 0.00 O ATOM 1893 CB SER B 2 54.256 10.431 8.504 1.00 0.00 C ATOM 1894 OG SER B 2 55.520 9.793 8.375 1.00 0.00 O ATOM 0 HA SER B 2 52.192 9.829 8.622 1.00 0.00 H new ATOM 0 HB2 SER B 2 54.045 11.031 7.619 1.00 0.00 H new ATOM 0 HB3 SER B 2 54.263 11.111 9.356 1.00 0.00 H new ATOM 0 HG SER B 2 56.197 10.306 8.865 1.00 0.00 H new ATOM 1900 N GLU B 3 52.804 8.563 6.425 1.00 0.00 N ATOM 1901 CA GLU B 3 52.876 7.548 5.337 1.00 0.00 C ATOM 1902 C GLU B 3 54.291 6.974 5.230 1.00 0.00 C ATOM 1903 O GLU B 3 54.479 5.777 5.184 1.00 0.00 O ATOM 1904 CB GLU B 3 52.526 8.220 4.010 1.00 0.00 C ATOM 1905 CG GLU B 3 51.043 8.589 3.987 1.00 0.00 C ATOM 1906 CD GLU B 3 50.722 9.288 2.667 1.00 0.00 C ATOM 1907 OE1 GLU B 3 51.600 9.344 1.822 1.00 0.00 O ATOM 1908 OE2 GLU B 3 49.605 9.754 2.522 1.00 0.00 O ATOM 0 H GLU B 3 52.335 9.434 6.175 1.00 0.00 H new ATOM 0 HA GLU B 3 52.177 6.742 5.562 1.00 0.00 H new ATOM 0 HB2 GLU B 3 53.134 9.114 3.874 1.00 0.00 H new ATOM 0 HB3 GLU B 3 52.755 7.550 3.182 1.00 0.00 H new ATOM 0 HG2 GLU B 3 50.431 7.694 4.097 1.00 0.00 H new ATOM 0 HG3 GLU B 3 50.805 9.243 4.826 1.00 0.00 H new ATOM 1915 N LEU B 4 55.288 7.811 5.169 1.00 0.00 N ATOM 1916 CA LEU B 4 56.679 7.288 5.046 1.00 0.00 C ATOM 1917 C LEU B 4 57.098 6.579 6.335 1.00 0.00 C ATOM 1918 O LEU B 4 57.670 5.508 6.303 1.00 0.00 O ATOM 1919 CB LEU B 4 57.638 8.457 4.750 1.00 0.00 C ATOM 1920 CG LEU B 4 57.674 8.734 3.234 1.00 0.00 C ATOM 1921 CD1 LEU B 4 58.144 10.172 2.973 1.00 0.00 C ATOM 1922 CD2 LEU B 4 58.646 7.748 2.553 1.00 0.00 C ATOM 0 H LEU B 4 55.203 8.827 5.199 1.00 0.00 H new ATOM 0 HA LEU B 4 56.720 6.568 4.229 1.00 0.00 H new ATOM 0 HB2 LEU B 4 57.313 9.350 5.284 1.00 0.00 H new ATOM 0 HB3 LEU B 4 58.639 8.218 5.109 1.00 0.00 H new ATOM 0 HG LEU B 4 56.672 8.604 2.825 1.00 0.00 H new ATOM 0 HD11 LEU B 4 58.166 10.358 1.899 1.00 0.00 H new ATOM 0 HD12 LEU B 4 57.456 10.871 3.449 1.00 0.00 H new ATOM 0 HD13 LEU B 4 59.144 10.309 3.386 1.00 0.00 H new ATOM 0 HD21 LEU B 4 58.671 7.944 1.481 1.00 0.00 H new ATOM 0 HD22 LEU B 4 59.645 7.876 2.969 1.00 0.00 H new ATOM 0 HD23 LEU B 4 58.309 6.726 2.727 1.00 0.00 H new ATOM 1934 N GLU B 5 56.829 7.160 7.464 1.00 0.00 N ATOM 1935 CA GLU B 5 57.227 6.500 8.732 1.00 0.00 C ATOM 1936 C GLU B 5 56.523 5.147 8.826 1.00 0.00 C ATOM 1937 O GLU B 5 57.087 4.165 9.264 1.00 0.00 O ATOM 1938 CB GLU B 5 56.851 7.384 9.926 1.00 0.00 C ATOM 1939 CG GLU B 5 57.292 6.708 11.227 1.00 0.00 C ATOM 1940 CD GLU B 5 56.972 7.621 12.413 1.00 0.00 C ATOM 1941 OE1 GLU B 5 56.429 8.690 12.184 1.00 0.00 O ATOM 1942 OE2 GLU B 5 57.284 7.241 13.529 1.00 0.00 O ATOM 0 H GLU B 5 56.354 8.057 7.565 1.00 0.00 H new ATOM 0 HA GLU B 5 58.306 6.349 8.747 1.00 0.00 H new ATOM 0 HB2 GLU B 5 57.327 8.360 9.832 1.00 0.00 H new ATOM 0 HB3 GLU B 5 55.774 7.554 9.940 1.00 0.00 H new ATOM 0 HG2 GLU B 5 56.782 5.752 11.343 1.00 0.00 H new ATOM 0 HG3 GLU B 5 58.361 6.497 11.195 1.00 0.00 H new ATOM 1949 N THR B 6 55.293 5.098 8.410 1.00 0.00 N ATOM 1950 CA THR B 6 54.528 3.824 8.458 1.00 0.00 C ATOM 1951 C THR B 6 55.353 2.693 7.839 1.00 0.00 C ATOM 1952 O THR B 6 55.502 1.628 8.399 1.00 0.00 O ATOM 1953 CB THR B 6 53.271 4.002 7.600 1.00 0.00 C ATOM 1954 OG1 THR B 6 52.532 5.123 8.068 1.00 0.00 O ATOM 1955 CG2 THR B 6 52.407 2.743 7.684 1.00 0.00 C ATOM 0 H THR B 6 54.778 5.894 8.034 1.00 0.00 H new ATOM 0 HA THR B 6 54.286 3.581 9.493 1.00 0.00 H new ATOM 0 HB THR B 6 53.562 4.168 6.563 1.00 0.00 H new ATOM 0 HG1 THR B 6 52.856 5.936 7.626 1.00 0.00 H new ATOM 0 HG21 THR B 6 51.514 2.873 7.073 1.00 0.00 H new ATOM 0 HG22 THR B 6 52.975 1.887 7.319 1.00 0.00 H new ATOM 0 HG23 THR B 6 52.115 2.570 8.720 1.00 0.00 H new ATOM 1963 N ALA B 7 55.860 2.938 6.664 1.00 0.00 N ATOM 1964 CA ALA B 7 56.660 1.924 5.913 1.00 0.00 C ATOM 1965 C ALA B 7 58.019 1.631 6.562 1.00 0.00 C ATOM 1966 O ALA B 7 58.566 0.560 6.387 1.00 0.00 O ATOM 1967 CB ALA B 7 56.913 2.473 4.508 1.00 0.00 C ATOM 0 H ALA B 7 55.751 3.827 6.176 1.00 0.00 H new ATOM 0 HA ALA B 7 56.093 0.993 5.905 1.00 0.00 H new ATOM 0 HB1 ALA B 7 57.496 1.752 3.935 1.00 0.00 H new ATOM 0 HB2 ALA B 7 55.960 2.647 4.008 1.00 0.00 H new ATOM 0 HB3 ALA B 7 57.463 3.411 4.578 1.00 0.00 H new ATOM 1973 N MET B 8 58.588 2.550 7.277 1.00 0.00 N ATOM 1974 CA MET B 8 59.927 2.275 7.874 1.00 0.00 C ATOM 1975 C MET B 8 59.806 1.238 8.982 1.00 0.00 C ATOM 1976 O MET B 8 60.554 0.283 9.050 1.00 0.00 O ATOM 1977 CB MET B 8 60.505 3.569 8.453 1.00 0.00 C ATOM 1978 CG MET B 8 61.848 3.272 9.125 1.00 0.00 C ATOM 1979 SD MET B 8 62.651 4.821 9.600 1.00 0.00 S ATOM 1980 CE MET B 8 63.886 4.091 10.704 1.00 0.00 C ATOM 0 H MET B 8 58.196 3.470 7.476 1.00 0.00 H new ATOM 0 HA MET B 8 60.588 1.891 7.097 1.00 0.00 H new ATOM 0 HB2 MET B 8 60.637 4.307 7.662 1.00 0.00 H new ATOM 0 HB3 MET B 8 59.811 3.998 9.176 1.00 0.00 H new ATOM 0 HG2 MET B 8 61.695 2.647 10.004 1.00 0.00 H new ATOM 0 HG3 MET B 8 62.490 2.713 8.444 1.00 0.00 H new ATOM 0 HE1 MET B 8 64.765 4.735 10.743 1.00 0.00 H new ATOM 0 HE2 MET B 8 63.465 3.990 11.704 1.00 0.00 H new ATOM 0 HE3 MET B 8 64.173 3.108 10.330 1.00 0.00 H new ATOM 1990 N GLU B 9 58.888 1.446 9.867 1.00 0.00 N ATOM 1991 CA GLU B 9 58.714 0.523 11.005 1.00 0.00 C ATOM 1992 C GLU B 9 58.187 -0.829 10.527 1.00 0.00 C ATOM 1993 O GLU B 9 58.429 -1.840 11.146 1.00 0.00 O ATOM 1994 CB GLU B 9 57.733 1.157 11.978 1.00 0.00 C ATOM 1995 CG GLU B 9 58.402 2.327 12.697 1.00 0.00 C ATOM 1996 CD GLU B 9 59.470 1.797 13.658 1.00 0.00 C ATOM 1997 OE1 GLU B 9 59.206 0.804 14.316 1.00 0.00 O ATOM 1998 OE2 GLU B 9 60.534 2.391 13.717 1.00 0.00 O ATOM 0 H GLU B 9 58.238 2.232 9.850 1.00 0.00 H new ATOM 0 HA GLU B 9 59.673 0.350 11.493 1.00 0.00 H new ATOM 0 HB2 GLU B 9 56.849 1.504 11.443 1.00 0.00 H new ATOM 0 HB3 GLU B 9 57.396 0.417 12.704 1.00 0.00 H new ATOM 0 HG2 GLU B 9 58.855 3.002 11.971 1.00 0.00 H new ATOM 0 HG3 GLU B 9 57.657 2.903 13.247 1.00 0.00 H new ATOM 2005 N THR B 10 57.446 -0.861 9.455 1.00 0.00 N ATOM 2006 CA THR B 10 56.900 -2.167 8.985 1.00 0.00 C ATOM 2007 C THR B 10 58.052 -3.115 8.597 1.00 0.00 C ATOM 2008 O THR B 10 58.151 -4.199 9.121 1.00 0.00 O ATOM 2009 CB THR B 10 55.954 -1.922 7.787 1.00 0.00 C ATOM 2010 OG1 THR B 10 55.822 -0.527 7.584 1.00 0.00 O ATOM 2011 CG2 THR B 10 54.571 -2.521 8.064 1.00 0.00 C ATOM 0 H THR B 10 57.196 -0.050 8.889 1.00 0.00 H new ATOM 0 HA THR B 10 56.334 -2.640 9.788 1.00 0.00 H new ATOM 0 HB THR B 10 56.373 -2.398 6.900 1.00 0.00 H new ATOM 0 HG1 THR B 10 55.421 -0.117 8.379 1.00 0.00 H new ATOM 0 HG21 THR B 10 53.918 -2.339 7.210 1.00 0.00 H new ATOM 0 HG22 THR B 10 54.665 -3.595 8.226 1.00 0.00 H new ATOM 0 HG23 THR B 10 54.144 -2.056 8.953 1.00 0.00 H new ATOM 2019 N LEU B 11 58.910 -2.744 7.692 1.00 0.00 N ATOM 2020 CA LEU B 11 60.025 -3.665 7.300 1.00 0.00 C ATOM 2021 C LEU B 11 60.836 -4.071 8.537 1.00 0.00 C ATOM 2022 O LEU B 11 61.273 -5.198 8.660 1.00 0.00 O ATOM 2023 CB LEU B 11 60.951 -2.938 6.310 1.00 0.00 C ATOM 2024 CG LEU B 11 60.377 -3.022 4.894 1.00 0.00 C ATOM 2025 CD1 LEU B 11 58.957 -2.461 4.885 1.00 0.00 C ATOM 2026 CD2 LEU B 11 61.251 -2.199 3.944 1.00 0.00 C ATOM 0 H LEU B 11 58.893 -1.848 7.205 1.00 0.00 H new ATOM 0 HA LEU B 11 59.605 -4.559 6.839 1.00 0.00 H new ATOM 0 HB2 LEU B 11 61.063 -1.894 6.604 1.00 0.00 H new ATOM 0 HB3 LEU B 11 61.945 -3.385 6.335 1.00 0.00 H new ATOM 0 HG LEU B 11 60.360 -4.063 4.570 1.00 0.00 H new ATOM 0 HD11 LEU B 11 58.548 -2.521 3.876 1.00 0.00 H new ATOM 0 HD12 LEU B 11 58.332 -3.041 5.565 1.00 0.00 H new ATOM 0 HD13 LEU B 11 58.975 -1.420 5.208 1.00 0.00 H new ATOM 0 HD21 LEU B 11 60.845 -2.257 2.934 1.00 0.00 H new ATOM 0 HD22 LEU B 11 61.265 -1.159 4.271 1.00 0.00 H new ATOM 0 HD23 LEU B 11 62.267 -2.594 3.950 1.00 0.00 H new ATOM 2038 N ILE B 12 61.073 -3.167 9.429 1.00 0.00 N ATOM 2039 CA ILE B 12 61.890 -3.501 10.630 1.00 0.00 C ATOM 2040 C ILE B 12 61.203 -4.554 11.529 1.00 0.00 C ATOM 2041 O ILE B 12 61.869 -5.409 12.077 1.00 0.00 O ATOM 2042 CB ILE B 12 62.159 -2.209 11.412 1.00 0.00 C ATOM 2043 CG1 ILE B 12 63.100 -1.318 10.598 1.00 0.00 C ATOM 2044 CG2 ILE B 12 62.804 -2.518 12.762 1.00 0.00 C ATOM 2045 CD1 ILE B 12 63.170 0.069 11.239 1.00 0.00 C ATOM 0 H ILE B 12 60.738 -2.204 9.385 1.00 0.00 H new ATOM 0 HA ILE B 12 62.830 -3.944 10.301 1.00 0.00 H new ATOM 0 HB ILE B 12 61.211 -1.700 11.586 1.00 0.00 H new ATOM 0 HG12 ILE B 12 64.095 -1.762 10.558 1.00 0.00 H new ATOM 0 HG13 ILE B 12 62.745 -1.238 9.571 1.00 0.00 H new ATOM 0 HG21 ILE B 12 62.986 -1.588 13.300 1.00 0.00 H new ATOM 0 HG22 ILE B 12 62.137 -3.151 13.347 1.00 0.00 H new ATOM 0 HG23 ILE B 12 63.750 -3.036 12.603 1.00 0.00 H new ATOM 0 HD11 ILE B 12 63.840 0.704 10.660 1.00 0.00 H new ATOM 0 HD12 ILE B 12 62.174 0.512 11.256 1.00 0.00 H new ATOM 0 HD13 ILE B 12 63.545 -0.020 12.258 1.00 0.00 H new ATOM 2057 N ASN B 13 59.912 -4.501 11.733 1.00 0.00 N ATOM 2058 CA ASN B 13 59.274 -5.510 12.649 1.00 0.00 C ATOM 2059 C ASN B 13 59.030 -6.862 11.945 1.00 0.00 C ATOM 2060 O ASN B 13 59.249 -7.908 12.521 1.00 0.00 O ATOM 2061 CB ASN B 13 57.955 -4.953 13.189 1.00 0.00 C ATOM 2062 CG ASN B 13 57.452 -5.842 14.327 1.00 0.00 C ATOM 2063 OD1 ASN B 13 58.185 -6.663 14.842 1.00 0.00 O ATOM 2064 ND2 ASN B 13 56.224 -5.711 14.747 1.00 0.00 N ATOM 0 H ASN B 13 59.277 -3.819 11.317 1.00 0.00 H new ATOM 0 HA ASN B 13 59.964 -5.694 13.473 1.00 0.00 H new ATOM 0 HB2 ASN B 13 58.098 -3.933 13.546 1.00 0.00 H new ATOM 0 HB3 ASN B 13 57.213 -4.910 12.392 1.00 0.00 H new ATOM 0 HD21 ASN B 13 55.880 -6.297 15.507 1.00 0.00 H new ATOM 0 HD22 ASN B 13 55.608 -5.022 14.315 1.00 0.00 H new ATOM 2071 N VAL B 14 58.568 -6.860 10.722 1.00 0.00 N ATOM 2072 CA VAL B 14 58.307 -8.154 10.022 1.00 0.00 C ATOM 2073 C VAL B 14 59.617 -8.934 9.937 1.00 0.00 C ATOM 2074 O VAL B 14 59.673 -10.134 10.155 1.00 0.00 O ATOM 2075 CB VAL B 14 57.766 -7.865 8.614 1.00 0.00 C ATOM 2076 CG1 VAL B 14 58.877 -7.317 7.712 1.00 0.00 C ATOM 2077 CG2 VAL B 14 57.185 -9.149 8.006 1.00 0.00 C ATOM 0 H VAL B 14 58.361 -6.022 10.179 1.00 0.00 H new ATOM 0 HA VAL B 14 57.570 -8.743 10.568 1.00 0.00 H new ATOM 0 HB VAL B 14 56.980 -7.114 8.690 1.00 0.00 H new ATOM 0 HG11 VAL B 14 58.474 -7.118 6.719 1.00 0.00 H new ATOM 0 HG12 VAL B 14 59.268 -6.392 8.137 1.00 0.00 H new ATOM 0 HG13 VAL B 14 59.680 -8.050 7.638 1.00 0.00 H new ATOM 0 HG21 VAL B 14 56.803 -8.938 7.007 1.00 0.00 H new ATOM 0 HG22 VAL B 14 57.965 -9.907 7.943 1.00 0.00 H new ATOM 0 HG23 VAL B 14 56.374 -9.515 8.635 1.00 0.00 H new ATOM 2087 N PHE B 15 60.672 -8.245 9.641 1.00 0.00 N ATOM 2088 CA PHE B 15 62.004 -8.904 9.556 1.00 0.00 C ATOM 2089 C PHE B 15 62.343 -9.535 10.913 1.00 0.00 C ATOM 2090 O PHE B 15 62.880 -10.616 10.977 1.00 0.00 O ATOM 2091 CB PHE B 15 63.065 -7.877 9.138 1.00 0.00 C ATOM 2092 CG PHE B 15 64.448 -8.403 9.448 1.00 0.00 C ATOM 2093 CD1 PHE B 15 64.954 -8.283 10.748 1.00 0.00 C ATOM 2094 CD2 PHE B 15 65.219 -9.004 8.450 1.00 0.00 C ATOM 2095 CE1 PHE B 15 66.232 -8.765 11.051 1.00 0.00 C ATOM 2096 CE2 PHE B 15 66.500 -9.485 8.753 1.00 0.00 C ATOM 2097 CZ PHE B 15 67.005 -9.366 10.053 1.00 0.00 C ATOM 0 H PHE B 15 60.674 -7.243 9.451 1.00 0.00 H new ATOM 0 HA PHE B 15 61.984 -9.692 8.803 1.00 0.00 H new ATOM 0 HB2 PHE B 15 62.978 -7.666 8.072 1.00 0.00 H new ATOM 0 HB3 PHE B 15 62.899 -6.937 9.663 1.00 0.00 H new ATOM 0 HD1 PHE B 15 64.357 -7.818 11.518 1.00 0.00 H new ATOM 0 HD2 PHE B 15 64.829 -9.098 7.447 1.00 0.00 H new ATOM 0 HE1 PHE B 15 66.621 -8.673 12.054 1.00 0.00 H new ATOM 0 HE2 PHE B 15 67.098 -9.948 7.982 1.00 0.00 H new ATOM 0 HZ PHE B 15 67.992 -9.738 10.285 1.00 0.00 H new ATOM 2107 N HIS B 16 62.033 -8.879 11.988 1.00 0.00 N ATOM 2108 CA HIS B 16 62.327 -9.456 13.334 1.00 0.00 C ATOM 2109 C HIS B 16 61.587 -10.796 13.501 1.00 0.00 C ATOM 2110 O HIS B 16 62.104 -11.737 14.071 1.00 0.00 O ATOM 2111 CB HIS B 16 61.853 -8.472 14.406 1.00 0.00 C ATOM 2112 CG HIS B 16 62.161 -9.019 15.772 1.00 0.00 C ATOM 2113 ND1 HIS B 16 61.174 -9.522 16.607 1.00 0.00 N ATOM 2114 CD2 HIS B 16 63.338 -9.137 16.469 1.00 0.00 C ATOM 2115 CE1 HIS B 16 61.769 -9.916 17.748 1.00 0.00 C ATOM 2116 NE2 HIS B 16 63.086 -9.701 17.713 1.00 0.00 N ATOM 0 H HIS B 16 61.586 -7.962 11.999 1.00 0.00 H new ATOM 0 HA HIS B 16 63.399 -9.629 13.434 1.00 0.00 H new ATOM 0 HB2 HIS B 16 62.344 -7.508 14.271 1.00 0.00 H new ATOM 0 HB3 HIS B 16 60.781 -8.300 14.306 1.00 0.00 H new ATOM 0 HD2 HIS B 16 64.310 -8.837 16.106 1.00 0.00 H new ATOM 0 HE1 HIS B 16 61.246 -10.352 18.587 1.00 0.00 H new ATOM 0 HE2 HIS B 16 63.765 -9.908 18.446 1.00 0.00 H new ATOM 2125 N ALA B 17 60.372 -10.871 13.035 1.00 0.00 N ATOM 2126 CA ALA B 17 59.562 -12.124 13.181 1.00 0.00 C ATOM 2127 C ALA B 17 60.289 -13.375 12.652 1.00 0.00 C ATOM 2128 O ALA B 17 60.433 -14.357 13.350 1.00 0.00 O ATOM 2129 CB ALA B 17 58.275 -11.958 12.373 1.00 0.00 C ATOM 0 H ALA B 17 59.895 -10.110 12.552 1.00 0.00 H new ATOM 0 HA ALA B 17 59.375 -12.269 14.245 1.00 0.00 H new ATOM 0 HB1 ALA B 17 57.669 -12.859 12.465 1.00 0.00 H new ATOM 0 HB2 ALA B 17 57.715 -11.104 12.753 1.00 0.00 H new ATOM 0 HB3 ALA B 17 58.522 -11.792 11.324 1.00 0.00 H new ATOM 2135 N HIS B 18 60.715 -13.363 11.418 1.00 0.00 N ATOM 2136 CA HIS B 18 61.392 -14.580 10.848 1.00 0.00 C ATOM 2137 C HIS B 18 62.854 -14.684 11.306 1.00 0.00 C ATOM 2138 O HIS B 18 63.350 -15.748 11.621 1.00 0.00 O ATOM 2139 CB HIS B 18 61.352 -14.508 9.319 1.00 0.00 C ATOM 2140 CG HIS B 18 59.926 -14.606 8.850 1.00 0.00 C ATOM 2141 ND1 HIS B 18 59.061 -13.521 8.881 1.00 0.00 N ATOM 2142 CD2 HIS B 18 59.197 -15.652 8.335 1.00 0.00 C ATOM 2143 CE1 HIS B 18 57.873 -13.934 8.400 1.00 0.00 C ATOM 2144 NE2 HIS B 18 57.906 -15.221 8.053 1.00 0.00 N ATOM 0 H HIS B 18 60.628 -12.573 10.778 1.00 0.00 H new ATOM 0 HA HIS B 18 60.860 -15.461 11.207 1.00 0.00 H new ATOM 0 HB2 HIS B 18 61.795 -13.573 8.977 1.00 0.00 H new ATOM 0 HB3 HIS B 18 61.944 -15.317 8.890 1.00 0.00 H new ATOM 0 HD2 HIS B 18 59.570 -16.653 8.175 1.00 0.00 H new ATOM 0 HE1 HIS B 18 57.002 -13.302 8.307 1.00 0.00 H new ATOM 0 HE2 HIS B 18 57.143 -15.774 7.662 1.00 0.00 H new ATOM 2153 N SER B 19 63.543 -13.589 11.304 1.00 0.00 N ATOM 2154 CA SER B 19 64.988 -13.541 11.686 1.00 0.00 C ATOM 2155 C SER B 19 65.276 -13.926 13.147 1.00 0.00 C ATOM 2156 O SER B 19 66.348 -14.415 13.444 1.00 0.00 O ATOM 2157 CB SER B 19 65.464 -12.099 11.479 1.00 0.00 C ATOM 2158 OG SER B 19 66.881 -12.083 11.351 1.00 0.00 O ATOM 0 H SER B 19 63.155 -12.683 11.043 1.00 0.00 H new ATOM 0 HA SER B 19 65.508 -14.271 11.066 1.00 0.00 H new ATOM 0 HB2 SER B 19 65.002 -11.677 10.586 1.00 0.00 H new ATOM 0 HB3 SER B 19 65.157 -11.479 12.321 1.00 0.00 H new ATOM 0 HG SER B 19 67.146 -11.365 10.739 1.00 0.00 H new ATOM 2164 N GLY B 20 64.388 -13.660 14.072 1.00 0.00 N ATOM 2165 CA GLY B 20 64.697 -13.960 15.511 1.00 0.00 C ATOM 2166 C GLY B 20 64.072 -15.268 15.987 1.00 0.00 C ATOM 2167 O GLY B 20 64.124 -15.568 17.164 1.00 0.00 O ATOM 0 H GLY B 20 63.469 -13.252 13.899 1.00 0.00 H new ATOM 0 HA2 GLY B 20 65.778 -14.009 15.644 1.00 0.00 H new ATOM 0 HA3 GLY B 20 64.336 -13.142 16.134 1.00 0.00 H new ATOM 2171 N LYS B 21 63.487 -16.055 15.116 1.00 0.00 N ATOM 2172 CA LYS B 21 62.871 -17.348 15.574 1.00 0.00 C ATOM 2173 C LYS B 21 63.549 -18.520 14.868 1.00 0.00 C ATOM 2174 O LYS B 21 64.083 -19.408 15.500 1.00 0.00 O ATOM 2175 CB LYS B 21 61.360 -17.338 15.273 1.00 0.00 C ATOM 2176 CG LYS B 21 60.601 -16.610 16.395 1.00 0.00 C ATOM 2177 CD LYS B 21 59.225 -16.142 15.896 1.00 0.00 C ATOM 2178 CE LYS B 21 58.434 -17.318 15.316 1.00 0.00 C ATOM 2179 NZ LYS B 21 58.337 -18.407 16.329 1.00 0.00 N ATOM 0 H LYS B 21 63.408 -15.864 14.117 1.00 0.00 H new ATOM 0 HA LYS B 21 63.013 -17.458 16.649 1.00 0.00 H new ATOM 0 HB2 LYS B 21 61.175 -16.845 14.319 1.00 0.00 H new ATOM 0 HB3 LYS B 21 60.993 -18.360 15.180 1.00 0.00 H new ATOM 0 HG2 LYS B 21 60.478 -17.275 17.250 1.00 0.00 H new ATOM 0 HG3 LYS B 21 61.181 -15.753 16.738 1.00 0.00 H new ATOM 0 HD2 LYS B 21 58.668 -15.692 16.718 1.00 0.00 H new ATOM 0 HD3 LYS B 21 59.351 -15.371 15.136 1.00 0.00 H new ATOM 0 HE2 LYS B 21 57.436 -16.989 15.025 1.00 0.00 H new ATOM 0 HE3 LYS B 21 58.923 -17.689 14.415 1.00 0.00 H new ATOM 0 HZ1 LYS B 21 57.613 -19.093 16.033 1.00 0.00 H new ATOM 0 HZ2 LYS B 21 59.256 -18.887 16.412 1.00 0.00 H new ATOM 0 HZ3 LYS B 21 58.074 -18.002 17.250 1.00 0.00 H new ATOM 2193 N GLU B 22 63.510 -18.551 13.570 1.00 0.00 N ATOM 2194 CA GLU B 22 64.125 -19.693 12.830 1.00 0.00 C ATOM 2195 C GLU B 22 65.592 -19.409 12.491 1.00 0.00 C ATOM 2196 O GLU B 22 66.161 -20.057 11.636 1.00 0.00 O ATOM 2197 CB GLU B 22 63.348 -19.913 11.531 1.00 0.00 C ATOM 2198 CG GLU B 22 61.926 -20.370 11.858 1.00 0.00 C ATOM 2199 CD GLU B 22 61.150 -20.590 10.558 1.00 0.00 C ATOM 2200 OE1 GLU B 22 61.661 -20.216 9.515 1.00 0.00 O ATOM 2201 OE2 GLU B 22 60.059 -21.131 10.627 1.00 0.00 O ATOM 0 H GLU B 22 63.079 -17.836 12.984 1.00 0.00 H new ATOM 0 HA GLU B 22 64.084 -20.580 13.462 1.00 0.00 H new ATOM 0 HB2 GLU B 22 63.320 -18.991 10.951 1.00 0.00 H new ATOM 0 HB3 GLU B 22 63.850 -20.661 10.917 1.00 0.00 H new ATOM 0 HG2 GLU B 22 61.953 -21.292 12.438 1.00 0.00 H new ATOM 0 HG3 GLU B 22 61.424 -19.622 12.472 1.00 0.00 H new ATOM 2208 N GLY B 23 66.223 -18.454 13.126 1.00 0.00 N ATOM 2209 CA GLY B 23 67.648 -18.189 12.770 1.00 0.00 C ATOM 2210 C GLY B 23 68.359 -17.332 13.817 1.00 0.00 C ATOM 2211 O GLY B 23 67.940 -17.211 14.951 1.00 0.00 O ATOM 0 H GLY B 23 65.826 -17.862 13.855 1.00 0.00 H new ATOM 0 HA2 GLY B 23 68.175 -19.137 12.661 1.00 0.00 H new ATOM 0 HA3 GLY B 23 67.691 -17.687 11.803 1.00 0.00 H new ATOM 2215 N ASP B 24 69.458 -16.752 13.412 1.00 0.00 N ATOM 2216 CA ASP B 24 70.268 -15.903 14.329 1.00 0.00 C ATOM 2217 C ASP B 24 69.434 -14.729 14.836 1.00 0.00 C ATOM 2218 O ASP B 24 68.598 -14.192 14.138 1.00 0.00 O ATOM 2219 CB ASP B 24 71.483 -15.371 13.574 1.00 0.00 C ATOM 2220 CG ASP B 24 72.453 -16.520 13.294 1.00 0.00 C ATOM 2221 OD1 ASP B 24 72.364 -17.524 13.981 1.00 0.00 O ATOM 2222 OD2 ASP B 24 73.269 -16.375 12.400 1.00 0.00 O ATOM 0 H ASP B 24 69.833 -16.834 12.467 1.00 0.00 H new ATOM 0 HA ASP B 24 70.590 -16.502 15.181 1.00 0.00 H new ATOM 0 HB2 ASP B 24 71.169 -14.910 12.638 1.00 0.00 H new ATOM 0 HB3 ASP B 24 71.979 -14.597 14.160 1.00 0.00 H new ATOM 2227 N LYS B 25 69.638 -14.357 16.065 1.00 0.00 N ATOM 2228 CA LYS B 25 68.843 -13.251 16.659 1.00 0.00 C ATOM 2229 C LYS B 25 68.877 -12.000 15.766 1.00 0.00 C ATOM 2230 O LYS B 25 67.842 -11.434 15.476 1.00 0.00 O ATOM 2231 CB LYS B 25 69.420 -12.905 18.042 1.00 0.00 C ATOM 2232 CG LYS B 25 68.931 -13.910 19.095 1.00 0.00 C ATOM 2233 CD LYS B 25 69.579 -15.276 18.857 1.00 0.00 C ATOM 2234 CE LYS B 25 69.296 -16.185 20.053 1.00 0.00 C ATOM 2235 NZ LYS B 25 69.705 -17.580 19.727 1.00 0.00 N ATOM 0 H LYS B 25 70.328 -14.775 16.689 1.00 0.00 H new ATOM 0 HA LYS B 25 67.807 -13.578 16.749 1.00 0.00 H new ATOM 0 HB2 LYS B 25 70.509 -12.913 18.001 1.00 0.00 H new ATOM 0 HB3 LYS B 25 69.120 -11.896 18.326 1.00 0.00 H new ATOM 0 HG2 LYS B 25 69.177 -13.551 20.094 1.00 0.00 H new ATOM 0 HG3 LYS B 25 67.846 -14.000 19.047 1.00 0.00 H new ATOM 0 HD2 LYS B 25 69.186 -15.724 17.944 1.00 0.00 H new ATOM 0 HD3 LYS B 25 70.654 -15.162 18.719 1.00 0.00 H new ATOM 0 HE2 LYS B 25 69.840 -15.831 20.929 1.00 0.00 H new ATOM 0 HE3 LYS B 25 68.235 -16.155 20.303 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 69.512 -18.198 20.541 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 69.167 -17.916 18.903 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 70.722 -17.602 19.509 1.00 0.00 H new ATOM 2249 N TYR B 26 70.038 -11.530 15.354 1.00 0.00 N ATOM 2250 CA TYR B 26 70.094 -10.277 14.520 1.00 0.00 C ATOM 2251 C TYR B 26 70.577 -10.564 13.090 1.00 0.00 C ATOM 2252 O TYR B 26 70.973 -9.658 12.386 1.00 0.00 O ATOM 2253 CB TYR B 26 71.070 -9.305 15.190 1.00 0.00 C ATOM 2254 CG TYR B 26 70.978 -7.943 14.540 1.00 0.00 C ATOM 2255 CD1 TYR B 26 69.955 -7.061 14.908 1.00 0.00 C ATOM 2256 CD2 TYR B 26 71.915 -7.562 13.572 1.00 0.00 C ATOM 2257 CE1 TYR B 26 69.870 -5.799 14.309 1.00 0.00 C ATOM 2258 CE2 TYR B 26 71.830 -6.300 12.973 1.00 0.00 C ATOM 2259 CZ TYR B 26 70.808 -5.418 13.341 1.00 0.00 C ATOM 2260 OH TYR B 26 70.725 -4.174 12.750 1.00 0.00 O ATOM 0 H TYR B 26 70.942 -11.956 15.557 1.00 0.00 H new ATOM 0 HA TYR B 26 69.091 -9.856 14.454 1.00 0.00 H new ATOM 0 HB2 TYR B 26 70.843 -9.225 16.253 1.00 0.00 H new ATOM 0 HB3 TYR B 26 72.088 -9.687 15.109 1.00 0.00 H new ATOM 0 HD1 TYR B 26 69.231 -7.354 15.654 1.00 0.00 H new ATOM 0 HD2 TYR B 26 72.704 -8.242 13.287 1.00 0.00 H new ATOM 0 HE1 TYR B 26 69.081 -5.119 14.593 1.00 0.00 H new ATOM 0 HE2 TYR B 26 72.553 -6.007 12.227 1.00 0.00 H new ATOM 0 HH TYR B 26 69.851 -4.075 12.317 1.00 0.00 H new ATOM 2270 N LYS B 27 70.548 -11.794 12.635 1.00 0.00 N ATOM 2271 CA LYS B 27 71.011 -12.076 11.235 1.00 0.00 C ATOM 2272 C LYS B 27 70.062 -13.064 10.560 1.00 0.00 C ATOM 2273 O LYS B 27 69.472 -13.927 11.178 1.00 0.00 O ATOM 2274 CB LYS B 27 72.455 -12.622 11.266 1.00 0.00 C ATOM 2275 CG LYS B 27 73.265 -12.025 10.106 1.00 0.00 C ATOM 2276 CD LYS B 27 74.708 -12.529 10.171 1.00 0.00 C ATOM 2277 CE LYS B 27 75.615 -11.625 9.335 1.00 0.00 C ATOM 2278 NZ LYS B 27 77.039 -11.998 9.568 1.00 0.00 N ATOM 0 H LYS B 27 70.229 -12.606 13.163 1.00 0.00 H new ATOM 0 HA LYS B 27 71.005 -11.153 10.655 1.00 0.00 H new ATOM 0 HB2 LYS B 27 72.927 -12.373 12.216 1.00 0.00 H new ATOM 0 HB3 LYS B 27 72.444 -13.709 11.191 1.00 0.00 H new ATOM 0 HG2 LYS B 27 72.815 -12.305 9.154 1.00 0.00 H new ATOM 0 HG3 LYS B 27 73.247 -10.936 10.160 1.00 0.00 H new ATOM 0 HD2 LYS B 27 75.050 -12.545 11.206 1.00 0.00 H new ATOM 0 HD3 LYS B 27 74.761 -13.553 9.802 1.00 0.00 H new ATOM 0 HE2 LYS B 27 75.370 -11.724 8.277 1.00 0.00 H new ATOM 0 HE3 LYS B 27 75.453 -10.581 9.603 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 77.656 -11.384 9.000 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 77.268 -11.882 10.576 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 77.188 -12.989 9.291 1.00 0.00 H new ATOM 2292 N LEU B 28 69.902 -12.889 9.285 1.00 0.00 N ATOM 2293 CA LEU B 28 68.983 -13.737 8.481 1.00 0.00 C ATOM 2294 C LEU B 28 69.776 -14.919 7.890 1.00 0.00 C ATOM 2295 O LEU B 28 70.981 -14.928 7.895 1.00 0.00 O ATOM 2296 CB LEU B 28 68.421 -12.836 7.367 1.00 0.00 C ATOM 2297 CG LEU B 28 66.964 -13.156 6.998 1.00 0.00 C ATOM 2298 CD1 LEU B 28 66.037 -12.922 8.200 1.00 0.00 C ATOM 2299 CD2 LEU B 28 66.539 -12.222 5.854 1.00 0.00 C ATOM 0 H LEU B 28 70.385 -12.170 8.747 1.00 0.00 H new ATOM 0 HA LEU B 28 68.171 -14.148 9.080 1.00 0.00 H new ATOM 0 HB2 LEU B 28 68.487 -11.795 7.684 1.00 0.00 H new ATOM 0 HB3 LEU B 28 69.044 -12.939 6.478 1.00 0.00 H new ATOM 0 HG LEU B 28 66.891 -14.201 6.698 1.00 0.00 H new ATOM 0 HD11 LEU B 28 65.010 -13.154 7.918 1.00 0.00 H new ATOM 0 HD12 LEU B 28 66.341 -13.566 9.025 1.00 0.00 H new ATOM 0 HD13 LEU B 28 66.101 -11.879 8.511 1.00 0.00 H new ATOM 0 HD21 LEU B 28 65.506 -12.433 5.577 1.00 0.00 H new ATOM 0 HD22 LEU B 28 66.622 -11.185 6.181 1.00 0.00 H new ATOM 0 HD23 LEU B 28 67.187 -12.384 4.992 1.00 0.00 H new ATOM 2311 N SER B 29 69.095 -15.910 7.389 1.00 0.00 N ATOM 2312 CA SER B 29 69.776 -17.104 6.790 1.00 0.00 C ATOM 2313 C SER B 29 69.152 -17.425 5.427 1.00 0.00 C ATOM 2314 O SER B 29 68.075 -16.962 5.106 1.00 0.00 O ATOM 2315 CB SER B 29 69.603 -18.303 7.724 1.00 0.00 C ATOM 2316 OG SER B 29 70.338 -18.076 8.920 1.00 0.00 O ATOM 0 H SER B 29 68.076 -15.949 7.366 1.00 0.00 H new ATOM 0 HA SER B 29 70.837 -16.890 6.658 1.00 0.00 H new ATOM 0 HB2 SER B 29 68.548 -18.450 7.954 1.00 0.00 H new ATOM 0 HB3 SER B 29 69.953 -19.213 7.236 1.00 0.00 H new ATOM 0 HG SER B 29 70.228 -18.842 9.522 1.00 0.00 H new ATOM 2322 N LYS B 30 69.810 -18.230 4.626 1.00 0.00 N ATOM 2323 CA LYS B 30 69.229 -18.587 3.288 1.00 0.00 C ATOM 2324 C LYS B 30 67.757 -19.019 3.417 1.00 0.00 C ATOM 2325 O LYS B 30 66.939 -18.688 2.581 1.00 0.00 O ATOM 2326 CB LYS B 30 70.073 -19.728 2.677 1.00 0.00 C ATOM 2327 CG LYS B 30 69.427 -20.331 1.411 1.00 0.00 C ATOM 2328 CD LYS B 30 69.489 -19.332 0.260 1.00 0.00 C ATOM 2329 CE LYS B 30 69.075 -20.024 -1.036 1.00 0.00 C ATOM 2330 NZ LYS B 30 70.058 -21.095 -1.363 1.00 0.00 N ATOM 0 H LYS B 30 70.715 -18.652 4.836 1.00 0.00 H new ATOM 0 HA LYS B 30 69.255 -17.712 2.639 1.00 0.00 H new ATOM 0 HB2 LYS B 30 71.065 -19.349 2.429 1.00 0.00 H new ATOM 0 HB3 LYS B 30 70.208 -20.513 3.421 1.00 0.00 H new ATOM 0 HG2 LYS B 30 69.944 -21.250 1.133 1.00 0.00 H new ATOM 0 HG3 LYS B 30 68.390 -20.598 1.615 1.00 0.00 H new ATOM 0 HD2 LYS B 30 68.829 -18.488 0.461 1.00 0.00 H new ATOM 0 HD3 LYS B 30 70.499 -18.932 0.165 1.00 0.00 H new ATOM 0 HE2 LYS B 30 68.078 -20.451 -0.930 1.00 0.00 H new ATOM 0 HE3 LYS B 30 69.027 -19.299 -1.849 1.00 0.00 H new ATOM 0 HZ1 LYS B 30 70.123 -21.203 -2.395 1.00 0.00 H new ATOM 0 HZ2 LYS B 30 70.991 -20.838 -0.982 1.00 0.00 H new ATOM 0 HZ3 LYS B 30 69.747 -21.993 -0.940 1.00 0.00 H new ATOM 2344 N LYS B 31 67.395 -19.758 4.416 1.00 0.00 N ATOM 2345 CA LYS B 31 65.965 -20.181 4.521 1.00 0.00 C ATOM 2346 C LYS B 31 65.117 -19.059 5.120 1.00 0.00 C ATOM 2347 O LYS B 31 63.951 -18.934 4.801 1.00 0.00 O ATOM 2348 CB LYS B 31 65.846 -21.439 5.384 1.00 0.00 C ATOM 2349 CG LYS B 31 64.371 -21.829 5.547 1.00 0.00 C ATOM 2350 CD LYS B 31 64.269 -23.039 6.465 1.00 0.00 C ATOM 2351 CE LYS B 31 62.804 -23.259 6.836 1.00 0.00 C ATOM 2352 NZ LYS B 31 62.679 -24.481 7.681 1.00 0.00 N ATOM 0 H LYS B 31 68.010 -20.088 5.159 1.00 0.00 H new ATOM 0 HA LYS B 31 65.598 -20.402 3.519 1.00 0.00 H new ATOM 0 HB2 LYS B 31 66.398 -22.259 4.924 1.00 0.00 H new ATOM 0 HB3 LYS B 31 66.294 -21.262 6.362 1.00 0.00 H new ATOM 0 HG2 LYS B 31 63.806 -20.994 5.962 1.00 0.00 H new ATOM 0 HG3 LYS B 31 63.934 -22.058 4.575 1.00 0.00 H new ATOM 0 HD2 LYS B 31 64.669 -23.923 5.968 1.00 0.00 H new ATOM 0 HD3 LYS B 31 64.865 -22.881 7.364 1.00 0.00 H new ATOM 0 HE2 LYS B 31 62.421 -22.392 7.374 1.00 0.00 H new ATOM 0 HE3 LYS B 31 62.202 -23.366 5.934 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 61.681 -24.629 7.932 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 63.029 -25.306 7.153 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 63.240 -24.362 8.548 1.00 0.00 H new ATOM 2366 N GLU B 32 65.652 -18.247 5.975 1.00 0.00 N ATOM 2367 CA GLU B 32 64.804 -17.168 6.548 1.00 0.00 C ATOM 2368 C GLU B 32 64.477 -16.111 5.485 1.00 0.00 C ATOM 2369 O GLU B 32 63.380 -15.609 5.444 1.00 0.00 O ATOM 2370 CB GLU B 32 65.475 -16.527 7.745 1.00 0.00 C ATOM 2371 CG GLU B 32 65.493 -17.507 8.914 1.00 0.00 C ATOM 2372 CD GLU B 32 65.956 -16.776 10.171 1.00 0.00 C ATOM 2373 OE1 GLU B 32 66.796 -15.901 10.048 1.00 0.00 O ATOM 2374 OE2 GLU B 32 65.473 -17.113 11.239 1.00 0.00 O ATOM 0 H GLU B 32 66.618 -18.277 6.300 1.00 0.00 H new ATOM 0 HA GLU B 32 63.870 -17.619 6.884 1.00 0.00 H new ATOM 0 HB2 GLU B 32 66.493 -16.234 7.489 1.00 0.00 H new ATOM 0 HB3 GLU B 32 64.943 -15.619 8.028 1.00 0.00 H new ATOM 0 HG2 GLU B 32 64.499 -17.927 9.068 1.00 0.00 H new ATOM 0 HG3 GLU B 32 66.161 -18.340 8.696 1.00 0.00 H new ATOM 2381 N LEU B 33 65.400 -15.764 4.620 1.00 0.00 N ATOM 2382 CA LEU B 33 65.063 -14.740 3.575 1.00 0.00 C ATOM 2383 C LEU B 33 63.951 -15.268 2.680 1.00 0.00 C ATOM 2384 O LEU B 33 63.016 -14.577 2.356 1.00 0.00 O ATOM 2385 CB LEU B 33 66.275 -14.405 2.683 1.00 0.00 C ATOM 2386 CG LEU B 33 66.740 -15.603 1.834 1.00 0.00 C ATOM 2387 CD1 LEU B 33 66.122 -15.584 0.413 1.00 0.00 C ATOM 2388 CD2 LEU B 33 68.244 -15.524 1.670 1.00 0.00 C ATOM 0 H LEU B 33 66.350 -16.133 4.589 1.00 0.00 H new ATOM 0 HA LEU B 33 64.751 -13.836 4.099 1.00 0.00 H new ATOM 0 HB2 LEU B 33 66.017 -13.576 2.023 1.00 0.00 H new ATOM 0 HB3 LEU B 33 67.100 -14.068 3.310 1.00 0.00 H new ATOM 0 HG LEU B 33 66.425 -16.512 2.346 1.00 0.00 H new ATOM 0 HD11 LEU B 33 66.478 -16.447 -0.150 1.00 0.00 H new ATOM 0 HD12 LEU B 33 65.035 -15.623 0.488 1.00 0.00 H new ATOM 0 HD13 LEU B 33 66.418 -14.669 -0.100 1.00 0.00 H new ATOM 0 HD21 LEU B 33 68.589 -16.366 1.070 1.00 0.00 H new ATOM 0 HD22 LEU B 33 68.507 -14.591 1.171 1.00 0.00 H new ATOM 0 HD23 LEU B 33 68.719 -15.557 2.650 1.00 0.00 H new ATOM 2400 N LYS B 34 64.061 -16.497 2.258 1.00 0.00 N ATOM 2401 CA LYS B 34 63.019 -17.066 1.353 1.00 0.00 C ATOM 2402 C LYS B 34 61.636 -17.061 2.024 1.00 0.00 C ATOM 2403 O LYS B 34 60.628 -16.843 1.387 1.00 0.00 O ATOM 2404 CB LYS B 34 63.398 -18.500 0.978 1.00 0.00 C ATOM 2405 CG LYS B 34 62.467 -18.983 -0.133 1.00 0.00 C ATOM 2406 CD LYS B 34 62.894 -20.370 -0.611 1.00 0.00 C ATOM 2407 CE LYS B 34 61.963 -20.832 -1.735 1.00 0.00 C ATOM 2408 NZ LYS B 34 60.667 -21.286 -1.153 1.00 0.00 N ATOM 0 H LYS B 34 64.823 -17.131 2.498 1.00 0.00 H new ATOM 0 HA LYS B 34 62.967 -16.446 0.458 1.00 0.00 H new ATOM 0 HB2 LYS B 34 64.435 -18.541 0.645 1.00 0.00 H new ATOM 0 HB3 LYS B 34 63.316 -19.151 1.848 1.00 0.00 H new ATOM 0 HG2 LYS B 34 61.440 -19.016 0.231 1.00 0.00 H new ATOM 0 HG3 LYS B 34 62.488 -18.281 -0.966 1.00 0.00 H new ATOM 0 HD2 LYS B 34 63.924 -20.343 -0.966 1.00 0.00 H new ATOM 0 HD3 LYS B 34 62.861 -21.078 0.217 1.00 0.00 H new ATOM 0 HE2 LYS B 34 61.792 -20.017 -2.438 1.00 0.00 H new ATOM 0 HE3 LYS B 34 62.427 -21.644 -2.295 1.00 0.00 H new ATOM 0 HZ1 LYS B 34 60.073 -21.694 -1.903 1.00 0.00 H new ATOM 0 HZ2 LYS B 34 60.847 -22.006 -0.424 1.00 0.00 H new ATOM 0 HZ3 LYS B 34 60.176 -20.475 -0.725 1.00 0.00 H new ATOM 2422 N ASP B 35 61.586 -17.345 3.291 1.00 0.00 N ATOM 2423 CA ASP B 35 60.279 -17.410 4.019 1.00 0.00 C ATOM 2424 C ASP B 35 59.678 -16.012 4.219 1.00 0.00 C ATOM 2425 O ASP B 35 58.489 -15.803 4.085 1.00 0.00 O ATOM 2426 CB ASP B 35 60.524 -18.038 5.392 1.00 0.00 C ATOM 2427 CG ASP B 35 60.855 -19.522 5.224 1.00 0.00 C ATOM 2428 OD1 ASP B 35 60.429 -20.097 4.236 1.00 0.00 O ATOM 2429 OD2 ASP B 35 61.536 -20.057 6.084 1.00 0.00 O ATOM 0 H ASP B 35 62.404 -17.539 3.868 1.00 0.00 H new ATOM 0 HA ASP B 35 59.580 -18.002 3.429 1.00 0.00 H new ATOM 0 HB2 ASP B 35 61.344 -17.527 5.896 1.00 0.00 H new ATOM 0 HB3 ASP B 35 59.641 -17.921 6.020 1.00 0.00 H new ATOM 2434 N LEU B 36 60.496 -15.073 4.575 1.00 0.00 N ATOM 2435 CA LEU B 36 60.022 -13.687 4.837 1.00 0.00 C ATOM 2436 C LEU B 36 59.436 -13.068 3.563 1.00 0.00 C ATOM 2437 O LEU B 36 58.361 -12.503 3.566 1.00 0.00 O ATOM 2438 CB LEU B 36 61.243 -12.877 5.297 1.00 0.00 C ATOM 2439 CG LEU B 36 60.867 -11.430 5.648 1.00 0.00 C ATOM 2440 CD1 LEU B 36 60.091 -11.395 6.968 1.00 0.00 C ATOM 2441 CD2 LEU B 36 62.153 -10.613 5.796 1.00 0.00 C ATOM 0 H LEU B 36 61.499 -15.207 4.700 1.00 0.00 H new ATOM 0 HA LEU B 36 59.239 -13.687 5.595 1.00 0.00 H new ATOM 0 HB2 LEU B 36 61.691 -13.357 6.167 1.00 0.00 H new ATOM 0 HB3 LEU B 36 61.997 -12.876 4.509 1.00 0.00 H new ATOM 0 HG LEU B 36 60.242 -11.013 4.859 1.00 0.00 H new ATOM 0 HD11 LEU B 36 59.829 -10.365 7.209 1.00 0.00 H new ATOM 0 HD12 LEU B 36 59.181 -11.988 6.871 1.00 0.00 H new ATOM 0 HD13 LEU B 36 60.710 -11.807 7.765 1.00 0.00 H new ATOM 0 HD21 LEU B 36 61.902 -9.582 6.045 1.00 0.00 H new ATOM 0 HD22 LEU B 36 62.766 -11.040 6.590 1.00 0.00 H new ATOM 0 HD23 LEU B 36 62.708 -10.635 4.858 1.00 0.00 H new ATOM 2453 N LEU B 37 60.159 -13.145 2.488 1.00 0.00 N ATOM 2454 CA LEU B 37 59.694 -12.538 1.212 1.00 0.00 C ATOM 2455 C LEU B 37 58.508 -13.300 0.600 1.00 0.00 C ATOM 2456 O LEU B 37 57.589 -12.713 0.073 1.00 0.00 O ATOM 2457 CB LEU B 37 60.864 -12.571 0.208 1.00 0.00 C ATOM 2458 CG LEU B 37 61.831 -11.389 0.447 1.00 0.00 C ATOM 2459 CD1 LEU B 37 61.150 -10.047 0.095 1.00 0.00 C ATOM 2460 CD2 LEU B 37 62.299 -11.367 1.913 1.00 0.00 C ATOM 0 H LEU B 37 61.066 -13.609 2.436 1.00 0.00 H new ATOM 0 HA LEU B 37 59.365 -11.521 1.423 1.00 0.00 H new ATOM 0 HB2 LEU B 37 61.404 -13.513 0.304 1.00 0.00 H new ATOM 0 HB3 LEU B 37 60.476 -12.528 -0.810 1.00 0.00 H new ATOM 0 HG LEU B 37 62.697 -11.523 -0.201 1.00 0.00 H new ATOM 0 HD11 LEU B 37 61.848 -9.228 0.270 1.00 0.00 H new ATOM 0 HD12 LEU B 37 60.854 -10.053 -0.954 1.00 0.00 H new ATOM 0 HD13 LEU B 37 60.267 -9.912 0.720 1.00 0.00 H new ATOM 0 HD21 LEU B 37 62.979 -10.529 2.065 1.00 0.00 H new ATOM 0 HD22 LEU B 37 61.435 -11.257 2.569 1.00 0.00 H new ATOM 0 HD23 LEU B 37 62.814 -12.299 2.144 1.00 0.00 H new ATOM 2472 N GLN B 38 58.557 -14.604 0.606 1.00 0.00 N ATOM 2473 CA GLN B 38 57.475 -15.403 -0.047 1.00 0.00 C ATOM 2474 C GLN B 38 56.146 -15.319 0.699 1.00 0.00 C ATOM 2475 O GLN B 38 55.089 -15.277 0.114 1.00 0.00 O ATOM 2476 CB GLN B 38 57.912 -16.873 -0.081 1.00 0.00 C ATOM 2477 CG GLN B 38 57.753 -17.543 1.289 1.00 0.00 C ATOM 2478 CD GLN B 38 58.439 -18.911 1.261 1.00 0.00 C ATOM 2479 OE1 GLN B 38 59.018 -19.314 0.163 1.00 0.00 O flip ATOM 2480 NE2 GLN B 38 58.438 -19.627 2.243 1.00 0.00 N flip ATOM 0 H GLN B 38 59.301 -15.154 1.036 1.00 0.00 H new ATOM 0 HA GLN B 38 57.323 -14.995 -1.046 1.00 0.00 H new ATOM 0 HB2 GLN B 38 57.320 -17.412 -0.821 1.00 0.00 H new ATOM 0 HB3 GLN B 38 58.953 -16.936 -0.399 1.00 0.00 H new ATOM 0 HG2 GLN B 38 58.192 -16.918 2.066 1.00 0.00 H new ATOM 0 HG3 GLN B 38 56.696 -17.657 1.531 1.00 0.00 H new ATOM 0 HE21 GLN B 38 57.986 -19.314 3.102 1.00 0.00 H new ATOM 0 HE22 GLN B 38 58.889 -20.541 2.208 1.00 0.00 H new ATOM 2489 N THR B 39 56.201 -15.375 1.997 1.00 0.00 N ATOM 2490 CA THR B 39 54.949 -15.403 2.795 1.00 0.00 C ATOM 2491 C THR B 39 54.011 -14.274 2.391 1.00 0.00 C ATOM 2492 O THR B 39 52.830 -14.487 2.206 1.00 0.00 O ATOM 2493 CB THR B 39 55.297 -15.267 4.280 1.00 0.00 C ATOM 2494 OG1 THR B 39 56.139 -16.345 4.667 1.00 0.00 O ATOM 2495 CG2 THR B 39 54.016 -15.297 5.116 1.00 0.00 C ATOM 0 H THR B 39 57.063 -15.403 2.542 1.00 0.00 H new ATOM 0 HA THR B 39 54.442 -16.350 2.609 1.00 0.00 H new ATOM 0 HB THR B 39 55.812 -14.321 4.445 1.00 0.00 H new ATOM 0 HG1 THR B 39 57.055 -16.018 4.786 1.00 0.00 H new ATOM 0 HG21 THR B 39 54.268 -15.200 6.172 1.00 0.00 H new ATOM 0 HG22 THR B 39 53.369 -14.471 4.820 1.00 0.00 H new ATOM 0 HG23 THR B 39 53.497 -16.241 4.952 1.00 0.00 H new ATOM 2503 N GLU B 40 54.503 -13.067 2.302 1.00 0.00 N ATOM 2504 CA GLU B 40 53.599 -11.916 1.965 1.00 0.00 C ATOM 2505 C GLU B 40 53.708 -11.540 0.488 1.00 0.00 C ATOM 2506 O GLU B 40 52.800 -10.952 -0.067 1.00 0.00 O ATOM 2507 CB GLU B 40 53.992 -10.718 2.827 1.00 0.00 C ATOM 2508 CG GLU B 40 53.660 -11.020 4.289 1.00 0.00 C ATOM 2509 CD GLU B 40 54.051 -9.827 5.163 1.00 0.00 C ATOM 2510 OE1 GLU B 40 54.679 -8.920 4.646 1.00 0.00 O ATOM 2511 OE2 GLU B 40 53.720 -9.844 6.337 1.00 0.00 O ATOM 0 H GLU B 40 55.483 -12.824 2.446 1.00 0.00 H new ATOM 0 HA GLU B 40 52.568 -12.209 2.162 1.00 0.00 H new ATOM 0 HB2 GLU B 40 55.057 -10.511 2.719 1.00 0.00 H new ATOM 0 HB3 GLU B 40 53.458 -9.827 2.497 1.00 0.00 H new ATOM 0 HG2 GLU B 40 52.595 -11.227 4.395 1.00 0.00 H new ATOM 0 HG3 GLU B 40 54.193 -11.913 4.616 1.00 0.00 H new ATOM 2518 N LEU B 41 54.796 -11.877 -0.160 1.00 0.00 N ATOM 2519 CA LEU B 41 54.949 -11.544 -1.616 1.00 0.00 C ATOM 2520 C LEU B 41 55.132 -12.850 -2.391 1.00 0.00 C ATOM 2521 O LEU B 41 55.787 -12.901 -3.414 1.00 0.00 O ATOM 2522 CB LEU B 41 56.149 -10.610 -1.817 1.00 0.00 C ATOM 2523 CG LEU B 41 55.938 -9.319 -1.008 1.00 0.00 C ATOM 2524 CD1 LEU B 41 57.165 -8.414 -1.165 1.00 0.00 C ATOM 2525 CD2 LEU B 41 54.683 -8.575 -1.508 1.00 0.00 C ATOM 0 H LEU B 41 55.587 -12.369 0.255 1.00 0.00 H new ATOM 0 HA LEU B 41 54.063 -11.027 -1.984 1.00 0.00 H new ATOM 0 HB2 LEU B 41 57.066 -11.105 -1.498 1.00 0.00 H new ATOM 0 HB3 LEU B 41 56.266 -10.374 -2.875 1.00 0.00 H new ATOM 0 HG LEU B 41 55.801 -9.576 0.042 1.00 0.00 H new ATOM 0 HD11 LEU B 41 57.017 -7.498 -0.592 1.00 0.00 H new ATOM 0 HD12 LEU B 41 58.050 -8.934 -0.797 1.00 0.00 H new ATOM 0 HD13 LEU B 41 57.302 -8.166 -2.217 1.00 0.00 H new ATOM 0 HD21 LEU B 41 54.545 -7.663 -0.927 1.00 0.00 H new ATOM 0 HD22 LEU B 41 54.807 -8.320 -2.560 1.00 0.00 H new ATOM 0 HD23 LEU B 41 53.809 -9.216 -1.390 1.00 0.00 H new ATOM 2537 N SER B 42 54.535 -13.906 -1.903 1.00 0.00 N ATOM 2538 CA SER B 42 54.638 -15.225 -2.588 1.00 0.00 C ATOM 2539 C SER B 42 54.302 -15.060 -4.068 1.00 0.00 C ATOM 2540 O SER B 42 55.099 -15.346 -4.934 1.00 0.00 O ATOM 2541 CB SER B 42 53.612 -16.195 -1.953 1.00 0.00 C ATOM 2542 OG SER B 42 52.579 -15.437 -1.335 1.00 0.00 O ATOM 0 H SER B 42 53.975 -13.909 -1.050 1.00 0.00 H new ATOM 0 HA SER B 42 55.650 -15.615 -2.482 1.00 0.00 H new ATOM 0 HB2 SER B 42 53.193 -16.851 -2.715 1.00 0.00 H new ATOM 0 HB3 SER B 42 54.102 -16.833 -1.218 1.00 0.00 H new ATOM 0 HG SER B 42 51.924 -16.044 -0.932 1.00 0.00 H new ATOM 2548 N SER B 43 53.108 -14.633 -4.347 1.00 0.00 N ATOM 2549 CA SER B 43 52.666 -14.486 -5.755 1.00 0.00 C ATOM 2550 C SER B 43 53.369 -13.328 -6.469 1.00 0.00 C ATOM 2551 O SER B 43 53.372 -13.284 -7.684 1.00 0.00 O ATOM 2552 CB SER B 43 51.157 -14.245 -5.774 1.00 0.00 C ATOM 2553 OG SER B 43 50.873 -12.995 -5.158 1.00 0.00 O ATOM 0 H SER B 43 52.410 -14.376 -3.649 1.00 0.00 H new ATOM 0 HA SER B 43 52.925 -15.403 -6.285 1.00 0.00 H new ATOM 0 HB2 SER B 43 50.789 -14.250 -6.800 1.00 0.00 H new ATOM 0 HB3 SER B 43 50.642 -15.048 -5.247 1.00 0.00 H new ATOM 0 HG SER B 43 49.906 -12.837 -5.170 1.00 0.00 H new ATOM 2559 N PHE B 44 53.934 -12.363 -5.767 1.00 0.00 N ATOM 2560 CA PHE B 44 54.567 -11.223 -6.512 1.00 0.00 C ATOM 2561 C PHE B 44 56.044 -11.495 -6.830 1.00 0.00 C ATOM 2562 O PHE B 44 56.380 -12.017 -7.872 1.00 0.00 O ATOM 2563 CB PHE B 44 54.482 -9.926 -5.681 1.00 0.00 C ATOM 2564 CG PHE B 44 55.298 -8.786 -6.323 1.00 0.00 C ATOM 2565 CD1 PHE B 44 55.608 -8.779 -7.708 1.00 0.00 C ATOM 2566 CD2 PHE B 44 55.743 -7.710 -5.522 1.00 0.00 C ATOM 2567 CE1 PHE B 44 56.345 -7.722 -8.258 1.00 0.00 C ATOM 2568 CE2 PHE B 44 56.475 -6.662 -6.089 1.00 0.00 C ATOM 2569 CZ PHE B 44 56.775 -6.669 -7.450 1.00 0.00 C ATOM 0 H PHE B 44 53.983 -12.316 -4.749 1.00 0.00 H new ATOM 0 HA PHE B 44 54.018 -11.115 -7.448 1.00 0.00 H new ATOM 0 HB2 PHE B 44 53.440 -9.620 -5.588 1.00 0.00 H new ATOM 0 HB3 PHE B 44 54.850 -10.115 -4.673 1.00 0.00 H new ATOM 0 HD1 PHE B 44 55.275 -9.590 -8.339 1.00 0.00 H new ATOM 0 HD2 PHE B 44 55.516 -7.697 -4.466 1.00 0.00 H new ATOM 0 HE1 PHE B 44 56.581 -7.722 -9.312 1.00 0.00 H new ATOM 0 HE2 PHE B 44 56.809 -5.843 -5.469 1.00 0.00 H new ATOM 0 HZ PHE B 44 57.342 -5.857 -7.880 1.00 0.00 H new ATOM 2579 N LEU B 45 56.921 -11.106 -5.920 1.00 0.00 N ATOM 2580 CA LEU B 45 58.404 -11.247 -6.141 1.00 0.00 C ATOM 2581 C LEU B 45 58.675 -12.592 -6.837 1.00 0.00 C ATOM 2582 O LEU B 45 57.853 -13.477 -6.734 1.00 0.00 O ATOM 2583 CB LEU B 45 59.108 -11.196 -4.755 1.00 0.00 C ATOM 2584 CG LEU B 45 59.957 -9.907 -4.621 1.00 0.00 C ATOM 2585 CD1 LEU B 45 59.038 -8.656 -4.560 1.00 0.00 C ATOM 2586 CD2 LEU B 45 60.871 -9.989 -3.364 1.00 0.00 C ATOM 0 H LEU B 45 56.666 -10.692 -5.023 1.00 0.00 H new ATOM 0 HA LEU B 45 58.787 -10.443 -6.770 1.00 0.00 H new ATOM 0 HB2 LEU B 45 58.362 -11.231 -3.961 1.00 0.00 H new ATOM 0 HB3 LEU B 45 59.745 -12.072 -4.632 1.00 0.00 H new ATOM 0 HG LEU B 45 60.595 -9.815 -5.500 1.00 0.00 H new ATOM 0 HD11 LEU B 45 59.650 -7.759 -4.466 1.00 0.00 H new ATOM 0 HD12 LEU B 45 58.444 -8.596 -5.472 1.00 0.00 H new ATOM 0 HD13 LEU B 45 58.374 -8.734 -3.699 1.00 0.00 H new ATOM 0 HD21 LEU B 45 61.461 -9.076 -3.283 1.00 0.00 H new ATOM 0 HD22 LEU B 45 60.254 -10.102 -2.472 1.00 0.00 H new ATOM 0 HD23 LEU B 45 61.538 -10.846 -3.455 1.00 0.00 H new ATOM 2598 N ASP B 46 59.788 -12.823 -7.491 1.00 0.00 N ATOM 2599 CA ASP B 46 59.997 -14.184 -8.088 1.00 0.00 C ATOM 2600 C ASP B 46 60.757 -15.063 -7.082 1.00 0.00 C ATOM 2601 O ASP B 46 61.966 -14.987 -6.992 1.00 0.00 O ATOM 2602 CB ASP B 46 60.820 -14.082 -9.374 1.00 0.00 C ATOM 2603 CG ASP B 46 60.333 -12.910 -10.226 1.00 0.00 C ATOM 2604 OD1 ASP B 46 59.498 -12.154 -9.759 1.00 0.00 O ATOM 2605 OD2 ASP B 46 60.808 -12.790 -11.335 1.00 0.00 O ATOM 0 H ASP B 46 60.542 -12.151 -7.636 1.00 0.00 H new ATOM 0 HA ASP B 46 59.025 -14.621 -8.319 1.00 0.00 H new ATOM 0 HB2 ASP B 46 61.874 -13.949 -9.129 1.00 0.00 H new ATOM 0 HB3 ASP B 46 60.739 -15.010 -9.940 1.00 0.00 H new ATOM 2610 N VAL B 47 60.074 -15.905 -6.341 1.00 0.00 N ATOM 2611 CA VAL B 47 60.778 -16.804 -5.356 1.00 0.00 C ATOM 2612 C VAL B 47 60.326 -18.246 -5.592 1.00 0.00 C ATOM 2613 O VAL B 47 61.023 -19.052 -6.177 1.00 0.00 O ATOM 2614 CB VAL B 47 60.420 -16.409 -3.900 1.00 0.00 C ATOM 2615 CG1 VAL B 47 60.895 -17.491 -2.924 1.00 0.00 C ATOM 2616 CG2 VAL B 47 61.099 -15.090 -3.512 1.00 0.00 C ATOM 0 H VAL B 47 59.060 -16.012 -6.372 1.00 0.00 H new ATOM 0 HA VAL B 47 61.854 -16.704 -5.499 1.00 0.00 H new ATOM 0 HB VAL B 47 59.337 -16.298 -3.846 1.00 0.00 H new ATOM 0 HG11 VAL B 47 60.637 -17.201 -1.905 1.00 0.00 H new ATOM 0 HG12 VAL B 47 60.410 -18.437 -3.165 1.00 0.00 H new ATOM 0 HG13 VAL B 47 61.976 -17.606 -3.006 1.00 0.00 H new ATOM 0 HG21 VAL B 47 60.834 -14.832 -2.487 1.00 0.00 H new ATOM 0 HG22 VAL B 47 62.181 -15.201 -3.590 1.00 0.00 H new ATOM 0 HG23 VAL B 47 60.766 -14.298 -4.183 1.00 0.00 H new ATOM 2626 N GLN B 48 59.168 -18.567 -5.096 1.00 0.00 N ATOM 2627 CA GLN B 48 58.629 -19.945 -5.220 1.00 0.00 C ATOM 2628 C GLN B 48 58.416 -20.341 -6.687 1.00 0.00 C ATOM 2629 O GLN B 48 58.687 -21.459 -7.076 1.00 0.00 O ATOM 2630 CB GLN B 48 57.309 -20.014 -4.439 1.00 0.00 C ATOM 2631 CG GLN B 48 57.601 -20.126 -2.940 1.00 0.00 C ATOM 2632 CD GLN B 48 56.283 -20.168 -2.168 1.00 0.00 C ATOM 2633 OE1 GLN B 48 55.797 -21.229 -1.831 1.00 0.00 O ATOM 2634 NE2 GLN B 48 55.678 -19.049 -1.875 1.00 0.00 N ATOM 0 H GLN B 48 58.559 -17.917 -4.599 1.00 0.00 H new ATOM 0 HA GLN B 48 59.349 -20.653 -4.808 1.00 0.00 H new ATOM 0 HB2 GLN B 48 56.711 -19.124 -4.637 1.00 0.00 H new ATOM 0 HB3 GLN B 48 56.724 -20.872 -4.770 1.00 0.00 H new ATOM 0 HG2 GLN B 48 58.182 -21.026 -2.738 1.00 0.00 H new ATOM 0 HG3 GLN B 48 58.201 -19.278 -2.611 1.00 0.00 H new ATOM 0 HE21 GLN B 48 56.087 -18.159 -2.158 1.00 0.00 H new ATOM 0 HE22 GLN B 48 54.796 -19.065 -1.363 1.00 0.00 H new ATOM 2643 N LYS B 49 57.940 -19.447 -7.501 1.00 0.00 N ATOM 2644 CA LYS B 49 57.721 -19.800 -8.941 1.00 0.00 C ATOM 2645 C LYS B 49 59.090 -20.062 -9.556 1.00 0.00 C ATOM 2646 O LYS B 49 59.218 -20.694 -10.586 1.00 0.00 O ATOM 2647 CB LYS B 49 56.988 -18.670 -9.714 1.00 0.00 C ATOM 2648 CG LYS B 49 56.438 -17.613 -8.752 1.00 0.00 C ATOM 2649 CD LYS B 49 55.329 -18.214 -7.881 1.00 0.00 C ATOM 2650 CE LYS B 49 55.117 -17.323 -6.661 1.00 0.00 C ATOM 2651 NZ LYS B 49 53.963 -17.832 -5.863 1.00 0.00 N ATOM 0 H LYS B 49 57.692 -18.492 -7.242 1.00 0.00 H new ATOM 0 HA LYS B 49 57.083 -20.681 -9.007 1.00 0.00 H new ATOM 0 HB2 LYS B 49 57.675 -18.202 -10.419 1.00 0.00 H new ATOM 0 HB3 LYS B 49 56.172 -19.095 -10.298 1.00 0.00 H new ATOM 0 HG2 LYS B 49 57.241 -17.233 -8.120 1.00 0.00 H new ATOM 0 HG3 LYS B 49 56.048 -16.766 -9.316 1.00 0.00 H new ATOM 0 HD2 LYS B 49 54.404 -18.296 -8.452 1.00 0.00 H new ATOM 0 HD3 LYS B 49 55.601 -19.222 -7.568 1.00 0.00 H new ATOM 0 HE2 LYS B 49 56.018 -17.309 -6.048 1.00 0.00 H new ATOM 0 HE3 LYS B 49 54.930 -16.296 -6.976 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 54.066 -17.531 -4.873 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 53.077 -17.450 -6.251 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 53.941 -18.871 -5.908 1.00 0.00 H new ATOM 2665 N ASP B 50 60.113 -19.596 -8.912 1.00 0.00 N ATOM 2666 CA ASP B 50 61.487 -19.821 -9.419 1.00 0.00 C ATOM 2667 C ASP B 50 62.420 -19.961 -8.224 1.00 0.00 C ATOM 2668 O ASP B 50 63.000 -19.005 -7.761 1.00 0.00 O ATOM 2669 CB ASP B 50 61.911 -18.628 -10.280 1.00 0.00 C ATOM 2670 CG ASP B 50 61.215 -18.702 -11.640 1.00 0.00 C ATOM 2671 OD1 ASP B 50 60.897 -19.799 -12.062 1.00 0.00 O ATOM 2672 OD2 ASP B 50 61.010 -17.657 -12.235 1.00 0.00 O ATOM 0 H ASP B 50 60.056 -19.062 -8.045 1.00 0.00 H new ATOM 0 HA ASP B 50 61.527 -20.725 -10.027 1.00 0.00 H new ATOM 0 HB2 ASP B 50 61.653 -17.695 -9.779 1.00 0.00 H new ATOM 0 HB3 ASP B 50 62.993 -18.629 -10.413 1.00 0.00 H new ATOM 2677 N ALA B 51 62.587 -21.150 -7.721 1.00 0.00 N ATOM 2678 CA ALA B 51 63.500 -21.323 -6.564 1.00 0.00 C ATOM 2679 C ALA B 51 64.858 -20.777 -6.985 1.00 0.00 C ATOM 2680 O ALA B 51 65.586 -20.198 -6.208 1.00 0.00 O ATOM 2681 CB ALA B 51 63.592 -22.802 -6.206 1.00 0.00 C ATOM 0 H ALA B 51 62.135 -22.000 -8.058 1.00 0.00 H new ATOM 0 HA ALA B 51 63.139 -20.792 -5.683 1.00 0.00 H new ATOM 0 HB1 ALA B 51 64.263 -22.930 -5.356 1.00 0.00 H new ATOM 0 HB2 ALA B 51 62.602 -23.176 -5.946 1.00 0.00 H new ATOM 0 HB3 ALA B 51 63.978 -23.360 -7.059 1.00 0.00 H new ATOM 2687 N ASP B 52 65.160 -20.903 -8.242 1.00 0.00 N ATOM 2688 CA ASP B 52 66.425 -20.344 -8.776 1.00 0.00 C ATOM 2689 C ASP B 52 66.411 -18.836 -8.539 1.00 0.00 C ATOM 2690 O ASP B 52 67.420 -18.237 -8.246 1.00 0.00 O ATOM 2691 CB ASP B 52 66.489 -20.600 -10.284 1.00 0.00 C ATOM 2692 CG ASP B 52 66.697 -22.095 -10.542 1.00 0.00 C ATOM 2693 OD1 ASP B 52 67.180 -22.769 -9.648 1.00 0.00 O ATOM 2694 OD2 ASP B 52 66.367 -22.539 -11.630 1.00 0.00 O ATOM 0 H ASP B 52 64.576 -21.376 -8.931 1.00 0.00 H new ATOM 0 HA ASP B 52 67.282 -20.807 -8.286 1.00 0.00 H new ATOM 0 HB2 ASP B 52 65.568 -20.263 -10.760 1.00 0.00 H new ATOM 0 HB3 ASP B 52 67.304 -20.027 -10.726 1.00 0.00 H new ATOM 2699 N ALA B 53 65.281 -18.214 -8.724 1.00 0.00 N ATOM 2700 CA ALA B 53 65.232 -16.732 -8.565 1.00 0.00 C ATOM 2701 C ALA B 53 65.693 -16.342 -7.155 1.00 0.00 C ATOM 2702 O ALA B 53 66.421 -15.382 -6.986 1.00 0.00 O ATOM 2703 CB ALA B 53 63.815 -16.206 -8.828 1.00 0.00 C ATOM 0 H ALA B 53 64.399 -18.659 -8.975 1.00 0.00 H new ATOM 0 HA ALA B 53 65.904 -16.280 -9.295 1.00 0.00 H new ATOM 0 HB1 ALA B 53 63.801 -15.123 -8.707 1.00 0.00 H new ATOM 0 HB2 ALA B 53 63.515 -16.461 -9.844 1.00 0.00 H new ATOM 0 HB3 ALA B 53 63.121 -16.659 -8.120 1.00 0.00 H new ATOM 2709 N VAL B 54 65.301 -17.061 -6.141 1.00 0.00 N ATOM 2710 CA VAL B 54 65.756 -16.686 -4.770 1.00 0.00 C ATOM 2711 C VAL B 54 67.290 -16.744 -4.722 1.00 0.00 C ATOM 2712 O VAL B 54 67.934 -15.931 -4.101 1.00 0.00 O ATOM 2713 CB VAL B 54 65.126 -17.646 -3.716 1.00 0.00 C ATOM 2714 CG1 VAL B 54 66.076 -18.804 -3.349 1.00 0.00 C ATOM 2715 CG2 VAL B 54 64.793 -16.861 -2.439 1.00 0.00 C ATOM 0 H VAL B 54 64.695 -17.880 -6.197 1.00 0.00 H new ATOM 0 HA VAL B 54 65.432 -15.673 -4.534 1.00 0.00 H new ATOM 0 HB VAL B 54 64.224 -18.069 -4.158 1.00 0.00 H new ATOM 0 HG11 VAL B 54 65.597 -19.448 -2.612 1.00 0.00 H new ATOM 0 HG12 VAL B 54 66.305 -19.384 -4.243 1.00 0.00 H new ATOM 0 HG13 VAL B 54 66.998 -18.400 -2.932 1.00 0.00 H new ATOM 0 HG21 VAL B 54 64.353 -17.534 -1.703 1.00 0.00 H new ATOM 0 HG22 VAL B 54 65.705 -16.425 -2.032 1.00 0.00 H new ATOM 0 HG23 VAL B 54 64.085 -16.067 -2.674 1.00 0.00 H new ATOM 2725 N ASP B 55 67.860 -17.727 -5.360 1.00 0.00 N ATOM 2726 CA ASP B 55 69.345 -17.896 -5.356 1.00 0.00 C ATOM 2727 C ASP B 55 70.036 -16.705 -6.028 1.00 0.00 C ATOM 2728 O ASP B 55 71.062 -16.249 -5.577 1.00 0.00 O ATOM 2729 CB ASP B 55 69.706 -19.170 -6.125 1.00 0.00 C ATOM 2730 CG ASP B 55 69.263 -20.393 -5.322 1.00 0.00 C ATOM 2731 OD1 ASP B 55 69.090 -20.259 -4.122 1.00 0.00 O ATOM 2732 OD2 ASP B 55 69.103 -21.442 -5.921 1.00 0.00 O ATOM 0 H ASP B 55 67.354 -18.434 -5.894 1.00 0.00 H new ATOM 0 HA ASP B 55 69.682 -17.960 -4.321 1.00 0.00 H new ATOM 0 HB2 ASP B 55 69.221 -19.168 -7.101 1.00 0.00 H new ATOM 0 HB3 ASP B 55 70.781 -19.208 -6.303 1.00 0.00 H new ATOM 2737 N LYS B 56 69.492 -16.198 -7.101 1.00 0.00 N ATOM 2738 CA LYS B 56 70.139 -15.039 -7.783 1.00 0.00 C ATOM 2739 C LYS B 56 70.161 -13.854 -6.817 1.00 0.00 C ATOM 2740 O LYS B 56 71.124 -13.123 -6.736 1.00 0.00 O ATOM 2741 CB LYS B 56 69.348 -14.678 -9.057 1.00 0.00 C ATOM 2742 CG LYS B 56 69.851 -15.503 -10.255 1.00 0.00 C ATOM 2743 CD LYS B 56 69.515 -16.983 -10.059 1.00 0.00 C ATOM 2744 CE LYS B 56 70.061 -17.790 -11.240 1.00 0.00 C ATOM 2745 NZ LYS B 56 71.538 -17.615 -11.323 1.00 0.00 N ATOM 0 H LYS B 56 68.632 -16.534 -7.534 1.00 0.00 H new ATOM 0 HA LYS B 56 71.159 -15.293 -8.071 1.00 0.00 H new ATOM 0 HB2 LYS B 56 68.286 -14.866 -8.898 1.00 0.00 H new ATOM 0 HB3 LYS B 56 69.455 -13.614 -9.270 1.00 0.00 H new ATOM 0 HG2 LYS B 56 69.393 -15.138 -11.174 1.00 0.00 H new ATOM 0 HG3 LYS B 56 70.928 -15.379 -10.364 1.00 0.00 H new ATOM 0 HD2 LYS B 56 69.948 -17.345 -9.126 1.00 0.00 H new ATOM 0 HD3 LYS B 56 68.436 -17.115 -9.982 1.00 0.00 H new ATOM 0 HE2 LYS B 56 69.816 -18.845 -11.117 1.00 0.00 H new ATOM 0 HE3 LYS B 56 69.593 -17.460 -12.167 1.00 0.00 H new ATOM 0 HZ1 LYS B 56 71.949 -18.393 -11.877 1.00 0.00 H new ATOM 0 HZ2 LYS B 56 71.755 -16.709 -11.785 1.00 0.00 H new ATOM 0 HZ3 LYS B 56 71.943 -17.621 -10.365 1.00 0.00 H new ATOM 2759 N ILE B 57 69.104 -13.670 -6.085 1.00 0.00 N ATOM 2760 CA ILE B 57 69.040 -12.550 -5.109 1.00 0.00 C ATOM 2761 C ILE B 57 70.110 -12.729 -4.010 1.00 0.00 C ATOM 2762 O ILE B 57 70.809 -11.800 -3.661 1.00 0.00 O ATOM 2763 CB ILE B 57 67.624 -12.536 -4.511 1.00 0.00 C ATOM 2764 CG1 ILE B 57 66.600 -12.040 -5.569 1.00 0.00 C ATOM 2765 CG2 ILE B 57 67.574 -11.654 -3.269 1.00 0.00 C ATOM 2766 CD1 ILE B 57 66.950 -10.631 -6.077 1.00 0.00 C ATOM 0 H ILE B 57 68.269 -14.255 -6.121 1.00 0.00 H new ATOM 0 HA ILE B 57 69.245 -11.599 -5.600 1.00 0.00 H new ATOM 0 HB ILE B 57 67.362 -13.553 -4.219 1.00 0.00 H new ATOM 0 HG12 ILE B 57 66.577 -12.735 -6.408 1.00 0.00 H new ATOM 0 HG13 ILE B 57 65.601 -12.033 -5.134 1.00 0.00 H new ATOM 0 HG21 ILE B 57 66.563 -11.657 -2.861 1.00 0.00 H new ATOM 0 HG22 ILE B 57 68.268 -12.038 -2.522 1.00 0.00 H new ATOM 0 HG23 ILE B 57 67.854 -10.635 -3.535 1.00 0.00 H new ATOM 0 HD11 ILE B 57 66.212 -10.317 -6.815 1.00 0.00 H new ATOM 0 HD12 ILE B 57 66.947 -9.932 -5.241 1.00 0.00 H new ATOM 0 HD13 ILE B 57 67.939 -10.645 -6.535 1.00 0.00 H new ATOM 2778 N MET B 58 70.237 -13.908 -3.463 1.00 0.00 N ATOM 2779 CA MET B 58 71.255 -14.132 -2.387 1.00 0.00 C ATOM 2780 C MET B 58 72.637 -13.823 -2.932 1.00 0.00 C ATOM 2781 O MET B 58 73.461 -13.246 -2.261 1.00 0.00 O ATOM 2782 CB MET B 58 71.213 -15.594 -1.908 1.00 0.00 C ATOM 2783 CG MET B 58 70.261 -15.723 -0.735 1.00 0.00 C ATOM 2784 SD MET B 58 71.005 -14.915 0.706 1.00 0.00 S ATOM 2785 CE MET B 58 71.857 -16.352 1.392 1.00 0.00 C ATOM 0 H MET B 58 69.682 -14.727 -3.712 1.00 0.00 H new ATOM 0 HA MET B 58 71.031 -13.477 -1.545 1.00 0.00 H new ATOM 0 HB2 MET B 58 70.892 -16.244 -2.722 1.00 0.00 H new ATOM 0 HB3 MET B 58 72.211 -15.919 -1.615 1.00 0.00 H new ATOM 0 HG2 MET B 58 69.302 -15.263 -0.974 1.00 0.00 H new ATOM 0 HG3 MET B 58 70.065 -16.774 -0.520 1.00 0.00 H new ATOM 0 HE1 MET B 58 72.266 -16.100 2.370 1.00 0.00 H new ATOM 0 HE2 MET B 58 71.153 -17.177 1.495 1.00 0.00 H new ATOM 0 HE3 MET B 58 72.667 -16.647 0.725 1.00 0.00 H new ATOM 2795 N LYS B 59 72.900 -14.192 -4.128 1.00 0.00 N ATOM 2796 CA LYS B 59 74.242 -13.902 -4.693 1.00 0.00 C ATOM 2797 C LYS B 59 74.439 -12.390 -4.683 1.00 0.00 C ATOM 2798 O LYS B 59 75.452 -11.873 -4.261 1.00 0.00 O ATOM 2799 CB LYS B 59 74.311 -14.439 -6.126 1.00 0.00 C ATOM 2800 CG LYS B 59 75.692 -14.155 -6.744 1.00 0.00 C ATOM 2801 CD LYS B 59 76.809 -14.957 -6.019 1.00 0.00 C ATOM 2802 CE LYS B 59 77.696 -14.015 -5.187 1.00 0.00 C ATOM 2803 NZ LYS B 59 78.379 -13.048 -6.093 1.00 0.00 N ATOM 0 H LYS B 59 72.256 -14.681 -4.749 1.00 0.00 H new ATOM 0 HA LYS B 59 75.025 -14.380 -4.105 1.00 0.00 H new ATOM 0 HB2 LYS B 59 74.119 -15.512 -6.128 1.00 0.00 H new ATOM 0 HB3 LYS B 59 73.533 -13.975 -6.732 1.00 0.00 H new ATOM 0 HG2 LYS B 59 75.681 -14.417 -7.802 1.00 0.00 H new ATOM 0 HG3 LYS B 59 75.908 -13.088 -6.682 1.00 0.00 H new ATOM 0 HD2 LYS B 59 76.361 -15.711 -5.371 1.00 0.00 H new ATOM 0 HD3 LYS B 59 77.418 -15.487 -6.751 1.00 0.00 H new ATOM 0 HE2 LYS B 59 77.091 -13.480 -4.456 1.00 0.00 H new ATOM 0 HE3 LYS B 59 78.434 -14.591 -4.629 1.00 0.00 H new ATOM 0 HZ1 LYS B 59 79.303 -12.790 -5.692 1.00 0.00 H new ATOM 0 HZ2 LYS B 59 78.517 -13.485 -7.027 1.00 0.00 H new ATOM 0 HZ3 LYS B 59 77.794 -12.194 -6.193 1.00 0.00 H new ATOM 2817 N GLU B 60 73.455 -11.685 -5.131 1.00 0.00 N ATOM 2818 CA GLU B 60 73.533 -10.208 -5.152 1.00 0.00 C ATOM 2819 C GLU B 60 73.621 -9.680 -3.716 1.00 0.00 C ATOM 2820 O GLU B 60 74.199 -8.643 -3.461 1.00 0.00 O ATOM 2821 CB GLU B 60 72.277 -9.665 -5.831 1.00 0.00 C ATOM 2822 CG GLU B 60 72.335 -8.144 -5.871 1.00 0.00 C ATOM 2823 CD GLU B 60 71.089 -7.607 -6.569 1.00 0.00 C ATOM 2824 OE1 GLU B 60 70.282 -8.413 -7.001 1.00 0.00 O ATOM 2825 OE2 GLU B 60 70.965 -6.398 -6.662 1.00 0.00 O ATOM 0 H GLU B 60 72.583 -12.074 -5.491 1.00 0.00 H new ATOM 0 HA GLU B 60 74.418 -9.885 -5.700 1.00 0.00 H new ATOM 0 HB2 GLU B 60 72.198 -10.063 -6.843 1.00 0.00 H new ATOM 0 HB3 GLU B 60 71.389 -9.991 -5.290 1.00 0.00 H new ATOM 0 HG2 GLU B 60 72.399 -7.745 -4.859 1.00 0.00 H new ATOM 0 HG3 GLU B 60 73.231 -7.817 -6.399 1.00 0.00 H new ATOM 2832 N LEU B 61 73.050 -10.388 -2.778 1.00 0.00 N ATOM 2833 CA LEU B 61 73.090 -9.928 -1.352 1.00 0.00 C ATOM 2834 C LEU B 61 74.250 -10.584 -0.614 1.00 0.00 C ATOM 2835 O LEU B 61 74.658 -10.136 0.439 1.00 0.00 O ATOM 2836 CB LEU B 61 71.797 -10.330 -0.633 1.00 0.00 C ATOM 2837 CG LEU B 61 70.571 -9.604 -1.208 1.00 0.00 C ATOM 2838 CD1 LEU B 61 69.363 -9.904 -0.311 1.00 0.00 C ATOM 2839 CD2 LEU B 61 70.800 -8.082 -1.257 1.00 0.00 C ATOM 0 H LEU B 61 72.556 -11.267 -2.934 1.00 0.00 H new ATOM 0 HA LEU B 61 73.208 -8.844 -1.354 1.00 0.00 H new ATOM 0 HB2 LEU B 61 71.654 -11.407 -0.719 1.00 0.00 H new ATOM 0 HB3 LEU B 61 71.887 -10.104 0.429 1.00 0.00 H new ATOM 0 HG LEU B 61 70.396 -9.955 -2.225 1.00 0.00 H new ATOM 0 HD11 LEU B 61 68.483 -9.396 -0.705 1.00 0.00 H new ATOM 0 HD12 LEU B 61 69.183 -10.979 -0.291 1.00 0.00 H new ATOM 0 HD13 LEU B 61 69.564 -9.551 0.700 1.00 0.00 H new ATOM 0 HD21 LEU B 61 69.916 -7.594 -1.668 1.00 0.00 H new ATOM 0 HD22 LEU B 61 70.985 -7.709 -0.250 1.00 0.00 H new ATOM 0 HD23 LEU B 61 71.662 -7.864 -1.888 1.00 0.00 H new ATOM 2851 N ASP B 62 74.787 -11.641 -1.144 1.00 0.00 N ATOM 2852 CA ASP B 62 75.916 -12.312 -0.454 1.00 0.00 C ATOM 2853 C ASP B 62 77.164 -11.490 -0.707 1.00 0.00 C ATOM 2854 O ASP B 62 78.222 -12.006 -1.007 1.00 0.00 O ATOM 2855 CB ASP B 62 76.086 -13.727 -1.006 1.00 0.00 C ATOM 2856 CG ASP B 62 74.910 -14.587 -0.539 1.00 0.00 C ATOM 2857 OD1 ASP B 62 74.276 -14.207 0.434 1.00 0.00 O ATOM 2858 OD2 ASP B 62 74.665 -15.609 -1.158 1.00 0.00 O ATOM 0 H ASP B 62 74.494 -12.069 -2.023 1.00 0.00 H new ATOM 0 HA ASP B 62 75.729 -12.386 0.617 1.00 0.00 H new ATOM 0 HB2 ASP B 62 76.127 -13.704 -2.095 1.00 0.00 H new ATOM 0 HB3 ASP B 62 77.027 -14.156 -0.661 1.00 0.00 H new ATOM 2863 N GLU B 63 77.033 -10.199 -0.615 1.00 0.00 N ATOM 2864 CA GLU B 63 78.201 -9.330 -0.882 1.00 0.00 C ATOM 2865 C GLU B 63 79.306 -9.672 0.101 1.00 0.00 C ATOM 2866 O GLU B 63 80.466 -9.755 -0.252 1.00 0.00 O ATOM 2867 CB GLU B 63 77.802 -7.866 -0.719 1.00 0.00 C ATOM 2868 CG GLU B 63 76.868 -7.459 -1.859 1.00 0.00 C ATOM 2869 CD GLU B 63 76.381 -6.027 -1.633 1.00 0.00 C ATOM 2870 OE1 GLU B 63 76.750 -5.450 -0.623 1.00 0.00 O ATOM 2871 OE2 GLU B 63 75.647 -5.532 -2.472 1.00 0.00 O ATOM 0 H GLU B 63 76.171 -9.713 -0.368 1.00 0.00 H new ATOM 0 HA GLU B 63 78.553 -9.490 -1.901 1.00 0.00 H new ATOM 0 HB2 GLU B 63 77.307 -7.718 0.241 1.00 0.00 H new ATOM 0 HB3 GLU B 63 78.690 -7.234 -0.720 1.00 0.00 H new ATOM 0 HG2 GLU B 63 77.389 -7.531 -2.814 1.00 0.00 H new ATOM 0 HG3 GLU B 63 76.018 -8.140 -1.908 1.00 0.00 H new ATOM 2878 N ASN B 64 78.951 -9.903 1.328 1.00 0.00 N ATOM 2879 CA ASN B 64 79.980 -10.275 2.321 1.00 0.00 C ATOM 2880 C ASN B 64 80.362 -11.723 2.049 1.00 0.00 C ATOM 2881 O ASN B 64 81.391 -12.202 2.482 1.00 0.00 O ATOM 2882 CB ASN B 64 79.409 -10.140 3.736 1.00 0.00 C ATOM 2883 CG ASN B 64 79.208 -8.659 4.065 1.00 0.00 C ATOM 2884 OD1 ASN B 64 78.121 -8.247 4.421 1.00 0.00 O ATOM 2885 ND2 ASN B 64 80.216 -7.836 3.961 1.00 0.00 N ATOM 0 H ASN B 64 77.996 -9.850 1.683 1.00 0.00 H new ATOM 0 HA ASN B 64 80.851 -9.624 2.243 1.00 0.00 H new ATOM 0 HB2 ASN B 64 78.460 -10.672 3.809 1.00 0.00 H new ATOM 0 HB3 ASN B 64 80.087 -10.595 4.458 1.00 0.00 H new ATOM 0 HD21 ASN B 64 80.092 -6.847 4.178 1.00 0.00 H new ATOM 0 HD22 ASN B 64 81.128 -8.182 3.662 1.00 0.00 H new ATOM 2892 N GLY B 65 79.517 -12.433 1.343 1.00 0.00 N ATOM 2893 CA GLY B 65 79.808 -13.861 1.054 1.00 0.00 C ATOM 2894 C GLY B 65 79.631 -14.639 2.347 1.00 0.00 C ATOM 2895 O GLY B 65 80.346 -15.584 2.619 1.00 0.00 O ATOM 0 H GLY B 65 78.641 -12.081 0.957 1.00 0.00 H new ATOM 0 HA2 GLY B 65 79.136 -14.240 0.284 1.00 0.00 H new ATOM 0 HA3 GLY B 65 80.823 -13.975 0.675 1.00 0.00 H new ATOM 2899 N ASP B 66 78.704 -14.216 3.175 1.00 0.00 N ATOM 2900 CA ASP B 66 78.512 -14.906 4.495 1.00 0.00 C ATOM 2901 C ASP B 66 77.436 -16.008 4.420 1.00 0.00 C ATOM 2902 O ASP B 66 77.255 -16.764 5.353 1.00 0.00 O ATOM 2903 CB ASP B 66 78.091 -13.863 5.532 1.00 0.00 C ATOM 2904 CG ASP B 66 76.783 -13.201 5.089 1.00 0.00 C ATOM 2905 OD1 ASP B 66 76.431 -13.346 3.929 1.00 0.00 O ATOM 2906 OD2 ASP B 66 76.161 -12.554 5.915 1.00 0.00 O ATOM 0 H ASP B 66 78.077 -13.431 2.998 1.00 0.00 H new ATOM 0 HA ASP B 66 79.453 -15.381 4.773 1.00 0.00 H new ATOM 0 HB2 ASP B 66 77.960 -14.335 6.506 1.00 0.00 H new ATOM 0 HB3 ASP B 66 78.872 -13.111 5.644 1.00 0.00 H new ATOM 2911 N GLY B 67 76.715 -16.106 3.329 1.00 0.00 N ATOM 2912 CA GLY B 67 75.652 -17.160 3.225 1.00 0.00 C ATOM 2913 C GLY B 67 74.444 -16.767 4.090 1.00 0.00 C ATOM 2914 O GLY B 67 73.509 -17.560 4.311 1.00 0.00 O ATOM 0 H GLY B 67 76.814 -15.507 2.510 1.00 0.00 H new ATOM 0 HA2 GLY B 67 75.344 -17.278 2.186 1.00 0.00 H new ATOM 0 HA3 GLY B 67 76.047 -18.122 3.551 1.00 0.00 H new ATOM 2918 N GLU B 68 74.421 -15.537 4.566 1.00 0.00 N ATOM 2919 CA GLU B 68 73.287 -15.055 5.404 1.00 0.00 C ATOM 2920 C GLU B 68 72.886 -13.683 4.852 1.00 0.00 C ATOM 2921 O GLU B 68 73.556 -13.160 3.984 1.00 0.00 O ATOM 2922 CB GLU B 68 73.785 -14.923 6.847 1.00 0.00 C ATOM 2923 CG GLU B 68 73.930 -16.314 7.470 1.00 0.00 C ATOM 2924 CD GLU B 68 74.656 -16.202 8.812 1.00 0.00 C ATOM 2925 OE1 GLU B 68 73.995 -15.940 9.803 1.00 0.00 O ATOM 2926 OE2 GLU B 68 75.863 -16.383 8.826 1.00 0.00 O ATOM 0 H GLU B 68 75.153 -14.845 4.402 1.00 0.00 H new ATOM 0 HA GLU B 68 72.435 -15.735 5.384 1.00 0.00 H new ATOM 0 HB2 GLU B 68 74.743 -14.404 6.866 1.00 0.00 H new ATOM 0 HB3 GLU B 68 73.086 -14.323 7.430 1.00 0.00 H new ATOM 0 HG2 GLU B 68 72.947 -16.764 7.613 1.00 0.00 H new ATOM 0 HG3 GLU B 68 74.485 -16.968 6.798 1.00 0.00 H new ATOM 2933 N VAL B 69 71.826 -13.086 5.328 1.00 0.00 N ATOM 2934 CA VAL B 69 71.428 -11.736 4.801 1.00 0.00 C ATOM 2935 C VAL B 69 71.227 -10.788 5.979 1.00 0.00 C ATOM 2936 O VAL B 69 70.505 -11.073 6.904 1.00 0.00 O ATOM 2937 CB VAL B 69 70.148 -11.893 3.970 1.00 0.00 C ATOM 2938 CG1 VAL B 69 69.891 -10.656 3.122 1.00 0.00 C ATOM 2939 CG2 VAL B 69 70.319 -13.099 3.053 1.00 0.00 C ATOM 0 H VAL B 69 71.219 -13.467 6.054 1.00 0.00 H new ATOM 0 HA VAL B 69 72.203 -11.317 4.159 1.00 0.00 H new ATOM 0 HB VAL B 69 69.301 -12.028 4.642 1.00 0.00 H new ATOM 0 HG11 VAL B 69 68.978 -10.795 2.543 1.00 0.00 H new ATOM 0 HG12 VAL B 69 69.781 -9.787 3.770 1.00 0.00 H new ATOM 0 HG13 VAL B 69 70.730 -10.499 2.444 1.00 0.00 H new ATOM 0 HG21 VAL B 69 69.419 -13.230 2.452 1.00 0.00 H new ATOM 0 HG22 VAL B 69 71.174 -12.938 2.396 1.00 0.00 H new ATOM 0 HG23 VAL B 69 70.486 -13.993 3.654 1.00 0.00 H new ATOM 2949 N ASP B 70 71.876 -9.656 5.949 1.00 0.00 N ATOM 2950 CA ASP B 70 71.742 -8.678 7.067 1.00 0.00 C ATOM 2951 C ASP B 70 70.642 -7.676 6.721 1.00 0.00 C ATOM 2952 O ASP B 70 70.327 -7.449 5.570 1.00 0.00 O ATOM 2953 CB ASP B 70 73.065 -7.936 7.273 1.00 0.00 C ATOM 2954 CG ASP B 70 74.133 -8.917 7.753 1.00 0.00 C ATOM 2955 OD1 ASP B 70 73.776 -10.035 8.080 1.00 0.00 O ATOM 2956 OD2 ASP B 70 75.292 -8.535 7.777 1.00 0.00 O ATOM 0 H ASP B 70 72.497 -9.365 5.194 1.00 0.00 H new ATOM 0 HA ASP B 70 71.487 -9.207 7.985 1.00 0.00 H new ATOM 0 HB2 ASP B 70 73.380 -7.467 6.341 1.00 0.00 H new ATOM 0 HB3 ASP B 70 72.936 -7.137 8.003 1.00 0.00 H new ATOM 2961 N PHE B 71 70.041 -7.092 7.721 1.00 0.00 N ATOM 2962 CA PHE B 71 68.942 -6.121 7.475 1.00 0.00 C ATOM 2963 C PHE B 71 69.413 -5.051 6.484 1.00 0.00 C ATOM 2964 O PHE B 71 68.621 -4.418 5.820 1.00 0.00 O ATOM 2965 CB PHE B 71 68.541 -5.480 8.808 1.00 0.00 C ATOM 2966 CG PHE B 71 67.209 -4.773 8.669 1.00 0.00 C ATOM 2967 CD1 PHE B 71 66.053 -5.498 8.340 1.00 0.00 C ATOM 2968 CD2 PHE B 71 67.126 -3.391 8.876 1.00 0.00 C ATOM 2969 CE1 PHE B 71 64.825 -4.839 8.216 1.00 0.00 C ATOM 2970 CE2 PHE B 71 65.897 -2.734 8.753 1.00 0.00 C ATOM 2971 CZ PHE B 71 64.747 -3.457 8.422 1.00 0.00 C ATOM 0 H PHE B 71 70.267 -7.248 8.703 1.00 0.00 H new ATOM 0 HA PHE B 71 68.079 -6.631 7.047 1.00 0.00 H new ATOM 0 HB2 PHE B 71 68.476 -6.244 9.582 1.00 0.00 H new ATOM 0 HB3 PHE B 71 69.306 -4.771 9.124 1.00 0.00 H new ATOM 0 HD1 PHE B 71 66.111 -6.565 8.183 1.00 0.00 H new ATOM 0 HD2 PHE B 71 68.013 -2.830 9.131 1.00 0.00 H new ATOM 0 HE1 PHE B 71 63.936 -5.397 7.961 1.00 0.00 H new ATOM 0 HE2 PHE B 71 65.837 -1.668 8.914 1.00 0.00 H new ATOM 0 HZ PHE B 71 63.799 -2.949 8.325 1.00 0.00 H new ATOM 2981 N GLN B 72 70.697 -4.861 6.366 1.00 0.00 N ATOM 2982 CA GLN B 72 71.222 -3.855 5.395 1.00 0.00 C ATOM 2983 C GLN B 72 71.170 -4.463 3.988 1.00 0.00 C ATOM 2984 O GLN B 72 71.095 -3.775 2.988 1.00 0.00 O ATOM 2985 CB GLN B 72 72.676 -3.511 5.753 1.00 0.00 C ATOM 2986 CG GLN B 72 73.099 -2.212 5.056 1.00 0.00 C ATOM 2987 CD GLN B 72 73.290 -2.470 3.561 1.00 0.00 C ATOM 2988 OE1 GLN B 72 72.762 -1.751 2.736 1.00 0.00 O ATOM 2989 NE2 GLN B 72 74.029 -3.473 3.174 1.00 0.00 N ATOM 0 H GLN B 72 71.409 -5.359 6.900 1.00 0.00 H new ATOM 0 HA GLN B 72 70.620 -2.947 5.432 1.00 0.00 H new ATOM 0 HB2 GLN B 72 72.777 -3.402 6.833 1.00 0.00 H new ATOM 0 HB3 GLN B 72 73.335 -4.325 5.452 1.00 0.00 H new ATOM 0 HG2 GLN B 72 72.342 -1.443 5.209 1.00 0.00 H new ATOM 0 HG3 GLN B 72 74.026 -1.839 5.492 1.00 0.00 H new ATOM 0 HE21 GLN B 72 74.472 -4.077 3.866 1.00 0.00 H new ATOM 0 HE22 GLN B 72 74.163 -3.653 2.179 1.00 0.00 H new ATOM 2998 N GLU B 73 71.176 -5.762 3.930 1.00 0.00 N ATOM 2999 CA GLU B 73 71.108 -6.459 2.629 1.00 0.00 C ATOM 3000 C GLU B 73 69.644 -6.609 2.214 1.00 0.00 C ATOM 3001 O GLU B 73 69.261 -6.313 1.103 1.00 0.00 O ATOM 3002 CB GLU B 73 71.723 -7.845 2.773 1.00 0.00 C ATOM 3003 CG GLU B 73 73.237 -7.741 2.980 1.00 0.00 C ATOM 3004 CD GLU B 73 73.851 -9.145 2.909 1.00 0.00 C ATOM 3005 OE1 GLU B 73 73.162 -10.048 2.464 1.00 0.00 O ATOM 3006 OE2 GLU B 73 74.997 -9.296 3.299 1.00 0.00 O ATOM 0 H GLU B 73 71.226 -6.376 4.743 1.00 0.00 H new ATOM 0 HA GLU B 73 71.650 -5.886 1.877 1.00 0.00 H new ATOM 0 HB2 GLU B 73 71.269 -8.365 3.617 1.00 0.00 H new ATOM 0 HB3 GLU B 73 71.512 -8.437 1.883 1.00 0.00 H new ATOM 0 HG2 GLU B 73 73.678 -7.099 2.217 1.00 0.00 H new ATOM 0 HG3 GLU B 73 73.454 -7.284 3.946 1.00 0.00 H new ATOM 3013 N PHE B 74 68.830 -7.088 3.124 1.00 0.00 N ATOM 3014 CA PHE B 74 67.379 -7.295 2.833 1.00 0.00 C ATOM 3015 C PHE B 74 66.699 -5.974 2.454 1.00 0.00 C ATOM 3016 O PHE B 74 65.994 -5.889 1.473 1.00 0.00 O ATOM 3017 CB PHE B 74 66.697 -7.896 4.077 1.00 0.00 C ATOM 3018 CG PHE B 74 65.183 -7.855 3.937 1.00 0.00 C ATOM 3019 CD1 PHE B 74 64.559 -8.315 2.767 1.00 0.00 C ATOM 3020 CD2 PHE B 74 64.402 -7.344 4.986 1.00 0.00 C ATOM 3021 CE1 PHE B 74 63.165 -8.263 2.651 1.00 0.00 C ATOM 3022 CE2 PHE B 74 63.009 -7.294 4.865 1.00 0.00 C ATOM 3023 CZ PHE B 74 62.391 -7.752 3.697 1.00 0.00 C ATOM 0 H PHE B 74 69.115 -7.347 4.068 1.00 0.00 H new ATOM 0 HA PHE B 74 67.284 -7.977 1.988 1.00 0.00 H new ATOM 0 HB2 PHE B 74 67.026 -8.926 4.215 1.00 0.00 H new ATOM 0 HB3 PHE B 74 66.999 -7.343 4.966 1.00 0.00 H new ATOM 0 HD1 PHE B 74 65.154 -8.709 1.956 1.00 0.00 H new ATOM 0 HD2 PHE B 74 64.878 -6.989 5.888 1.00 0.00 H new ATOM 0 HE1 PHE B 74 62.686 -8.619 1.751 1.00 0.00 H new ATOM 0 HE2 PHE B 74 62.411 -6.902 5.674 1.00 0.00 H new ATOM 0 HZ PHE B 74 61.316 -7.711 3.603 1.00 0.00 H new ATOM 3033 N VAL B 75 66.890 -4.953 3.233 1.00 0.00 N ATOM 3034 CA VAL B 75 66.240 -3.645 2.934 1.00 0.00 C ATOM 3035 C VAL B 75 66.701 -3.145 1.561 1.00 0.00 C ATOM 3036 O VAL B 75 65.920 -2.627 0.788 1.00 0.00 O ATOM 3037 CB VAL B 75 66.591 -2.646 4.037 1.00 0.00 C ATOM 3038 CG1 VAL B 75 66.173 -1.228 3.626 1.00 0.00 C ATOM 3039 CG2 VAL B 75 65.862 -3.047 5.324 1.00 0.00 C ATOM 0 H VAL B 75 67.472 -4.964 4.071 1.00 0.00 H new ATOM 0 HA VAL B 75 65.156 -3.760 2.905 1.00 0.00 H new ATOM 0 HB VAL B 75 67.668 -2.656 4.202 1.00 0.00 H new ATOM 0 HG11 VAL B 75 66.429 -0.528 4.421 1.00 0.00 H new ATOM 0 HG12 VAL B 75 66.695 -0.945 2.712 1.00 0.00 H new ATOM 0 HG13 VAL B 75 65.097 -1.202 3.452 1.00 0.00 H new ATOM 0 HG21 VAL B 75 66.107 -2.340 6.116 1.00 0.00 H new ATOM 0 HG22 VAL B 75 64.786 -3.039 5.150 1.00 0.00 H new ATOM 0 HG23 VAL B 75 66.174 -4.048 5.622 1.00 0.00 H new ATOM 3049 N VAL B 76 67.941 -3.338 1.226 1.00 0.00 N ATOM 3050 CA VAL B 76 68.403 -2.917 -0.122 1.00 0.00 C ATOM 3051 C VAL B 76 67.592 -3.677 -1.195 1.00 0.00 C ATOM 3052 O VAL B 76 67.255 -3.142 -2.228 1.00 0.00 O ATOM 3053 CB VAL B 76 69.896 -3.244 -0.272 1.00 0.00 C ATOM 3054 CG1 VAL B 76 70.323 -3.066 -1.735 1.00 0.00 C ATOM 3055 CG2 VAL B 76 70.715 -2.294 0.614 1.00 0.00 C ATOM 0 H VAL B 76 68.651 -3.765 1.821 1.00 0.00 H new ATOM 0 HA VAL B 76 68.255 -1.844 -0.247 1.00 0.00 H new ATOM 0 HB VAL B 76 70.071 -4.276 0.032 1.00 0.00 H new ATOM 0 HG11 VAL B 76 71.383 -3.299 -1.836 1.00 0.00 H new ATOM 0 HG12 VAL B 76 69.742 -3.737 -2.368 1.00 0.00 H new ATOM 0 HG13 VAL B 76 70.148 -2.035 -2.042 1.00 0.00 H new ATOM 0 HG21 VAL B 76 71.776 -2.523 0.510 1.00 0.00 H new ATOM 0 HG22 VAL B 76 70.535 -1.264 0.307 1.00 0.00 H new ATOM 0 HG23 VAL B 76 70.417 -2.420 1.655 1.00 0.00 H new ATOM 3065 N LEU B 77 67.331 -4.942 -0.959 1.00 0.00 N ATOM 3066 CA LEU B 77 66.595 -5.803 -1.952 1.00 0.00 C ATOM 3067 C LEU B 77 65.148 -5.322 -2.203 1.00 0.00 C ATOM 3068 O LEU B 77 64.756 -5.069 -3.325 1.00 0.00 O ATOM 3069 CB LEU B 77 66.564 -7.234 -1.365 1.00 0.00 C ATOM 3070 CG LEU B 77 65.977 -8.315 -2.326 1.00 0.00 C ATOM 3071 CD1 LEU B 77 64.473 -8.518 -2.070 1.00 0.00 C ATOM 3072 CD2 LEU B 77 66.204 -7.961 -3.801 1.00 0.00 C ATOM 0 H LEU B 77 67.601 -5.427 -0.103 1.00 0.00 H new ATOM 0 HA LEU B 77 67.108 -5.757 -2.913 1.00 0.00 H new ATOM 0 HB2 LEU B 77 67.579 -7.523 -1.090 1.00 0.00 H new ATOM 0 HB3 LEU B 77 65.976 -7.224 -0.447 1.00 0.00 H new ATOM 0 HG LEU B 77 66.508 -9.243 -2.115 1.00 0.00 H new ATOM 0 HD11 LEU B 77 64.087 -9.276 -2.752 1.00 0.00 H new ATOM 0 HD12 LEU B 77 64.320 -8.844 -1.041 1.00 0.00 H new ATOM 0 HD13 LEU B 77 63.946 -7.579 -2.236 1.00 0.00 H new ATOM 0 HD21 LEU B 77 65.779 -8.742 -4.432 1.00 0.00 H new ATOM 0 HD22 LEU B 77 65.721 -7.010 -4.025 1.00 0.00 H new ATOM 0 HD23 LEU B 77 67.273 -7.880 -3.995 1.00 0.00 H new ATOM 3084 N VAL B 78 64.347 -5.211 -1.177 1.00 0.00 N ATOM 3085 CA VAL B 78 62.924 -4.777 -1.367 1.00 0.00 C ATOM 3086 C VAL B 78 62.885 -3.390 -1.999 1.00 0.00 C ATOM 3087 O VAL B 78 62.035 -3.086 -2.809 1.00 0.00 O ATOM 3088 CB VAL B 78 62.225 -4.743 -0.004 1.00 0.00 C ATOM 3089 CG1 VAL B 78 62.214 -6.152 0.594 1.00 0.00 C ATOM 3090 CG2 VAL B 78 62.979 -3.799 0.932 1.00 0.00 C ATOM 0 H VAL B 78 64.614 -5.402 -0.211 1.00 0.00 H new ATOM 0 HA VAL B 78 62.413 -5.480 -2.025 1.00 0.00 H new ATOM 0 HB VAL B 78 61.201 -4.390 -0.127 1.00 0.00 H new ATOM 0 HG11 VAL B 78 61.717 -6.132 1.564 1.00 0.00 H new ATOM 0 HG12 VAL B 78 61.678 -6.827 -0.074 1.00 0.00 H new ATOM 0 HG13 VAL B 78 63.239 -6.503 0.718 1.00 0.00 H new ATOM 0 HG21 VAL B 78 62.482 -3.775 1.902 1.00 0.00 H new ATOM 0 HG22 VAL B 78 64.003 -4.152 1.058 1.00 0.00 H new ATOM 0 HG23 VAL B 78 62.991 -2.796 0.505 1.00 0.00 H new ATOM 3100 N ALA B 79 63.805 -2.564 -1.636 1.00 0.00 N ATOM 3101 CA ALA B 79 63.880 -1.183 -2.192 1.00 0.00 C ATOM 3102 C ALA B 79 64.171 -1.204 -3.705 1.00 0.00 C ATOM 3103 O ALA B 79 63.637 -0.415 -4.469 1.00 0.00 O ATOM 3104 CB ALA B 79 65.039 -0.479 -1.466 1.00 0.00 C ATOM 0 H ALA B 79 64.534 -2.785 -0.958 1.00 0.00 H new ATOM 0 HA ALA B 79 62.930 -0.669 -2.046 1.00 0.00 H new ATOM 0 HB1 ALA B 79 65.136 0.541 -1.839 1.00 0.00 H new ATOM 0 HB2 ALA B 79 64.837 -0.456 -0.395 1.00 0.00 H new ATOM 0 HB3 ALA B 79 65.966 -1.022 -1.649 1.00 0.00 H new ATOM 3110 N ALA B 80 65.055 -2.062 -4.129 1.00 0.00 N ATOM 3111 CA ALA B 80 65.449 -2.100 -5.567 1.00 0.00 C ATOM 3112 C ALA B 80 64.424 -2.814 -6.474 1.00 0.00 C ATOM 3113 O ALA B 80 64.391 -2.559 -7.665 1.00 0.00 O ATOM 3114 CB ALA B 80 66.820 -2.756 -5.686 1.00 0.00 C ATOM 0 H ALA B 80 65.527 -2.745 -3.537 1.00 0.00 H new ATOM 0 HA ALA B 80 65.483 -1.070 -5.922 1.00 0.00 H new ATOM 0 HB1 ALA B 80 67.118 -2.789 -6.734 1.00 0.00 H new ATOM 0 HB2 ALA B 80 67.550 -2.178 -5.119 1.00 0.00 H new ATOM 0 HB3 ALA B 80 66.774 -3.770 -5.290 1.00 0.00 H new ATOM 3120 N LEU B 81 63.591 -3.702 -5.981 1.00 0.00 N ATOM 3121 CA LEU B 81 62.617 -4.365 -6.925 1.00 0.00 C ATOM 3122 C LEU B 81 61.398 -3.447 -7.144 1.00 0.00 C ATOM 3123 O LEU B 81 60.943 -3.244 -8.247 1.00 0.00 O ATOM 3124 CB LEU B 81 62.185 -5.731 -6.377 1.00 0.00 C ATOM 3125 CG LEU B 81 61.639 -5.595 -4.934 1.00 0.00 C ATOM 3126 CD1 LEU B 81 60.143 -5.175 -4.923 1.00 0.00 C ATOM 3127 CD2 LEU B 81 61.815 -6.940 -4.210 1.00 0.00 C ATOM 0 H LEU B 81 63.538 -3.992 -5.005 1.00 0.00 H new ATOM 0 HA LEU B 81 63.105 -4.530 -7.886 1.00 0.00 H new ATOM 0 HB2 LEU B 81 61.419 -6.161 -7.022 1.00 0.00 H new ATOM 0 HB3 LEU B 81 63.032 -6.417 -6.387 1.00 0.00 H new ATOM 0 HG LEU B 81 62.199 -4.813 -4.421 1.00 0.00 H new ATOM 0 HD11 LEU B 81 59.796 -5.090 -3.893 1.00 0.00 H new ATOM 0 HD12 LEU B 81 60.031 -4.213 -5.424 1.00 0.00 H new ATOM 0 HD13 LEU B 81 59.550 -5.927 -5.444 1.00 0.00 H new ATOM 0 HD21 LEU B 81 61.434 -6.858 -3.192 1.00 0.00 H new ATOM 0 HD22 LEU B 81 61.263 -7.715 -4.742 1.00 0.00 H new ATOM 0 HD23 LEU B 81 62.873 -7.202 -4.182 1.00 0.00 H new ATOM 3139 N THR B 82 60.887 -2.873 -6.090 1.00 0.00 N ATOM 3140 CA THR B 82 59.714 -1.946 -6.200 1.00 0.00 C ATOM 3141 C THR B 82 60.015 -0.837 -7.216 1.00 0.00 C ATOM 3142 O THR B 82 59.209 -0.543 -8.076 1.00 0.00 O ATOM 3143 CB THR B 82 59.446 -1.328 -4.822 1.00 0.00 C ATOM 3144 OG1 THR B 82 58.500 -0.276 -4.960 1.00 0.00 O ATOM 3145 CG2 THR B 82 60.734 -0.770 -4.215 1.00 0.00 C ATOM 0 H THR B 82 61.235 -3.006 -5.140 1.00 0.00 H new ATOM 0 HA THR B 82 58.838 -2.499 -6.537 1.00 0.00 H new ATOM 0 HB THR B 82 59.058 -2.103 -4.161 1.00 0.00 H new ATOM 0 HG1 THR B 82 58.323 0.122 -4.082 1.00 0.00 H new ATOM 0 HG21 THR B 82 60.518 -0.337 -3.238 1.00 0.00 H new ATOM 0 HG22 THR B 82 61.461 -1.574 -4.103 1.00 0.00 H new ATOM 0 HG23 THR B 82 61.142 -0.001 -4.871 1.00 0.00 H new ATOM 3153 N VAL B 83 61.181 -0.252 -7.158 1.00 0.00 N ATOM 3154 CA VAL B 83 61.536 0.799 -8.162 1.00 0.00 C ATOM 3155 C VAL B 83 61.416 0.211 -9.565 1.00 0.00 C ATOM 3156 O VAL B 83 60.937 0.850 -10.482 1.00 0.00 O ATOM 3157 CB VAL B 83 62.987 1.240 -7.935 1.00 0.00 C ATOM 3158 CG1 VAL B 83 63.063 2.054 -6.640 1.00 0.00 C ATOM 3159 CG2 VAL B 83 63.894 0.034 -7.800 1.00 0.00 C ATOM 0 H VAL B 83 61.901 -0.453 -6.464 1.00 0.00 H new ATOM 0 HA VAL B 83 60.865 1.651 -8.055 1.00 0.00 H new ATOM 0 HB VAL B 83 63.310 1.838 -8.787 1.00 0.00 H new ATOM 0 HG11 VAL B 83 64.092 2.372 -6.470 1.00 0.00 H new ATOM 0 HG12 VAL B 83 62.421 2.931 -6.723 1.00 0.00 H new ATOM 0 HG13 VAL B 83 62.731 1.439 -5.804 1.00 0.00 H new ATOM 0 HG21 VAL B 83 64.920 0.366 -7.639 1.00 0.00 H new ATOM 0 HG22 VAL B 83 63.572 -0.571 -6.952 1.00 0.00 H new ATOM 0 HG23 VAL B 83 63.844 -0.562 -8.711 1.00 0.00 H new ATOM 3169 N ALA B 84 61.847 -1.008 -9.735 1.00 0.00 N ATOM 3170 CA ALA B 84 61.760 -1.649 -11.074 1.00 0.00 C ATOM 3171 C ALA B 84 60.286 -1.802 -11.459 1.00 0.00 C ATOM 3172 O ALA B 84 59.942 -1.843 -12.622 1.00 0.00 O ATOM 3173 CB ALA B 84 62.441 -3.026 -11.042 1.00 0.00 C ATOM 0 H ALA B 84 62.256 -1.588 -9.002 1.00 0.00 H new ATOM 0 HA ALA B 84 62.267 -1.027 -11.811 1.00 0.00 H new ATOM 0 HB1 ALA B 84 62.373 -3.489 -12.027 1.00 0.00 H new ATOM 0 HB2 ALA B 84 63.489 -2.907 -10.769 1.00 0.00 H new ATOM 0 HB3 ALA B 84 61.944 -3.660 -10.308 1.00 0.00 H new ATOM 3179 N CYS B 85 59.413 -1.896 -10.492 1.00 0.00 N ATOM 3180 CA CYS B 85 57.965 -2.054 -10.816 1.00 0.00 C ATOM 3181 C CYS B 85 57.411 -0.750 -11.399 1.00 0.00 C ATOM 3182 O CYS B 85 56.656 -0.758 -12.350 1.00 0.00 O ATOM 3183 CB CYS B 85 57.191 -2.423 -9.548 1.00 0.00 C ATOM 3184 SG CYS B 85 55.478 -2.817 -9.978 1.00 0.00 S ATOM 0 H CYS B 85 59.638 -1.870 -9.497 1.00 0.00 H new ATOM 0 HA CYS B 85 57.851 -2.848 -11.554 1.00 0.00 H new ATOM 0 HB2 CYS B 85 57.660 -3.277 -9.059 1.00 0.00 H new ATOM 0 HB3 CYS B 85 57.218 -1.595 -8.839 1.00 0.00 H new ATOM 0 HG CYS B 85 54.822 -3.132 -8.901 1.00 0.00 H new ATOM 3190 N ASN B 86 57.771 0.365 -10.830 1.00 0.00 N ATOM 3191 CA ASN B 86 57.259 1.670 -11.341 1.00 0.00 C ATOM 3192 C ASN B 86 57.709 1.886 -12.793 1.00 0.00 C ATOM 3193 O ASN B 86 56.952 2.349 -13.624 1.00 0.00 O ATOM 3194 CB ASN B 86 57.810 2.792 -10.456 1.00 0.00 C ATOM 3195 CG ASN B 86 57.236 4.138 -10.901 1.00 0.00 C ATOM 3196 OD1 ASN B 86 57.824 5.171 -10.651 1.00 0.00 O ATOM 3197 ND2 ASN B 86 56.102 4.170 -11.547 1.00 0.00 N ATOM 0 H ASN B 86 58.400 0.431 -10.030 1.00 0.00 H new ATOM 0 HA ASN B 86 56.169 1.671 -11.313 1.00 0.00 H new ATOM 0 HB2 ASN B 86 57.552 2.604 -9.414 1.00 0.00 H new ATOM 0 HB3 ASN B 86 58.898 2.813 -10.517 1.00 0.00 H new ATOM 0 HD21 ASN B 86 55.708 5.063 -11.843 1.00 0.00 H new ATOM 0 HD22 ASN B 86 55.610 3.302 -11.756 1.00 0.00 H new ATOM 3204 N ASN B 87 58.938 1.568 -13.099 1.00 0.00 N ATOM 3205 CA ASN B 87 59.448 1.764 -14.490 1.00 0.00 C ATOM 3206 C ASN B 87 58.734 0.823 -15.467 1.00 0.00 C ATOM 3207 O ASN B 87 58.425 1.192 -16.582 1.00 0.00 O ATOM 3208 CB ASN B 87 60.951 1.483 -14.528 1.00 0.00 C ATOM 3209 CG ASN B 87 61.485 1.768 -15.933 1.00 0.00 C ATOM 3210 OD1 ASN B 87 61.550 0.883 -16.763 1.00 0.00 O ATOM 3211 ND2 ASN B 87 61.867 2.979 -16.238 1.00 0.00 N ATOM 0 H ASN B 87 59.615 1.179 -12.443 1.00 0.00 H new ATOM 0 HA ASN B 87 59.253 2.794 -14.788 1.00 0.00 H new ATOM 0 HB2 ASN B 87 61.467 2.106 -13.797 1.00 0.00 H new ATOM 0 HB3 ASN B 87 61.145 0.445 -14.257 1.00 0.00 H new ATOM 0 HD21 ASN B 87 62.220 3.182 -17.173 1.00 0.00 H new ATOM 0 HD22 ASN B 87 61.812 3.722 -15.541 1.00 0.00 H new ATOM 3218 N PHE B 88 58.493 -0.397 -15.069 1.00 0.00 N ATOM 3219 CA PHE B 88 57.826 -1.365 -15.989 1.00 0.00 C ATOM 3220 C PHE B 88 56.317 -1.120 -15.991 1.00 0.00 C ATOM 3221 O PHE B 88 55.597 -1.639 -16.820 1.00 0.00 O ATOM 3222 CB PHE B 88 58.115 -2.791 -15.508 1.00 0.00 C ATOM 3223 CG PHE B 88 57.548 -3.792 -16.486 1.00 0.00 C ATOM 3224 CD1 PHE B 88 58.335 -4.250 -17.549 1.00 0.00 C ATOM 3225 CD2 PHE B 88 56.241 -4.269 -16.327 1.00 0.00 C ATOM 3226 CE1 PHE B 88 57.816 -5.183 -18.455 1.00 0.00 C ATOM 3227 CE2 PHE B 88 55.721 -5.202 -17.234 1.00 0.00 C ATOM 3228 CZ PHE B 88 56.509 -5.658 -18.298 1.00 0.00 C ATOM 0 H PHE B 88 58.729 -0.766 -14.148 1.00 0.00 H new ATOM 0 HA PHE B 88 58.209 -1.232 -17.001 1.00 0.00 H new ATOM 0 HB2 PHE B 88 59.190 -2.938 -15.407 1.00 0.00 H new ATOM 0 HB3 PHE B 88 57.678 -2.946 -14.522 1.00 0.00 H new ATOM 0 HD1 PHE B 88 59.344 -3.883 -17.671 1.00 0.00 H new ATOM 0 HD2 PHE B 88 55.634 -3.918 -15.506 1.00 0.00 H new ATOM 0 HE1 PHE B 88 58.424 -5.536 -19.275 1.00 0.00 H new ATOM 0 HE2 PHE B 88 54.713 -5.569 -17.112 1.00 0.00 H new ATOM 0 HZ PHE B 88 56.108 -6.376 -18.998 1.00 0.00 H new ATOM 3238 N PHE B 89 55.833 -0.318 -15.083 1.00 0.00 N ATOM 3239 CA PHE B 89 54.375 -0.028 -15.055 1.00 0.00 C ATOM 3240 C PHE B 89 54.057 1.007 -16.127 1.00 0.00 C ATOM 3241 O PHE B 89 52.972 1.043 -16.670 1.00 0.00 O ATOM 3242 CB PHE B 89 53.973 0.520 -13.686 1.00 0.00 C ATOM 3243 CG PHE B 89 52.501 0.861 -13.706 1.00 0.00 C ATOM 3244 CD1 PHE B 89 51.547 -0.100 -13.345 1.00 0.00 C ATOM 3245 CD2 PHE B 89 52.091 2.144 -14.088 1.00 0.00 C ATOM 3246 CE1 PHE B 89 50.184 0.224 -13.368 1.00 0.00 C ATOM 3247 CE2 PHE B 89 50.729 2.468 -14.111 1.00 0.00 C ATOM 3248 CZ PHE B 89 49.775 1.508 -13.751 1.00 0.00 C ATOM 0 H PHE B 89 56.384 0.147 -14.362 1.00 0.00 H new ATOM 0 HA PHE B 89 53.820 -0.947 -15.244 1.00 0.00 H new ATOM 0 HB2 PHE B 89 54.178 -0.218 -12.910 1.00 0.00 H new ATOM 0 HB3 PHE B 89 54.562 1.406 -13.447 1.00 0.00 H new ATOM 0 HD1 PHE B 89 51.862 -1.090 -13.049 1.00 0.00 H new ATOM 0 HD2 PHE B 89 52.826 2.885 -14.365 1.00 0.00 H new ATOM 0 HE1 PHE B 89 49.448 -0.516 -13.090 1.00 0.00 H new ATOM 0 HE2 PHE B 89 50.414 3.458 -14.406 1.00 0.00 H new ATOM 0 HZ PHE B 89 48.724 1.757 -13.769 1.00 0.00 H new ATOM 3258 N TRP B 90 54.998 1.864 -16.424 1.00 0.00 N ATOM 3259 CA TRP B 90 54.751 2.915 -17.450 1.00 0.00 C ATOM 3260 C TRP B 90 55.018 2.359 -18.850 1.00 0.00 C ATOM 3261 O TRP B 90 54.685 2.980 -19.841 1.00 0.00 O ATOM 3262 CB TRP B 90 55.677 4.107 -17.202 1.00 0.00 C ATOM 3263 CG TRP B 90 55.361 5.184 -18.189 1.00 0.00 C ATOM 3264 CD1 TRP B 90 56.055 5.425 -19.325 1.00 0.00 C ATOM 3265 CD2 TRP B 90 54.288 6.170 -18.147 1.00 0.00 C ATOM 3266 NE1 TRP B 90 55.472 6.491 -19.987 1.00 0.00 N ATOM 3267 CE2 TRP B 90 54.381 6.985 -19.300 1.00 0.00 C ATOM 3268 CE3 TRP B 90 53.252 6.433 -17.231 1.00 0.00 C ATOM 3269 CZ2 TRP B 90 53.478 8.022 -19.537 1.00 0.00 C ATOM 3270 CZ3 TRP B 90 52.342 7.477 -17.466 1.00 0.00 C ATOM 3271 CH2 TRP B 90 52.455 8.270 -18.617 1.00 0.00 C ATOM 0 H TRP B 90 55.926 1.880 -16.000 1.00 0.00 H new ATOM 0 HA TRP B 90 53.711 3.234 -17.379 1.00 0.00 H new ATOM 0 HB2 TRP B 90 55.548 4.479 -16.185 1.00 0.00 H new ATOM 0 HB3 TRP B 90 56.719 3.801 -17.300 1.00 0.00 H new ATOM 0 HD1 TRP B 90 56.922 4.875 -19.660 1.00 0.00 H new ATOM 0 HE1 TRP B 90 55.807 6.866 -20.874 1.00 0.00 H new ATOM 0 HE3 TRP B 90 53.156 5.828 -16.342 1.00 0.00 H new ATOM 0 HZ2 TRP B 90 53.569 8.629 -20.426 1.00 0.00 H new ATOM 0 HZ3 TRP B 90 51.551 7.670 -16.756 1.00 0.00 H new ATOM 0 HH2 TRP B 90 51.753 9.071 -18.793 1.00 0.00 H new