USER MOD reduce.3.24.130724 H: found=0, std=0, add=1340, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1344 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: C 323 HIS : no HE2:sc= 0.905 K(o=1.9,f=-6.7!) USER MOD Set 1.2: C 325 SER OG : rot -170:sc= 0.951 USER MOD Set 2.1: A 89 TYR OH : rot 60:sc= -0.931! USER MOD Set 2.2: A 99 TYR OH : rot -156:sc= 1.93 USER MOD Set 3.1: A 34 TYR OH : rot 110:sc= -0.067 USER MOD Set 3.2: A 71 ASN : amide:sc= -1.34 X(o=-1.4,f=-1.5!) USER MOD Set 4.1: A 12 TYR OH : rot -130:sc= 1.28 USER MOD Set 4.2: A 58 LYS NZ :NH3+ -148:sc= 1.28 (180deg=0.126!) USER MOD Single : A 1 GLY N :NH3+ -113:sc= 0.0992 (180deg=0) USER MOD Single : A 3 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 5 ASN : amide:sc= -0.0837 X(o=-0.084,f=-0.0057) USER MOD Single : A 7 TYR OH : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 ASN : amide:sc= -1.51 K(o=-1.5,f=-2.3) USER MOD Single : A 14 TYR OH : rot 180:sc= -0.3 USER MOD Single : A 17 ASN : amide:sc= -1.39! C(o=-1.4!,f=-2.9!) USER MOD Single : A 19 ASN : amide:sc= -0.97 K(o=-0.97,f=-2.9!) USER MOD Single : A 23 THR OG1 : rot -109:sc= -1.43! USER MOD Single : A 29 THR OG1 : rot 74:sc= 1.26 USER MOD Single : A 32 SER OG : rot 80:sc= 0.797 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 47 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 THR OG1 : rot -31:sc= 0.308 USER MOD Single : A 51 SER OG : rot 155:sc= -0.516 USER MOD Single : A 52 GLN : amide:sc= -0.241 K(o=-0.24,f=-3.6!) USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot -174:sc= 0.0314 USER MOD Single : A 62 GLN : amide:sc= -1.85! C(o=-1.8!,f=-2.6!) USER MOD Single : A 64 SER OG : rot 180:sc= -0.239 USER MOD Single : A 65 THR OG1 : rot -132:sc= 1.16 USER MOD Single : A 73 ASN : amide:sc= -2.57! C(o=-2.6!,f=-11!) USER MOD Single : A 76 LYS NZ :NH3+ 164:sc= -0.0549 (180deg=-0.358) USER MOD Single : A 83 LYS NZ :NH3+ -175:sc= 1.78 (180deg=1.74) USER MOD Single : A 86 HIS : no HE2:sc= -1.63 K(o=-1.6,f=-7.3!) USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 SER OG : rot 180:sc= 0.00364 USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 97 LYS NZ :NH3+ 153:sc= 1.21 (180deg=1.15) USER MOD Single : A 98 TYR OH : rot 27:sc= 2.33 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 SER OG : rot 180:sc= 0.468 USER MOD Single : A 113 LYS NZ :NH3+ 142:sc= -0.454 (180deg=-2.09!) USER MOD Single : A 114 ASN : amide:sc= 0 K(o=0,f=-0.6) USER MOD Single : A 115 ASN : amide:sc= 1.31 K(o=1.3,f=-0.58) USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 201 SER OG : rot -150:sc= -0.105 USER MOD Single : B 202 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0402) USER MOD Single : B 203 SER OG : rot 180:sc= 0.048 USER MOD Single : B 204 GLN : amide:sc= -0.716 K(o=-0.72,f=-2.8) USER MOD Single : B 205 TYR OH : rot 180:sc= 0 USER MOD Single : B 209 MET CE :methyl 138:sc= -1.63! (180deg=-4.27!) USER MOD Single : B 213 SER OG : rot 180:sc= 0 USER MOD Single : B 215 SER OG : rot -46:sc= 0.937 USER MOD Single : B 222 SER OG : rot -110:sc= 1.43 USER MOD Single : C 301 SER OG : rot 180:sc= 0 USER MOD Single : C 302 TYR OH : rot 180:sc= 0 USER MOD Single : C 304 LYS NZ :NH3+ -173:sc= 1.26 (180deg=1.2) USER MOD Single : C 309 ASN : amide:sc= 0.297 K(o=0.3,f=-9.6!) USER MOD Single : C 314 MET CE :methyl 165:sc= -3.85! (180deg=-4.4!) USER MOD Single : C 317 SER OG : rot -161:sc= 1.28 USER MOD Single : C 326 ASN : amide:sc= 0.792 K(o=0.79,f=-8.3!) USER MOD Single : C 331 LYS NZ :NH3+ -166:sc= 0.98 (180deg=0.885) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 17.430 10.303 -16.194 1.00 0.00 N ATOM 2 CA GLY A 1 15.982 10.297 -16.385 1.00 0.00 C ATOM 3 C GLY A 1 15.317 9.277 -15.502 1.00 0.00 C ATOM 4 O GLY A 1 15.992 8.416 -14.936 1.00 0.00 O ATOM 0 H1 GLY A 1 17.719 11.203 -15.760 1.00 0.00 H new ATOM 0 H2 GLY A 1 17.701 9.515 -15.572 1.00 0.00 H new ATOM 0 H3 GLY A 1 17.902 10.195 -17.114 1.00 0.00 H new ATOM 0 HA2 GLY A 1 15.580 11.287 -16.167 1.00 0.00 H new ATOM 0 HA3 GLY A 1 15.752 10.083 -17.429 1.00 0.00 H new ATOM 10 N ALA A 2 14.005 9.361 -15.377 1.00 0.00 N ATOM 11 CA ALA A 2 13.239 8.428 -14.576 1.00 0.00 C ATOM 12 C ALA A 2 11.775 8.465 -14.983 1.00 0.00 C ATOM 13 O ALA A 2 11.035 9.354 -14.589 1.00 0.00 O ATOM 14 CB ALA A 2 13.387 8.717 -13.082 1.00 0.00 C ATOM 0 H ALA A 2 13.441 10.080 -15.830 1.00 0.00 H new ATOM 0 HA ALA A 2 13.633 7.428 -14.759 1.00 0.00 H new ATOM 0 HB1 ALA A 2 12.799 7.998 -12.512 1.00 0.00 H new ATOM 0 HB2 ALA A 2 14.436 8.634 -12.798 1.00 0.00 H new ATOM 0 HB3 ALA A 2 13.032 9.725 -12.870 1.00 0.00 H new ATOM 20 N MET A 3 11.396 7.551 -15.823 1.00 0.00 N ATOM 21 CA MET A 3 10.020 7.413 -16.247 1.00 0.00 C ATOM 22 C MET A 3 9.428 6.246 -15.481 1.00 0.00 C ATOM 23 O MET A 3 9.963 5.127 -15.542 1.00 0.00 O ATOM 24 CB MET A 3 9.933 7.127 -17.761 1.00 0.00 C ATOM 25 CG MET A 3 10.518 8.206 -18.681 1.00 0.00 C ATOM 26 SD MET A 3 9.677 9.804 -18.552 1.00 0.00 S ATOM 27 CE MET A 3 10.475 10.721 -19.882 1.00 0.00 C ATOM 0 H MET A 3 12.031 6.871 -16.241 1.00 0.00 H new ATOM 0 HA MET A 3 9.477 8.338 -16.050 1.00 0.00 H new ATOM 0 HB2 MET A 3 10.446 6.187 -17.964 1.00 0.00 H new ATOM 0 HB3 MET A 3 8.885 6.982 -18.024 1.00 0.00 H new ATOM 0 HG2 MET A 3 11.573 8.340 -18.444 1.00 0.00 H new ATOM 0 HG3 MET A 3 10.465 7.859 -19.713 1.00 0.00 H new ATOM 0 HE1 MET A 3 10.061 11.728 -19.928 1.00 0.00 H new ATOM 0 HE2 MET A 3 11.547 10.777 -19.693 1.00 0.00 H new ATOM 0 HE3 MET A 3 10.300 10.213 -20.830 1.00 0.00 H new ATOM 37 N GLY A 4 8.388 6.485 -14.730 1.00 0.00 N ATOM 38 CA GLY A 4 7.807 5.416 -13.958 1.00 0.00 C ATOM 39 C GLY A 4 6.326 5.579 -13.726 1.00 0.00 C ATOM 40 O GLY A 4 5.745 4.841 -12.935 1.00 0.00 O ATOM 0 H GLY A 4 7.931 7.392 -14.635 1.00 0.00 H new ATOM 0 HA2 GLY A 4 7.985 4.470 -14.470 1.00 0.00 H new ATOM 0 HA3 GLY A 4 8.314 5.357 -12.995 1.00 0.00 H new ATOM 44 N ASN A 5 5.705 6.528 -14.438 1.00 0.00 N ATOM 45 CA ASN A 5 4.244 6.803 -14.357 1.00 0.00 C ATOM 46 C ASN A 5 3.406 5.595 -14.769 1.00 0.00 C ATOM 47 O ASN A 5 2.189 5.582 -14.592 1.00 0.00 O ATOM 48 CB ASN A 5 3.841 8.042 -15.191 1.00 0.00 C ATOM 49 CG ASN A 5 4.023 7.855 -16.687 1.00 0.00 C ATOM 50 OD1 ASN A 5 3.110 7.406 -17.384 1.00 0.00 O ATOM 51 ND2 ASN A 5 5.168 8.223 -17.197 1.00 0.00 N ATOM 0 H ASN A 5 6.195 7.136 -15.094 1.00 0.00 H new ATOM 0 HA ASN A 5 4.035 7.015 -13.308 1.00 0.00 H new ATOM 0 HB2 ASN A 5 2.797 8.282 -14.988 1.00 0.00 H new ATOM 0 HB3 ASN A 5 4.434 8.897 -14.866 1.00 0.00 H new ATOM 0 HD21 ASN A 5 5.328 8.143 -18.201 1.00 0.00 H new ATOM 0 HD22 ASN A 5 5.902 8.590 -16.591 1.00 0.00 H new ATOM 58 N GLU A 6 4.070 4.603 -15.349 1.00 0.00 N ATOM 59 CA GLU A 6 3.479 3.311 -15.665 1.00 0.00 C ATOM 60 C GLU A 6 2.910 2.716 -14.369 1.00 0.00 C ATOM 61 O GLU A 6 1.808 2.158 -14.340 1.00 0.00 O ATOM 62 CB GLU A 6 4.580 2.388 -16.177 1.00 0.00 C ATOM 63 CG GLU A 6 5.300 2.883 -17.420 1.00 0.00 C ATOM 64 CD GLU A 6 4.478 2.749 -18.676 1.00 0.00 C ATOM 65 OE1 GLU A 6 4.449 1.643 -19.245 1.00 0.00 O ATOM 66 OE2 GLU A 6 3.902 3.748 -19.151 1.00 0.00 O1- ATOM 0 H GLU A 6 5.051 4.676 -15.617 1.00 0.00 H new ATOM 0 HA GLU A 6 2.696 3.420 -16.415 1.00 0.00 H new ATOM 0 HB2 GLU A 6 5.313 2.244 -15.383 1.00 0.00 H new ATOM 0 HB3 GLU A 6 4.146 1.411 -16.391 1.00 0.00 H new ATOM 0 HG2 GLU A 6 5.572 3.929 -17.282 1.00 0.00 H new ATOM 0 HG3 GLU A 6 6.229 2.325 -17.540 1.00 0.00 H new ATOM 73 N TYR A 7 3.673 2.879 -13.302 1.00 0.00 N ATOM 74 CA TYR A 7 3.310 2.409 -11.996 1.00 0.00 C ATOM 75 C TYR A 7 2.843 3.634 -11.232 1.00 0.00 C ATOM 76 O TYR A 7 3.647 4.358 -10.640 1.00 0.00 O ATOM 77 CB TYR A 7 4.533 1.799 -11.276 1.00 0.00 C ATOM 78 CG TYR A 7 5.404 0.901 -12.143 1.00 0.00 C ATOM 79 CD1 TYR A 7 5.112 -0.445 -12.326 1.00 0.00 C ATOM 80 CD2 TYR A 7 6.531 1.419 -12.777 1.00 0.00 C ATOM 81 CE1 TYR A 7 5.923 -1.248 -13.118 1.00 0.00 C ATOM 82 CE2 TYR A 7 7.339 0.628 -13.566 1.00 0.00 C ATOM 83 CZ TYR A 7 7.035 -0.702 -13.734 1.00 0.00 C ATOM 84 OH TYR A 7 7.849 -1.492 -14.531 1.00 0.00 O ATOM 0 H TYR A 7 4.577 3.352 -13.330 1.00 0.00 H new ATOM 0 HA TYR A 7 2.542 1.638 -12.058 1.00 0.00 H new ATOM 0 HB2 TYR A 7 5.148 2.610 -10.885 1.00 0.00 H new ATOM 0 HB3 TYR A 7 4.182 1.223 -10.419 1.00 0.00 H new ATOM 0 HD1 TYR A 7 4.244 -0.872 -11.847 1.00 0.00 H new ATOM 0 HD2 TYR A 7 6.777 2.463 -12.648 1.00 0.00 H new ATOM 0 HE1 TYR A 7 5.687 -2.293 -13.252 1.00 0.00 H new ATOM 0 HE2 TYR A 7 8.207 1.051 -14.050 1.00 0.00 H new ATOM 0 HH TYR A 7 8.584 -0.950 -14.887 1.00 0.00 H new ATOM 94 N LYS A 8 1.565 3.895 -11.277 1.00 0.00 N ATOM 95 CA LYS A 8 1.024 5.118 -10.709 1.00 0.00 C ATOM 96 C LYS A 8 0.825 4.980 -9.194 1.00 0.00 C ATOM 97 O LYS A 8 0.458 5.933 -8.499 1.00 0.00 O ATOM 98 CB LYS A 8 -0.271 5.506 -11.451 1.00 0.00 C ATOM 99 CG LYS A 8 -0.836 6.875 -11.085 1.00 0.00 C ATOM 100 CD LYS A 8 -1.992 7.286 -11.983 1.00 0.00 C ATOM 101 CE LYS A 8 -3.167 6.335 -11.881 1.00 0.00 C ATOM 102 NZ LYS A 8 -4.290 6.768 -12.726 1.00 0.00 N1+ ATOM 0 H LYS A 8 0.870 3.280 -11.701 1.00 0.00 H new ATOM 0 HA LYS A 8 1.737 5.931 -10.847 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -0.078 5.484 -12.524 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -1.029 4.750 -11.248 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -1.173 6.860 -10.048 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -0.044 7.621 -11.153 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -2.317 8.291 -11.715 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -1.649 7.327 -13.017 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -2.853 5.334 -12.178 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -3.495 6.271 -10.844 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -5.076 6.094 -12.631 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -4.606 7.712 -12.426 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -3.983 6.804 -13.719 1.00 0.00 H new ATOM 116 N ASP A 9 1.119 3.795 -8.680 1.00 0.00 N ATOM 117 CA ASP A 9 1.023 3.505 -7.251 1.00 0.00 C ATOM 118 C ASP A 9 2.185 4.107 -6.495 1.00 0.00 C ATOM 119 O ASP A 9 2.175 4.166 -5.265 1.00 0.00 O ATOM 120 CB ASP A 9 0.924 1.996 -6.968 1.00 0.00 C ATOM 121 CG ASP A 9 2.114 1.194 -7.437 1.00 0.00 C ATOM 122 OD1 ASP A 9 2.165 0.850 -8.642 1.00 0.00 O1- ATOM 123 OD2 ASP A 9 2.997 0.871 -6.614 1.00 0.00 O ATOM 0 H ASP A 9 1.432 3.003 -9.241 1.00 0.00 H new ATOM 0 HA ASP A 9 0.100 3.965 -6.899 1.00 0.00 H new ATOM 0 HB2 ASP A 9 0.801 1.847 -5.895 1.00 0.00 H new ATOM 0 HB3 ASP A 9 0.027 1.607 -7.449 1.00 0.00 H new ATOM 128 N ASN A 10 3.174 4.553 -7.227 1.00 0.00 N ATOM 129 CA ASN A 10 4.327 5.216 -6.653 1.00 0.00 C ATOM 130 C ASN A 10 3.922 6.591 -6.169 1.00 0.00 C ATOM 131 O ASN A 10 3.569 7.456 -6.971 1.00 0.00 O ATOM 132 CB ASN A 10 5.456 5.342 -7.680 1.00 0.00 C ATOM 133 CG ASN A 10 6.064 4.018 -8.081 1.00 0.00 C ATOM 134 OD1 ASN A 10 6.108 3.073 -7.298 1.00 0.00 O ATOM 135 ND2 ASN A 10 6.536 3.928 -9.296 1.00 0.00 N ATOM 0 H ASN A 10 3.206 4.468 -8.243 1.00 0.00 H new ATOM 0 HA ASN A 10 4.692 4.619 -5.817 1.00 0.00 H new ATOM 0 HB2 ASN A 10 5.071 5.839 -8.570 1.00 0.00 H new ATOM 0 HB3 ASN A 10 6.238 5.981 -7.270 1.00 0.00 H new ATOM 0 HD21 ASN A 10 6.955 3.055 -9.617 1.00 0.00 H new ATOM 0 HD22 ASN A 10 6.485 4.730 -9.924 1.00 0.00 H new ATOM 142 N ALA A 11 3.939 6.781 -4.860 1.00 0.00 N ATOM 143 CA ALA A 11 3.542 8.048 -4.268 1.00 0.00 C ATOM 144 C ALA A 11 4.639 9.104 -4.396 1.00 0.00 C ATOM 145 O ALA A 11 4.372 10.301 -4.274 1.00 0.00 O ATOM 146 CB ALA A 11 3.109 7.861 -2.818 1.00 0.00 C ATOM 0 H ALA A 11 4.224 6.071 -4.185 1.00 0.00 H new ATOM 0 HA ALA A 11 2.682 8.417 -4.827 1.00 0.00 H new ATOM 0 HB1 ALA A 11 2.817 8.824 -2.398 1.00 0.00 H new ATOM 0 HB2 ALA A 11 2.263 7.175 -2.777 1.00 0.00 H new ATOM 0 HB3 ALA A 11 3.937 7.450 -2.241 1.00 0.00 H new ATOM 152 N TYR A 12 5.867 8.661 -4.633 1.00 0.00 N ATOM 153 CA TYR A 12 6.972 9.576 -4.853 1.00 0.00 C ATOM 154 C TYR A 12 6.978 10.032 -6.289 1.00 0.00 C ATOM 155 O TYR A 12 6.701 9.251 -7.210 1.00 0.00 O ATOM 156 CB TYR A 12 8.338 8.957 -4.502 1.00 0.00 C ATOM 157 CG TYR A 12 8.670 8.893 -3.027 1.00 0.00 C ATOM 158 CD1 TYR A 12 8.246 7.840 -2.234 1.00 0.00 C ATOM 159 CD2 TYR A 12 9.444 9.891 -2.435 1.00 0.00 C ATOM 160 CE1 TYR A 12 8.581 7.780 -0.893 1.00 0.00 C ATOM 161 CE2 TYR A 12 9.779 9.841 -1.096 1.00 0.00 C ATOM 162 CZ TYR A 12 9.346 8.785 -0.328 1.00 0.00 C ATOM 163 OH TYR A 12 9.687 8.718 1.010 1.00 0.00 O ATOM 0 H TYR A 12 6.120 7.674 -4.677 1.00 0.00 H new ATOM 0 HA TYR A 12 6.821 10.425 -4.186 1.00 0.00 H new ATOM 0 HB2 TYR A 12 8.373 7.946 -4.908 1.00 0.00 H new ATOM 0 HB3 TYR A 12 9.116 9.530 -5.006 1.00 0.00 H new ATOM 0 HD1 TYR A 12 7.645 7.055 -2.668 1.00 0.00 H new ATOM 0 HD2 TYR A 12 9.788 10.720 -3.036 1.00 0.00 H new ATOM 0 HE1 TYR A 12 8.246 6.950 -0.288 1.00 0.00 H new ATOM 0 HE2 TYR A 12 10.377 10.625 -0.655 1.00 0.00 H new ATOM 0 HH TYR A 12 9.481 9.572 1.443 1.00 0.00 H new ATOM 173 N ILE A 13 7.259 11.270 -6.488 1.00 0.00 N ATOM 174 CA ILE A 13 7.301 11.813 -7.799 1.00 0.00 C ATOM 175 C ILE A 13 8.686 12.314 -8.136 1.00 0.00 C ATOM 176 O ILE A 13 9.394 12.874 -7.285 1.00 0.00 O ATOM 177 CB ILE A 13 6.235 12.922 -8.011 1.00 0.00 C ATOM 178 CG1 ILE A 13 6.414 14.074 -7.005 1.00 0.00 C ATOM 179 CG2 ILE A 13 4.842 12.326 -7.911 1.00 0.00 C ATOM 180 CD1 ILE A 13 5.353 15.146 -7.086 1.00 0.00 C ATOM 0 H ILE A 13 7.467 11.937 -5.745 1.00 0.00 H new ATOM 0 HA ILE A 13 7.056 11.004 -8.487 1.00 0.00 H new ATOM 0 HB ILE A 13 6.369 13.340 -9.009 1.00 0.00 H new ATOM 0 HG12 ILE A 13 6.419 13.661 -5.996 1.00 0.00 H new ATOM 0 HG13 ILE A 13 7.389 14.533 -7.167 1.00 0.00 H new ATOM 0 HG21 ILE A 13 4.099 13.110 -8.061 1.00 0.00 H new ATOM 0 HG22 ILE A 13 4.719 11.559 -8.675 1.00 0.00 H new ATOM 0 HG23 ILE A 13 4.706 11.881 -6.925 1.00 0.00 H new ATOM 0 HD11 ILE A 13 5.557 15.917 -6.343 1.00 0.00 H new ATOM 0 HD12 ILE A 13 5.360 15.590 -8.081 1.00 0.00 H new ATOM 0 HD13 ILE A 13 4.375 14.705 -6.892 1.00 0.00 H new ATOM 192 N TYR A 14 9.068 12.058 -9.346 1.00 0.00 N ATOM 193 CA TYR A 14 10.320 12.476 -9.908 1.00 0.00 C ATOM 194 C TYR A 14 10.141 13.832 -10.517 1.00 0.00 C ATOM 195 O TYR A 14 9.262 14.022 -11.337 1.00 0.00 O ATOM 196 CB TYR A 14 10.768 11.456 -10.984 1.00 0.00 C ATOM 197 CG TYR A 14 11.734 11.981 -12.043 1.00 0.00 C ATOM 198 CD1 TYR A 14 13.095 12.147 -11.792 1.00 0.00 C ATOM 199 CD2 TYR A 14 11.259 12.294 -13.315 1.00 0.00 C ATOM 200 CE1 TYR A 14 13.944 12.611 -12.785 1.00 0.00 C ATOM 201 CE2 TYR A 14 12.091 12.758 -14.301 1.00 0.00 C ATOM 202 CZ TYR A 14 13.434 12.917 -14.037 1.00 0.00 C ATOM 203 OH TYR A 14 14.276 13.381 -15.030 1.00 0.00 O ATOM 0 H TYR A 14 8.493 11.529 -10.001 1.00 0.00 H new ATOM 0 HA TYR A 14 11.086 12.524 -9.134 1.00 0.00 H new ATOM 0 HB2 TYR A 14 11.236 10.610 -10.481 1.00 0.00 H new ATOM 0 HB3 TYR A 14 9.879 11.076 -11.488 1.00 0.00 H new ATOM 0 HD1 TYR A 14 13.492 11.912 -10.815 1.00 0.00 H new ATOM 0 HD2 TYR A 14 10.208 12.168 -13.530 1.00 0.00 H new ATOM 0 HE1 TYR A 14 14.998 12.733 -12.584 1.00 0.00 H new ATOM 0 HE2 TYR A 14 11.697 12.997 -15.278 1.00 0.00 H new ATOM 0 HH TYR A 14 13.759 13.547 -15.846 1.00 0.00 H new ATOM 213 N ILE A 15 10.931 14.759 -10.099 1.00 0.00 N ATOM 214 CA ILE A 15 10.909 16.075 -10.656 1.00 0.00 C ATOM 215 C ILE A 15 12.262 16.252 -11.327 1.00 0.00 C ATOM 216 O ILE A 15 13.280 16.434 -10.655 1.00 0.00 O ATOM 217 CB ILE A 15 10.729 17.155 -9.559 1.00 0.00 C ATOM 218 CG1 ILE A 15 9.684 16.699 -8.524 1.00 0.00 C ATOM 219 CG2 ILE A 15 10.258 18.457 -10.213 1.00 0.00 C ATOM 220 CD1 ILE A 15 9.601 17.579 -7.296 1.00 0.00 C ATOM 0 H ILE A 15 11.617 14.629 -9.356 1.00 0.00 H new ATOM 0 HA ILE A 15 10.076 16.189 -11.349 1.00 0.00 H new ATOM 0 HB ILE A 15 11.681 17.311 -9.052 1.00 0.00 H new ATOM 0 HG12 ILE A 15 8.705 16.669 -9.002 1.00 0.00 H new ATOM 0 HG13 ILE A 15 9.918 15.681 -8.212 1.00 0.00 H new ATOM 0 HG21 ILE A 15 10.129 19.222 -9.448 1.00 0.00 H new ATOM 0 HG22 ILE A 15 11.001 18.790 -10.937 1.00 0.00 H new ATOM 0 HG23 ILE A 15 9.308 18.287 -10.720 1.00 0.00 H new ATOM 0 HD11 ILE A 15 8.842 17.188 -6.619 1.00 0.00 H new ATOM 0 HD12 ILE A 15 10.567 17.591 -6.791 1.00 0.00 H new ATOM 0 HD13 ILE A 15 9.335 18.593 -7.593 1.00 0.00 H new ATOM 232 N GLY A 16 12.294 16.150 -12.623 1.00 0.00 N ATOM 233 CA GLY A 16 13.560 16.125 -13.298 1.00 0.00 C ATOM 234 C GLY A 16 13.751 17.166 -14.352 1.00 0.00 C ATOM 235 O GLY A 16 13.767 16.847 -15.541 1.00 0.00 O ATOM 0 H GLY A 16 11.474 16.084 -13.226 1.00 0.00 H new ATOM 0 HA2 GLY A 16 14.350 16.237 -12.555 1.00 0.00 H new ATOM 0 HA3 GLY A 16 13.689 15.144 -13.755 1.00 0.00 H new ATOM 239 N ASN A 17 13.848 18.403 -13.909 1.00 0.00 N ATOM 240 CA ASN A 17 14.222 19.561 -14.732 1.00 0.00 C ATOM 241 C ASN A 17 14.033 20.815 -13.926 1.00 0.00 C ATOM 242 O ASN A 17 13.089 21.567 -14.120 1.00 0.00 O ATOM 243 CB ASN A 17 13.486 19.681 -16.097 1.00 0.00 C ATOM 244 CG ASN A 17 14.042 20.815 -16.963 1.00 0.00 C ATOM 245 OD1 ASN A 17 15.215 21.160 -16.876 1.00 0.00 O ATOM 246 ND2 ASN A 17 13.222 21.399 -17.781 1.00 0.00 N ATOM 0 H ASN A 17 13.665 18.650 -12.936 1.00 0.00 H new ATOM 0 HA ASN A 17 15.268 19.410 -15.000 1.00 0.00 H new ATOM 0 HB2 ASN A 17 13.573 18.739 -16.638 1.00 0.00 H new ATOM 0 HB3 ASN A 17 12.424 19.850 -15.920 1.00 0.00 H new ATOM 0 HD21 ASN A 17 13.549 22.164 -18.371 1.00 0.00 H new ATOM 0 HD22 ASN A 17 12.250 21.093 -17.834 1.00 0.00 H new ATOM 253 N LEU A 18 14.864 20.973 -12.948 1.00 0.00 N ATOM 254 CA LEU A 18 14.838 22.141 -12.124 1.00 0.00 C ATOM 255 C LEU A 18 16.001 22.975 -12.502 1.00 0.00 C ATOM 256 O LEU A 18 16.973 22.463 -13.042 1.00 0.00 O ATOM 257 CB LEU A 18 14.907 21.820 -10.618 1.00 0.00 C ATOM 258 CG LEU A 18 13.693 21.145 -9.968 1.00 0.00 C ATOM 259 CD1 LEU A 18 13.527 19.720 -10.432 1.00 0.00 C ATOM 260 CD2 LEU A 18 13.805 21.201 -8.464 1.00 0.00 C ATOM 0 H LEU A 18 15.583 20.295 -12.696 1.00 0.00 H new ATOM 0 HA LEU A 18 13.891 22.656 -12.286 1.00 0.00 H new ATOM 0 HB2 LEU A 18 15.773 21.179 -10.453 1.00 0.00 H new ATOM 0 HB3 LEU A 18 15.095 22.753 -10.086 1.00 0.00 H new ATOM 0 HG LEU A 18 12.805 21.695 -10.279 1.00 0.00 H new ATOM 0 HD11 LEU A 18 12.656 19.279 -9.948 1.00 0.00 H new ATOM 0 HD12 LEU A 18 13.389 19.703 -11.513 1.00 0.00 H new ATOM 0 HD13 LEU A 18 14.416 19.146 -10.171 1.00 0.00 H new ATOM 0 HD21 LEU A 18 12.936 20.718 -8.016 1.00 0.00 H new ATOM 0 HD22 LEU A 18 14.711 20.684 -8.147 1.00 0.00 H new ATOM 0 HD23 LEU A 18 13.849 22.241 -8.141 1.00 0.00 H new ATOM 272 N ASN A 19 15.910 24.234 -12.269 1.00 0.00 N ATOM 273 CA ASN A 19 16.978 25.115 -12.597 1.00 0.00 C ATOM 274 C ASN A 19 17.963 25.123 -11.434 1.00 0.00 C ATOM 275 O ASN A 19 17.589 24.764 -10.317 1.00 0.00 O ATOM 276 CB ASN A 19 16.420 26.495 -12.947 1.00 0.00 C ATOM 277 CG ASN A 19 17.437 27.407 -13.580 1.00 0.00 C ATOM 278 OD1 ASN A 19 18.424 26.952 -14.162 1.00 0.00 O ATOM 279 ND2 ASN A 19 17.165 28.675 -13.555 1.00 0.00 N ATOM 0 H ASN A 19 15.098 24.684 -11.847 1.00 0.00 H new ATOM 0 HA ASN A 19 17.521 24.781 -13.481 1.00 0.00 H new ATOM 0 HB2 ASN A 19 15.576 26.376 -13.627 1.00 0.00 H new ATOM 0 HB3 ASN A 19 16.036 26.964 -12.041 1.00 0.00 H new ATOM 0 HD21 ASN A 19 17.779 29.338 -14.029 1.00 0.00 H new ATOM 0 HD22 ASN A 19 16.337 29.009 -13.061 1.00 0.00 H new ATOM 286 N ARG A 20 19.183 25.530 -11.698 1.00 0.00 N ATOM 287 CA ARG A 20 20.324 25.396 -10.773 1.00 0.00 C ATOM 288 C ARG A 20 20.054 25.948 -9.363 1.00 0.00 C ATOM 289 O ARG A 20 20.486 25.369 -8.374 1.00 0.00 O ATOM 290 CB ARG A 20 21.520 26.106 -11.365 1.00 0.00 C ATOM 291 CG ARG A 20 22.855 25.674 -10.800 1.00 0.00 C ATOM 292 CD ARG A 20 23.161 24.239 -11.179 1.00 0.00 C ATOM 293 NE ARG A 20 24.583 24.051 -11.429 1.00 0.00 N ATOM 294 CZ ARG A 20 25.237 22.893 -11.369 1.00 0.00 C ATOM 295 NH1 ARG A 20 24.715 21.852 -10.734 1.00 0.00 N1+ ATOM 296 NH2 ARG A 20 26.460 22.813 -11.866 1.00 0.00 N ATOM 0 H ARG A 20 19.433 25.977 -12.580 1.00 0.00 H new ATOM 0 HA ARG A 20 20.507 24.328 -10.654 1.00 0.00 H new ATOM 0 HB2 ARG A 20 21.526 25.941 -12.442 1.00 0.00 H new ATOM 0 HB3 ARG A 20 21.404 27.178 -11.207 1.00 0.00 H new ATOM 0 HG2 ARG A 20 23.642 26.329 -11.173 1.00 0.00 H new ATOM 0 HG3 ARG A 20 22.845 25.774 -9.715 1.00 0.00 H new ATOM 0 HD2 ARG A 20 22.839 23.572 -10.379 1.00 0.00 H new ATOM 0 HD3 ARG A 20 22.594 23.966 -12.069 1.00 0.00 H new ATOM 0 HE ARG A 20 25.126 24.880 -11.672 1.00 0.00 H new ATOM 0 HH11 ARG A 20 23.803 21.934 -10.285 1.00 0.00 H new ATOM 0 HH12 ARG A 20 25.226 20.970 -10.695 1.00 0.00 H new ATOM 0 HH21 ARG A 20 26.893 23.634 -12.290 1.00 0.00 H new ATOM 0 HH22 ARG A 20 26.970 21.931 -11.825 1.00 0.00 H new ATOM 310 N GLU A 21 19.375 27.057 -9.288 1.00 0.00 N ATOM 311 CA GLU A 21 19.068 27.689 -8.011 1.00 0.00 C ATOM 312 C GLU A 21 17.833 27.128 -7.300 1.00 0.00 C ATOM 313 O GLU A 21 17.514 27.572 -6.192 1.00 0.00 O ATOM 314 CB GLU A 21 18.971 29.226 -8.119 1.00 0.00 C ATOM 315 CG GLU A 21 18.348 29.754 -9.385 1.00 0.00 C ATOM 316 CD GLU A 21 19.330 29.795 -10.522 1.00 0.00 C ATOM 317 OE1 GLU A 21 20.131 30.749 -10.581 1.00 0.00 O ATOM 318 OE2 GLU A 21 19.336 28.884 -11.352 1.00 0.00 O1- ATOM 0 H GLU A 21 19.014 27.557 -10.100 1.00 0.00 H new ATOM 0 HA GLU A 21 19.923 27.435 -7.385 1.00 0.00 H new ATOM 0 HB2 GLU A 21 18.395 29.596 -7.271 1.00 0.00 H new ATOM 0 HB3 GLU A 21 19.974 29.642 -8.029 1.00 0.00 H new ATOM 0 HG2 GLU A 21 17.500 29.127 -9.661 1.00 0.00 H new ATOM 0 HG3 GLU A 21 17.958 30.756 -9.206 1.00 0.00 H new ATOM 325 N LEU A 22 17.134 26.186 -7.900 1.00 0.00 N ATOM 326 CA LEU A 22 15.964 25.631 -7.235 1.00 0.00 C ATOM 327 C LEU A 22 16.360 24.681 -6.110 1.00 0.00 C ATOM 328 O LEU A 22 17.060 23.677 -6.312 1.00 0.00 O ATOM 329 CB LEU A 22 14.999 24.974 -8.229 1.00 0.00 C ATOM 330 CG LEU A 22 14.399 25.929 -9.269 1.00 0.00 C ATOM 331 CD1 LEU A 22 13.402 25.248 -10.159 1.00 0.00 C ATOM 332 CD2 LEU A 22 13.742 27.083 -8.590 1.00 0.00 C ATOM 0 H LEU A 22 17.343 25.796 -8.819 1.00 0.00 H new ATOM 0 HA LEU A 22 15.426 26.462 -6.780 1.00 0.00 H new ATOM 0 HB2 LEU A 22 15.525 24.175 -8.751 1.00 0.00 H new ATOM 0 HB3 LEU A 22 14.186 24.509 -7.671 1.00 0.00 H new ATOM 0 HG LEU A 22 15.223 26.278 -9.892 1.00 0.00 H new ATOM 0 HD11 LEU A 22 13.006 25.966 -10.878 1.00 0.00 H new ATOM 0 HD12 LEU A 22 13.888 24.431 -10.692 1.00 0.00 H new ATOM 0 HD13 LEU A 22 12.586 24.852 -9.555 1.00 0.00 H new ATOM 0 HD21 LEU A 22 13.320 27.754 -9.339 1.00 0.00 H new ATOM 0 HD22 LEU A 22 12.947 26.718 -7.940 1.00 0.00 H new ATOM 0 HD23 LEU A 22 14.479 27.622 -7.994 1.00 0.00 H new ATOM 344 N THR A 23 15.959 25.073 -4.934 1.00 0.00 N ATOM 345 CA THR A 23 16.199 24.373 -3.700 1.00 0.00 C ATOM 346 C THR A 23 14.848 23.836 -3.112 1.00 0.00 C ATOM 347 O THR A 23 13.791 24.104 -3.685 1.00 0.00 O ATOM 348 CB THR A 23 16.961 25.327 -2.742 1.00 0.00 C ATOM 349 OG1 THR A 23 17.182 24.764 -1.460 1.00 0.00 O ATOM 350 CG2 THR A 23 16.243 26.635 -2.610 1.00 0.00 C ATOM 0 H THR A 23 15.428 25.934 -4.801 1.00 0.00 H new ATOM 0 HA THR A 23 16.822 23.493 -3.856 1.00 0.00 H new ATOM 0 HB THR A 23 17.939 25.494 -3.193 1.00 0.00 H new ATOM 0 HG1 THR A 23 16.614 25.217 -0.802 1.00 0.00 H new ATOM 0 HG21 THR A 23 16.796 27.287 -1.934 1.00 0.00 H new ATOM 0 HG22 THR A 23 16.167 27.108 -3.589 1.00 0.00 H new ATOM 0 HG23 THR A 23 15.243 26.463 -2.211 1.00 0.00 H new ATOM 358 N GLU A 24 14.884 23.157 -1.941 1.00 0.00 N ATOM 359 CA GLU A 24 13.689 22.476 -1.365 1.00 0.00 C ATOM 360 C GLU A 24 12.523 23.429 -1.114 1.00 0.00 C ATOM 361 O GLU A 24 11.377 23.132 -1.455 1.00 0.00 O ATOM 362 CB GLU A 24 13.986 21.753 -0.035 1.00 0.00 C ATOM 363 CG GLU A 24 15.140 20.769 -0.046 1.00 0.00 C ATOM 364 CD GLU A 24 16.482 21.432 0.090 1.00 0.00 C ATOM 365 OE1 GLU A 24 16.543 22.609 0.561 1.00 0.00 O1- ATOM 366 OE2 GLU A 24 17.494 20.810 -0.283 1.00 0.00 O ATOM 0 H GLU A 24 15.726 23.063 -1.373 1.00 0.00 H new ATOM 0 HA GLU A 24 13.415 21.747 -2.127 1.00 0.00 H new ATOM 0 HB2 GLU A 24 14.187 22.507 0.726 1.00 0.00 H new ATOM 0 HB3 GLU A 24 13.086 21.221 0.273 1.00 0.00 H new ATOM 0 HG2 GLU A 24 15.009 20.056 0.768 1.00 0.00 H new ATOM 0 HG3 GLU A 24 15.115 20.200 -0.975 1.00 0.00 H new ATOM 373 N GLY A 25 12.828 24.578 -0.542 1.00 0.00 N ATOM 374 CA GLY A 25 11.793 25.538 -0.158 1.00 0.00 C ATOM 375 C GLY A 25 11.062 26.108 -1.338 1.00 0.00 C ATOM 376 O GLY A 25 9.890 26.498 -1.239 1.00 0.00 O ATOM 0 H GLY A 25 13.780 24.875 -0.330 1.00 0.00 H new ATOM 0 HA2 GLY A 25 11.079 25.050 0.505 1.00 0.00 H new ATOM 0 HA3 GLY A 25 12.249 26.350 0.408 1.00 0.00 H new ATOM 380 N ASP A 26 11.727 26.121 -2.457 1.00 0.00 N ATOM 381 CA ASP A 26 11.154 26.638 -3.670 1.00 0.00 C ATOM 382 C ASP A 26 10.146 25.650 -4.178 1.00 0.00 C ATOM 383 O ASP A 26 9.004 25.993 -4.477 1.00 0.00 O ATOM 384 CB ASP A 26 12.223 26.836 -4.709 1.00 0.00 C ATOM 385 CG ASP A 26 11.677 27.519 -5.908 1.00 0.00 C ATOM 386 OD1 ASP A 26 11.157 26.857 -6.800 1.00 0.00 O ATOM 387 OD2 ASP A 26 11.777 28.750 -5.953 1.00 0.00 O1- ATOM 0 H ASP A 26 12.681 25.774 -2.556 1.00 0.00 H new ATOM 0 HA ASP A 26 10.680 27.599 -3.469 1.00 0.00 H new ATOM 0 HB2 ASP A 26 13.038 27.425 -4.290 1.00 0.00 H new ATOM 0 HB3 ASP A 26 12.641 25.871 -4.994 1.00 0.00 H new ATOM 392 N ILE A 27 10.568 24.403 -4.178 1.00 0.00 N ATOM 393 CA ILE A 27 9.758 23.276 -4.599 1.00 0.00 C ATOM 394 C ILE A 27 8.495 23.203 -3.744 1.00 0.00 C ATOM 395 O ILE A 27 7.419 22.919 -4.237 1.00 0.00 O ATOM 396 CB ILE A 27 10.572 21.973 -4.457 1.00 0.00 C ATOM 397 CG1 ILE A 27 11.867 22.113 -5.239 1.00 0.00 C ATOM 398 CG2 ILE A 27 9.780 20.779 -4.972 1.00 0.00 C ATOM 399 CD1 ILE A 27 12.858 21.026 -4.974 1.00 0.00 C ATOM 0 H ILE A 27 11.506 24.137 -3.878 1.00 0.00 H new ATOM 0 HA ILE A 27 9.471 23.404 -5.643 1.00 0.00 H new ATOM 0 HB ILE A 27 10.790 21.803 -3.403 1.00 0.00 H new ATOM 0 HG12 ILE A 27 11.636 22.128 -6.304 1.00 0.00 H new ATOM 0 HG13 ILE A 27 12.323 23.073 -4.998 1.00 0.00 H new ATOM 0 HG21 ILE A 27 10.375 19.873 -4.861 1.00 0.00 H new ATOM 0 HG22 ILE A 27 8.858 20.680 -4.400 1.00 0.00 H new ATOM 0 HG23 ILE A 27 9.539 20.929 -6.025 1.00 0.00 H new ATOM 0 HD11 ILE A 27 13.755 21.198 -5.570 1.00 0.00 H new ATOM 0 HD12 ILE A 27 13.120 21.023 -3.916 1.00 0.00 H new ATOM 0 HD13 ILE A 27 12.423 20.063 -5.243 1.00 0.00 H new ATOM 411 N LEU A 28 8.641 23.496 -2.467 1.00 0.00 N ATOM 412 CA LEU A 28 7.512 23.568 -1.548 1.00 0.00 C ATOM 413 C LEU A 28 6.566 24.680 -1.952 1.00 0.00 C ATOM 414 O LEU A 28 5.366 24.489 -1.983 1.00 0.00 O ATOM 415 CB LEU A 28 8.000 23.770 -0.114 1.00 0.00 C ATOM 416 CG LEU A 28 8.263 22.506 0.720 1.00 0.00 C ATOM 417 CD1 LEU A 28 8.951 21.428 -0.085 1.00 0.00 C ATOM 418 CD2 LEU A 28 9.124 22.867 1.905 1.00 0.00 C ATOM 0 H LEU A 28 9.543 23.691 -2.033 1.00 0.00 H new ATOM 0 HA LEU A 28 6.969 22.624 -1.596 1.00 0.00 H new ATOM 0 HB2 LEU A 28 8.922 24.350 -0.149 1.00 0.00 H new ATOM 0 HB3 LEU A 28 7.262 24.375 0.412 1.00 0.00 H new ATOM 0 HG LEU A 28 7.300 22.114 1.047 1.00 0.00 H new ATOM 0 HD11 LEU A 28 9.117 20.554 0.544 1.00 0.00 H new ATOM 0 HD12 LEU A 28 8.324 21.151 -0.933 1.00 0.00 H new ATOM 0 HD13 LEU A 28 9.909 21.800 -0.448 1.00 0.00 H new ATOM 0 HD21 LEU A 28 9.315 21.975 2.501 1.00 0.00 H new ATOM 0 HD22 LEU A 28 10.071 23.279 1.555 1.00 0.00 H new ATOM 0 HD23 LEU A 28 8.610 23.609 2.516 1.00 0.00 H new ATOM 430 N THR A 29 7.120 25.803 -2.309 1.00 0.00 N ATOM 431 CA THR A 29 6.358 26.955 -2.746 1.00 0.00 C ATOM 432 C THR A 29 5.578 26.630 -4.059 1.00 0.00 C ATOM 433 O THR A 29 4.496 27.178 -4.327 1.00 0.00 O ATOM 434 CB THR A 29 7.325 28.154 -2.941 1.00 0.00 C ATOM 435 OG1 THR A 29 8.000 28.424 -1.691 1.00 0.00 O ATOM 436 CG2 THR A 29 6.595 29.409 -3.410 1.00 0.00 C ATOM 0 H THR A 29 8.129 25.954 -2.307 1.00 0.00 H new ATOM 0 HA THR A 29 5.619 27.218 -1.989 1.00 0.00 H new ATOM 0 HB THR A 29 8.044 27.885 -3.715 1.00 0.00 H new ATOM 0 HG1 THR A 29 8.676 27.733 -1.528 1.00 0.00 H new ATOM 0 HG21 THR A 29 7.311 30.222 -3.533 1.00 0.00 H new ATOM 0 HG22 THR A 29 6.105 29.210 -4.363 1.00 0.00 H new ATOM 0 HG23 THR A 29 5.847 29.693 -2.670 1.00 0.00 H new ATOM 444 N VAL A 30 6.133 25.754 -4.865 1.00 0.00 N ATOM 445 CA VAL A 30 5.487 25.311 -6.084 1.00 0.00 C ATOM 446 C VAL A 30 4.431 24.223 -5.798 1.00 0.00 C ATOM 447 O VAL A 30 3.252 24.384 -6.114 1.00 0.00 O ATOM 448 CB VAL A 30 6.525 24.791 -7.121 1.00 0.00 C ATOM 449 CG1 VAL A 30 5.849 24.372 -8.418 1.00 0.00 C ATOM 450 CG2 VAL A 30 7.579 25.850 -7.401 1.00 0.00 C ATOM 0 H VAL A 30 7.044 25.328 -4.696 1.00 0.00 H new ATOM 0 HA VAL A 30 4.981 26.177 -6.510 1.00 0.00 H new ATOM 0 HB VAL A 30 7.010 23.915 -6.691 1.00 0.00 H new ATOM 0 HG11 VAL A 30 6.601 24.014 -9.121 1.00 0.00 H new ATOM 0 HG12 VAL A 30 5.134 23.575 -8.215 1.00 0.00 H new ATOM 0 HG13 VAL A 30 5.327 25.227 -8.849 1.00 0.00 H new ATOM 0 HG21 VAL A 30 8.295 25.467 -8.128 1.00 0.00 H new ATOM 0 HG22 VAL A 30 7.100 26.744 -7.800 1.00 0.00 H new ATOM 0 HG23 VAL A 30 8.099 26.099 -6.476 1.00 0.00 H new ATOM 460 N PHE A 31 4.857 23.169 -5.141 1.00 0.00 N ATOM 461 CA PHE A 31 4.047 21.978 -4.917 1.00 0.00 C ATOM 462 C PHE A 31 2.997 22.105 -3.822 1.00 0.00 C ATOM 463 O PHE A 31 2.099 21.273 -3.742 1.00 0.00 O ATOM 464 CB PHE A 31 4.933 20.740 -4.701 1.00 0.00 C ATOM 465 CG PHE A 31 5.577 20.224 -5.967 1.00 0.00 C ATOM 466 CD1 PHE A 31 6.565 20.948 -6.612 1.00 0.00 C ATOM 467 CD2 PHE A 31 5.181 19.015 -6.514 1.00 0.00 C ATOM 468 CE1 PHE A 31 7.143 20.485 -7.773 1.00 0.00 C ATOM 469 CE2 PHE A 31 5.761 18.547 -7.676 1.00 0.00 C ATOM 470 CZ PHE A 31 6.738 19.283 -8.306 1.00 0.00 C ATOM 0 H PHE A 31 5.792 23.107 -4.737 1.00 0.00 H new ATOM 0 HA PHE A 31 3.472 21.854 -5.835 1.00 0.00 H new ATOM 0 HB2 PHE A 31 5.714 20.984 -3.981 1.00 0.00 H new ATOM 0 HB3 PHE A 31 4.330 19.946 -4.261 1.00 0.00 H new ATOM 0 HD1 PHE A 31 6.888 21.892 -6.198 1.00 0.00 H new ATOM 0 HD2 PHE A 31 4.412 18.433 -6.027 1.00 0.00 H new ATOM 0 HE1 PHE A 31 7.912 21.064 -8.264 1.00 0.00 H new ATOM 0 HE2 PHE A 31 5.447 17.601 -8.092 1.00 0.00 H new ATOM 0 HZ PHE A 31 7.187 18.918 -9.218 1.00 0.00 H new ATOM 480 N SER A 32 3.067 23.125 -2.992 1.00 0.00 N ATOM 481 CA SER A 32 2.039 23.293 -1.965 1.00 0.00 C ATOM 482 C SER A 32 0.698 23.731 -2.560 1.00 0.00 C ATOM 483 O SER A 32 -0.312 23.729 -1.893 1.00 0.00 O ATOM 484 CB SER A 32 2.475 24.230 -0.848 1.00 0.00 C ATOM 485 OG SER A 32 3.612 23.727 -0.166 1.00 0.00 O ATOM 0 H SER A 32 3.799 23.836 -2.999 1.00 0.00 H new ATOM 0 HA SER A 32 1.897 22.309 -1.519 1.00 0.00 H new ATOM 0 HB2 SER A 32 2.702 25.212 -1.263 1.00 0.00 H new ATOM 0 HB3 SER A 32 1.655 24.364 -0.142 1.00 0.00 H new ATOM 0 HG SER A 32 4.419 23.924 -0.686 1.00 0.00 H new ATOM 491 N GLU A 33 0.692 24.072 -3.826 1.00 0.00 N ATOM 492 CA GLU A 33 -0.531 24.473 -4.501 1.00 0.00 C ATOM 493 C GLU A 33 -1.408 23.204 -4.713 1.00 0.00 C ATOM 494 O GLU A 33 -2.603 23.278 -4.956 1.00 0.00 O ATOM 495 CB GLU A 33 -0.139 25.126 -5.840 1.00 0.00 C ATOM 496 CG GLU A 33 -1.061 26.240 -6.347 1.00 0.00 C ATOM 497 CD GLU A 33 -2.432 25.798 -6.776 1.00 0.00 C ATOM 498 OE1 GLU A 33 -2.568 25.182 -7.871 1.00 0.00 O ATOM 499 OE2 GLU A 33 -3.405 26.106 -6.076 1.00 0.00 O1- ATOM 0 H GLU A 33 1.523 24.082 -4.418 1.00 0.00 H new ATOM 0 HA GLU A 33 -1.106 25.192 -3.918 1.00 0.00 H new ATOM 0 HB2 GLU A 33 0.867 25.533 -5.741 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -0.094 24.347 -6.601 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -1.168 26.986 -5.559 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -0.577 26.734 -7.190 1.00 0.00 H new ATOM 506 N TYR A 34 -0.791 22.039 -4.552 1.00 0.00 N ATOM 507 CA TYR A 34 -1.465 20.772 -4.769 1.00 0.00 C ATOM 508 C TYR A 34 -1.582 19.980 -3.475 1.00 0.00 C ATOM 509 O TYR A 34 -1.946 18.803 -3.484 1.00 0.00 O ATOM 510 CB TYR A 34 -0.710 19.961 -5.822 1.00 0.00 C ATOM 511 CG TYR A 34 -0.524 20.727 -7.101 1.00 0.00 C ATOM 512 CD1 TYR A 34 -1.534 20.789 -8.039 1.00 0.00 C ATOM 513 CD2 TYR A 34 0.646 21.424 -7.347 1.00 0.00 C ATOM 514 CE1 TYR A 34 -1.387 21.513 -9.190 1.00 0.00 C ATOM 515 CE2 TYR A 34 0.798 22.159 -8.489 1.00 0.00 C ATOM 516 CZ TYR A 34 -0.221 22.200 -9.412 1.00 0.00 C ATOM 517 OH TYR A 34 -0.079 22.943 -10.556 1.00 0.00 O ATOM 0 H TYR A 34 0.185 21.950 -4.269 1.00 0.00 H new ATOM 0 HA TYR A 34 -2.475 20.976 -5.125 1.00 0.00 H new ATOM 0 HB2 TYR A 34 0.265 19.674 -5.427 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -1.255 19.040 -6.028 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -2.457 20.257 -7.861 1.00 0.00 H new ATOM 0 HD2 TYR A 34 1.450 21.387 -6.627 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -2.183 21.543 -9.919 1.00 0.00 H new ATOM 0 HE2 TYR A 34 1.713 22.705 -8.666 1.00 0.00 H new ATOM 0 HH TYR A 34 -0.085 23.896 -10.330 1.00 0.00 H new ATOM 527 N GLY A 35 -1.286 20.618 -2.364 1.00 0.00 N ATOM 528 CA GLY A 35 -1.395 19.952 -1.092 1.00 0.00 C ATOM 529 C GLY A 35 -0.228 20.263 -0.202 1.00 0.00 C ATOM 530 O GLY A 35 0.360 21.336 -0.301 1.00 0.00 O ATOM 0 H GLY A 35 -0.971 21.587 -2.318 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -2.319 20.256 -0.600 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -1.456 18.875 -1.249 1.00 0.00 H new ATOM 534 N VAL A 36 0.113 19.343 0.657 1.00 0.00 N ATOM 535 CA VAL A 36 1.216 19.528 1.566 1.00 0.00 C ATOM 536 C VAL A 36 2.300 18.496 1.270 1.00 0.00 C ATOM 537 O VAL A 36 2.049 17.289 1.363 1.00 0.00 O ATOM 538 CB VAL A 36 0.770 19.394 3.054 1.00 0.00 C ATOM 539 CG1 VAL A 36 1.941 19.645 4.005 1.00 0.00 C ATOM 540 CG2 VAL A 36 -0.377 20.346 3.364 1.00 0.00 C ATOM 0 H VAL A 36 -0.363 18.445 0.749 1.00 0.00 H new ATOM 0 HA VAL A 36 1.602 20.537 1.419 1.00 0.00 H new ATOM 0 HB VAL A 36 0.422 18.372 3.204 1.00 0.00 H new ATOM 0 HG11 VAL A 36 1.601 19.545 5.036 1.00 0.00 H new ATOM 0 HG12 VAL A 36 2.730 18.918 3.811 1.00 0.00 H new ATOM 0 HG13 VAL A 36 2.329 20.651 3.847 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -0.671 20.234 4.408 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -0.056 21.372 3.185 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -1.226 20.114 2.721 1.00 0.00 H new ATOM 550 N PRO A 37 3.484 18.944 0.825 1.00 0.00 N ATOM 551 CA PRO A 37 4.632 18.064 0.632 1.00 0.00 C ATOM 552 C PRO A 37 5.090 17.503 1.974 1.00 0.00 C ATOM 553 O PRO A 37 5.401 18.261 2.898 1.00 0.00 O ATOM 554 CB PRO A 37 5.715 18.996 0.064 1.00 0.00 C ATOM 555 CG PRO A 37 4.975 20.173 -0.460 1.00 0.00 C ATOM 556 CD PRO A 37 3.791 20.335 0.443 1.00 0.00 C ATOM 0 HA PRO A 37 4.412 17.216 -0.016 1.00 0.00 H new ATOM 0 HB2 PRO A 37 6.427 19.289 0.835 1.00 0.00 H new ATOM 0 HB3 PRO A 37 6.284 18.505 -0.725 1.00 0.00 H new ATOM 0 HG2 PRO A 37 5.600 21.066 -0.451 1.00 0.00 H new ATOM 0 HG3 PRO A 37 4.663 20.013 -1.492 1.00 0.00 H new ATOM 0 HD2 PRO A 37 4.025 20.951 1.311 1.00 0.00 H new ATOM 0 HD3 PRO A 37 2.953 20.809 -0.068 1.00 0.00 H new ATOM 564 N VAL A 38 5.105 16.197 2.092 1.00 0.00 N ATOM 565 CA VAL A 38 5.491 15.567 3.346 1.00 0.00 C ATOM 566 C VAL A 38 6.916 15.039 3.253 1.00 0.00 C ATOM 567 O VAL A 38 7.593 14.819 4.264 1.00 0.00 O ATOM 568 CB VAL A 38 4.520 14.419 3.734 1.00 0.00 C ATOM 569 CG1 VAL A 38 3.087 14.940 3.790 1.00 0.00 C ATOM 570 CG2 VAL A 38 4.634 13.249 2.767 1.00 0.00 C ATOM 0 H VAL A 38 4.858 15.548 1.345 1.00 0.00 H new ATOM 0 HA VAL A 38 5.438 16.325 4.127 1.00 0.00 H new ATOM 0 HB VAL A 38 4.799 14.055 4.723 1.00 0.00 H new ATOM 0 HG11 VAL A 38 2.415 14.127 4.063 1.00 0.00 H new ATOM 0 HG12 VAL A 38 3.017 15.734 4.534 1.00 0.00 H new ATOM 0 HG13 VAL A 38 2.804 15.332 2.813 1.00 0.00 H new ATOM 0 HG21 VAL A 38 3.942 12.462 3.065 1.00 0.00 H new ATOM 0 HG22 VAL A 38 4.389 13.585 1.759 1.00 0.00 H new ATOM 0 HG23 VAL A 38 5.653 12.862 2.783 1.00 0.00 H new ATOM 580 N ASP A 39 7.348 14.851 2.034 1.00 0.00 N ATOM 581 CA ASP A 39 8.665 14.365 1.695 1.00 0.00 C ATOM 582 C ASP A 39 9.157 15.181 0.565 1.00 0.00 C ATOM 583 O ASP A 39 8.468 15.295 -0.452 1.00 0.00 O ATOM 584 CB ASP A 39 8.606 12.912 1.199 1.00 0.00 C ATOM 585 CG ASP A 39 8.570 11.844 2.262 1.00 0.00 C ATOM 586 OD1 ASP A 39 7.541 11.701 2.933 1.00 0.00 O ATOM 587 OD2 ASP A 39 9.531 11.056 2.363 1.00 0.00 O1- ATOM 0 H ASP A 39 6.770 15.039 1.215 1.00 0.00 H new ATOM 0 HA ASP A 39 9.303 14.424 2.576 1.00 0.00 H new ATOM 0 HB2 ASP A 39 7.722 12.800 0.572 1.00 0.00 H new ATOM 0 HB3 ASP A 39 9.473 12.732 0.563 1.00 0.00 H new ATOM 592 N VAL A 40 10.281 15.775 0.722 1.00 0.00 N ATOM 593 CA VAL A 40 10.900 16.482 -0.347 1.00 0.00 C ATOM 594 C VAL A 40 12.383 16.287 -0.231 1.00 0.00 C ATOM 595 O VAL A 40 12.943 16.367 0.855 1.00 0.00 O ATOM 596 CB VAL A 40 10.532 18.008 -0.397 1.00 0.00 C ATOM 597 CG1 VAL A 40 11.057 18.773 0.809 1.00 0.00 C ATOM 598 CG2 VAL A 40 11.018 18.643 -1.698 1.00 0.00 C ATOM 0 H VAL A 40 10.804 15.788 1.598 1.00 0.00 H new ATOM 0 HA VAL A 40 10.524 16.075 -1.286 1.00 0.00 H new ATOM 0 HB VAL A 40 9.444 18.072 -0.364 1.00 0.00 H new ATOM 0 HG11 VAL A 40 10.775 19.823 0.725 1.00 0.00 H new ATOM 0 HG12 VAL A 40 10.629 18.354 1.720 1.00 0.00 H new ATOM 0 HG13 VAL A 40 12.143 18.691 0.847 1.00 0.00 H new ATOM 0 HG21 VAL A 40 10.751 19.700 -1.709 1.00 0.00 H new ATOM 0 HG22 VAL A 40 12.101 18.541 -1.770 1.00 0.00 H new ATOM 0 HG23 VAL A 40 10.549 18.142 -2.545 1.00 0.00 H new ATOM 608 N ILE A 41 12.982 15.925 -1.299 1.00 0.00 N ATOM 609 CA ILE A 41 14.398 15.747 -1.341 1.00 0.00 C ATOM 610 C ILE A 41 14.928 16.301 -2.616 1.00 0.00 C ATOM 611 O ILE A 41 14.439 15.986 -3.710 1.00 0.00 O ATOM 612 CB ILE A 41 14.908 14.275 -1.122 1.00 0.00 C ATOM 613 CG1 ILE A 41 14.157 13.222 -1.979 1.00 0.00 C ATOM 614 CG2 ILE A 41 14.913 13.892 0.353 1.00 0.00 C ATOM 615 CD1 ILE A 41 12.744 12.857 -1.507 1.00 0.00 C ATOM 0 H ILE A 41 12.508 15.740 -2.183 1.00 0.00 H new ATOM 0 HA ILE A 41 14.786 16.294 -0.482 1.00 0.00 H new ATOM 0 HB ILE A 41 15.939 14.268 -1.476 1.00 0.00 H new ATOM 0 HG12 ILE A 41 14.093 13.594 -3.002 1.00 0.00 H new ATOM 0 HG13 ILE A 41 14.756 12.312 -2.008 1.00 0.00 H new ATOM 0 HG21 ILE A 41 15.272 12.868 0.462 1.00 0.00 H new ATOM 0 HG22 ILE A 41 15.570 14.567 0.902 1.00 0.00 H new ATOM 0 HG23 ILE A 41 13.901 13.966 0.752 1.00 0.00 H new ATOM 0 HD11 ILE A 41 12.316 12.114 -2.180 1.00 0.00 H new ATOM 0 HD12 ILE A 41 12.792 12.448 -0.498 1.00 0.00 H new ATOM 0 HD13 ILE A 41 12.118 13.750 -1.507 1.00 0.00 H new ATOM 627 N LEU A 42 15.882 17.132 -2.487 1.00 0.00 N ATOM 628 CA LEU A 42 16.473 17.788 -3.600 1.00 0.00 C ATOM 629 C LEU A 42 17.791 17.106 -3.862 1.00 0.00 C ATOM 630 O LEU A 42 18.616 16.961 -2.953 1.00 0.00 O ATOM 631 CB LEU A 42 16.616 19.310 -3.268 1.00 0.00 C ATOM 632 CG LEU A 42 17.066 20.305 -4.374 1.00 0.00 C ATOM 633 CD1 LEU A 42 18.532 20.217 -4.667 1.00 0.00 C ATOM 634 CD2 LEU A 42 16.275 20.091 -5.632 1.00 0.00 C ATOM 0 H LEU A 42 16.290 17.388 -1.588 1.00 0.00 H new ATOM 0 HA LEU A 42 15.868 17.723 -4.504 1.00 0.00 H new ATOM 0 HB2 LEU A 42 15.651 19.653 -2.896 1.00 0.00 H new ATOM 0 HB3 LEU A 42 17.325 19.398 -2.445 1.00 0.00 H new ATOM 0 HG LEU A 42 16.872 21.307 -3.991 1.00 0.00 H new ATOM 0 HD11 LEU A 42 18.791 20.933 -5.447 1.00 0.00 H new ATOM 0 HD12 LEU A 42 19.098 20.444 -3.763 1.00 0.00 H new ATOM 0 HD13 LEU A 42 18.776 19.210 -5.005 1.00 0.00 H new ATOM 0 HD21 LEU A 42 16.605 20.797 -6.394 1.00 0.00 H new ATOM 0 HD22 LEU A 42 16.429 19.073 -5.990 1.00 0.00 H new ATOM 0 HD23 LEU A 42 15.216 20.247 -5.427 1.00 0.00 H new ATOM 646 N SER A 43 17.973 16.634 -5.073 1.00 0.00 N ATOM 647 CA SER A 43 19.183 15.969 -5.436 1.00 0.00 C ATOM 648 C SER A 43 20.264 17.026 -5.508 1.00 0.00 C ATOM 649 O SER A 43 20.254 17.896 -6.391 1.00 0.00 O ATOM 650 CB SER A 43 19.017 15.225 -6.780 1.00 0.00 C ATOM 651 OG SER A 43 20.137 14.395 -7.080 1.00 0.00 O ATOM 0 H SER A 43 17.286 16.704 -5.824 1.00 0.00 H new ATOM 0 HA SER A 43 19.450 15.211 -4.700 1.00 0.00 H new ATOM 0 HB2 SER A 43 18.114 14.615 -6.746 1.00 0.00 H new ATOM 0 HB3 SER A 43 18.881 15.952 -7.581 1.00 0.00 H new ATOM 0 HG SER A 43 19.989 13.943 -7.937 1.00 0.00 H new ATOM 657 N ARG A 44 21.127 17.007 -4.536 1.00 0.00 N ATOM 658 CA ARG A 44 22.153 17.979 -4.429 1.00 0.00 C ATOM 659 C ARG A 44 23.423 17.338 -3.929 1.00 0.00 C ATOM 660 O ARG A 44 23.387 16.244 -3.345 1.00 0.00 O ATOM 661 CB ARG A 44 21.681 19.158 -3.547 1.00 0.00 C ATOM 662 CG ARG A 44 21.269 18.804 -2.123 1.00 0.00 C ATOM 663 CD ARG A 44 20.452 19.936 -1.474 1.00 0.00 C ATOM 664 NE ARG A 44 21.099 21.256 -1.615 1.00 0.00 N ATOM 665 CZ ARG A 44 20.470 22.449 -1.548 1.00 0.00 C ATOM 666 NH1 ARG A 44 19.194 22.535 -1.194 1.00 0.00 N1+ ATOM 667 NH2 ARG A 44 21.159 23.552 -1.795 1.00 0.00 N ATOM 0 H ARG A 44 21.132 16.308 -3.794 1.00 0.00 H new ATOM 0 HA ARG A 44 22.375 18.393 -5.412 1.00 0.00 H new ATOM 0 HB2 ARG A 44 22.483 19.894 -3.500 1.00 0.00 H new ATOM 0 HB3 ARG A 44 20.836 19.639 -4.040 1.00 0.00 H new ATOM 0 HG2 ARG A 44 20.680 17.887 -2.131 1.00 0.00 H new ATOM 0 HG3 ARG A 44 22.158 18.606 -1.524 1.00 0.00 H new ATOM 0 HD2 ARG A 44 19.462 19.971 -1.928 1.00 0.00 H new ATOM 0 HD3 ARG A 44 20.310 19.716 -0.416 1.00 0.00 H new ATOM 0 HE ARG A 44 22.106 21.268 -1.777 1.00 0.00 H new ATOM 0 HH11 ARG A 44 18.670 21.690 -0.966 1.00 0.00 H new ATOM 0 HH12 ARG A 44 18.737 23.446 -1.150 1.00 0.00 H new ATOM 0 HH21 ARG A 44 22.149 23.492 -2.032 1.00 0.00 H new ATOM 0 HH22 ARG A 44 20.699 24.461 -1.749 1.00 0.00 H new ATOM 681 N ASP A 45 24.522 17.993 -4.209 1.00 0.00 N ATOM 682 CA ASP A 45 25.870 17.527 -3.879 1.00 0.00 C ATOM 683 C ASP A 45 26.046 17.252 -2.384 1.00 0.00 C ATOM 684 O ASP A 45 25.518 17.979 -1.547 1.00 0.00 O ATOM 685 CB ASP A 45 26.879 18.560 -4.333 1.00 0.00 C ATOM 686 CG ASP A 45 28.282 18.149 -4.042 1.00 0.00 C ATOM 687 OD1 ASP A 45 28.879 17.434 -4.857 1.00 0.00 O1- ATOM 688 OD2 ASP A 45 28.791 18.513 -2.990 1.00 0.00 O ATOM 0 H ASP A 45 24.516 18.894 -4.687 1.00 0.00 H new ATOM 0 HA ASP A 45 26.030 16.582 -4.399 1.00 0.00 H new ATOM 0 HB2 ASP A 45 26.767 18.727 -5.404 1.00 0.00 H new ATOM 0 HB3 ASP A 45 26.671 19.509 -3.839 1.00 0.00 H new ATOM 693 N GLU A 46 26.812 16.221 -2.072 1.00 0.00 N ATOM 694 CA GLU A 46 27.013 15.763 -0.702 1.00 0.00 C ATOM 695 C GLU A 46 28.061 16.604 0.080 1.00 0.00 C ATOM 696 O GLU A 46 28.048 16.629 1.318 1.00 0.00 O ATOM 697 CB GLU A 46 27.409 14.278 -0.724 1.00 0.00 C ATOM 698 CG GLU A 46 27.448 13.588 0.629 1.00 0.00 C ATOM 699 CD GLU A 46 27.882 12.147 0.522 1.00 0.00 C ATOM 700 OE1 GLU A 46 27.026 11.263 0.286 1.00 0.00 O1- ATOM 701 OE2 GLU A 46 29.095 11.867 0.667 1.00 0.00 O ATOM 0 H GLU A 46 27.318 15.671 -2.766 1.00 0.00 H new ATOM 0 HA GLU A 46 26.072 15.895 -0.168 1.00 0.00 H new ATOM 0 HB2 GLU A 46 26.708 13.743 -1.364 1.00 0.00 H new ATOM 0 HB3 GLU A 46 28.393 14.190 -1.185 1.00 0.00 H new ATOM 0 HG2 GLU A 46 28.131 14.123 1.288 1.00 0.00 H new ATOM 0 HG3 GLU A 46 26.460 13.635 1.087 1.00 0.00 H new ATOM 708 N ASN A 47 28.923 17.317 -0.626 1.00 0.00 N ATOM 709 CA ASN A 47 30.038 18.029 0.024 1.00 0.00 C ATOM 710 C ASN A 47 29.818 19.523 0.109 1.00 0.00 C ATOM 711 O ASN A 47 30.310 20.170 1.019 1.00 0.00 O ATOM 712 CB ASN A 47 31.379 17.763 -0.673 1.00 0.00 C ATOM 713 CG ASN A 47 31.855 16.334 -0.551 1.00 0.00 C ATOM 714 OD1 ASN A 47 32.531 15.969 0.416 1.00 0.00 O ATOM 715 ND2 ASN A 47 31.567 15.530 -1.543 1.00 0.00 N ATOM 0 H ASN A 47 28.883 17.425 -1.640 1.00 0.00 H new ATOM 0 HA ASN A 47 30.072 17.629 1.037 1.00 0.00 H new ATOM 0 HB2 ASN A 47 31.286 18.017 -1.729 1.00 0.00 H new ATOM 0 HB3 ASN A 47 32.135 18.426 -0.252 1.00 0.00 H new ATOM 0 HD21 ASN A 47 31.904 14.567 -1.533 1.00 0.00 H new ATOM 0 HD22 ASN A 47 31.006 15.866 -2.326 1.00 0.00 H new ATOM 722 N THR A 48 29.157 20.086 -0.856 1.00 0.00 N ATOM 723 CA THR A 48 28.893 21.504 -0.817 1.00 0.00 C ATOM 724 C THR A 48 27.401 21.809 -0.830 1.00 0.00 C ATOM 725 O THR A 48 26.992 22.963 -0.625 1.00 0.00 O ATOM 726 CB THR A 48 29.653 22.294 -1.938 1.00 0.00 C ATOM 727 OG1 THR A 48 29.292 23.689 -1.909 1.00 0.00 O ATOM 728 CG2 THR A 48 29.369 21.722 -3.311 1.00 0.00 C ATOM 0 H THR A 48 28.792 19.598 -1.674 1.00 0.00 H new ATOM 0 HA THR A 48 29.289 21.857 0.135 1.00 0.00 H new ATOM 0 HB THR A 48 30.720 22.194 -1.740 1.00 0.00 H new ATOM 0 HG1 THR A 48 28.366 23.781 -1.602 1.00 0.00 H new ATOM 0 HG21 THR A 48 29.912 22.294 -4.063 1.00 0.00 H new ATOM 0 HG22 THR A 48 29.690 20.681 -3.345 1.00 0.00 H new ATOM 0 HG23 THR A 48 28.300 21.778 -3.515 1.00 0.00 H new ATOM 736 N GLY A 49 26.594 20.792 -1.066 1.00 0.00 N ATOM 737 CA GLY A 49 25.161 20.963 -1.080 1.00 0.00 C ATOM 738 C GLY A 49 24.663 21.793 -2.245 1.00 0.00 C ATOM 739 O GLY A 49 23.659 22.485 -2.124 1.00 0.00 O ATOM 0 H GLY A 49 26.910 19.840 -1.250 1.00 0.00 H new ATOM 0 HA2 GLY A 49 24.686 19.982 -1.114 1.00 0.00 H new ATOM 0 HA3 GLY A 49 24.850 21.436 -0.148 1.00 0.00 H new ATOM 743 N GLU A 50 25.335 21.726 -3.372 1.00 0.00 N ATOM 744 CA GLU A 50 24.908 22.486 -4.529 1.00 0.00 C ATOM 745 C GLU A 50 23.863 21.695 -5.325 1.00 0.00 C ATOM 746 O GLU A 50 23.889 20.464 -5.317 1.00 0.00 O ATOM 747 CB GLU A 50 26.120 23.005 -5.345 1.00 0.00 C ATOM 748 CG GLU A 50 27.080 21.968 -5.928 1.00 0.00 C ATOM 749 CD GLU A 50 26.582 21.296 -7.175 1.00 0.00 C ATOM 750 OE1 GLU A 50 26.293 22.003 -8.154 1.00 0.00 O ATOM 751 OE2 GLU A 50 26.565 20.059 -7.228 1.00 0.00 O1- ATOM 0 H GLU A 50 26.171 21.160 -3.514 1.00 0.00 H new ATOM 0 HA GLU A 50 24.399 23.396 -4.211 1.00 0.00 H new ATOM 0 HB2 GLU A 50 25.737 23.608 -6.168 1.00 0.00 H new ATOM 0 HB3 GLU A 50 26.696 23.672 -4.703 1.00 0.00 H new ATOM 0 HG2 GLU A 50 28.031 22.453 -6.146 1.00 0.00 H new ATOM 0 HG3 GLU A 50 27.276 21.207 -5.173 1.00 0.00 H new ATOM 758 N SER A 51 22.935 22.388 -5.952 1.00 0.00 N ATOM 759 CA SER A 51 21.784 21.752 -6.576 1.00 0.00 C ATOM 760 C SER A 51 22.113 21.139 -7.941 1.00 0.00 C ATOM 761 O SER A 51 22.749 21.764 -8.799 1.00 0.00 O ATOM 762 CB SER A 51 20.613 22.750 -6.694 1.00 0.00 C ATOM 763 OG SER A 51 19.430 22.127 -7.202 1.00 0.00 O ATOM 0 H SER A 51 22.953 23.404 -6.045 1.00 0.00 H new ATOM 0 HA SER A 51 21.487 20.928 -5.927 1.00 0.00 H new ATOM 0 HB2 SER A 51 20.404 23.182 -5.715 1.00 0.00 H new ATOM 0 HB3 SER A 51 20.901 23.572 -7.350 1.00 0.00 H new ATOM 0 HG SER A 51 18.642 22.624 -6.897 1.00 0.00 H new ATOM 769 N GLN A 52 21.648 19.915 -8.125 1.00 0.00 N ATOM 770 CA GLN A 52 21.811 19.167 -9.368 1.00 0.00 C ATOM 771 C GLN A 52 20.675 19.523 -10.316 1.00 0.00 C ATOM 772 O GLN A 52 20.745 19.267 -11.517 1.00 0.00 O ATOM 773 CB GLN A 52 21.773 17.651 -9.086 1.00 0.00 C ATOM 774 CG GLN A 52 22.888 17.138 -8.179 1.00 0.00 C ATOM 775 CD GLN A 52 24.228 17.041 -8.868 1.00 0.00 C ATOM 776 OE1 GLN A 52 24.519 17.769 -9.802 1.00 0.00 O ATOM 777 NE2 GLN A 52 25.065 16.161 -8.388 1.00 0.00 N ATOM 0 H GLN A 52 21.138 19.402 -7.406 1.00 0.00 H new ATOM 0 HA GLN A 52 22.771 19.424 -9.815 1.00 0.00 H new ATOM 0 HB2 GLN A 52 20.813 17.405 -8.632 1.00 0.00 H new ATOM 0 HB3 GLN A 52 21.823 17.118 -10.036 1.00 0.00 H new ATOM 0 HG2 GLN A 52 22.978 17.800 -7.318 1.00 0.00 H new ATOM 0 HG3 GLN A 52 22.612 16.155 -7.798 1.00 0.00 H new ATOM 0 HE21 GLN A 52 24.788 15.568 -7.606 1.00 0.00 H new ATOM 0 HE22 GLN A 52 25.995 16.067 -8.796 1.00 0.00 H new ATOM 786 N GLY A 53 19.631 20.120 -9.769 1.00 0.00 N ATOM 787 CA GLY A 53 18.489 20.486 -10.566 1.00 0.00 C ATOM 788 C GLY A 53 17.518 19.332 -10.768 1.00 0.00 C ATOM 789 O GLY A 53 16.801 19.286 -11.774 1.00 0.00 O ATOM 0 H GLY A 53 19.557 20.358 -8.780 1.00 0.00 H new ATOM 0 HA2 GLY A 53 17.967 21.314 -10.087 1.00 0.00 H new ATOM 0 HA3 GLY A 53 18.829 20.843 -11.538 1.00 0.00 H new ATOM 793 N PHE A 54 17.495 18.401 -9.830 1.00 0.00 N ATOM 794 CA PHE A 54 16.575 17.265 -9.873 1.00 0.00 C ATOM 795 C PHE A 54 16.045 17.071 -8.474 1.00 0.00 C ATOM 796 O PHE A 54 16.764 17.344 -7.509 1.00 0.00 O ATOM 797 CB PHE A 54 17.278 15.962 -10.334 1.00 0.00 C ATOM 798 CG PHE A 54 18.047 16.083 -11.623 1.00 0.00 C ATOM 799 CD1 PHE A 54 17.387 16.222 -12.829 1.00 0.00 C ATOM 800 CD2 PHE A 54 19.432 16.071 -11.621 1.00 0.00 C ATOM 801 CE1 PHE A 54 18.089 16.347 -14.006 1.00 0.00 C ATOM 802 CE2 PHE A 54 20.143 16.196 -12.799 1.00 0.00 C ATOM 803 CZ PHE A 54 19.469 16.334 -13.994 1.00 0.00 C ATOM 0 H PHE A 54 18.110 18.406 -9.016 1.00 0.00 H new ATOM 0 HA PHE A 54 15.781 17.474 -10.590 1.00 0.00 H new ATOM 0 HB2 PHE A 54 17.961 15.636 -9.549 1.00 0.00 H new ATOM 0 HB3 PHE A 54 16.527 15.181 -10.447 1.00 0.00 H new ATOM 0 HD1 PHE A 54 16.307 16.233 -12.848 1.00 0.00 H new ATOM 0 HD2 PHE A 54 19.963 15.963 -10.687 1.00 0.00 H new ATOM 0 HE1 PHE A 54 17.559 16.455 -14.941 1.00 0.00 H new ATOM 0 HE2 PHE A 54 21.223 16.186 -12.784 1.00 0.00 H new ATOM 0 HZ PHE A 54 20.019 16.432 -14.918 1.00 0.00 H new ATOM 813 N ALA A 55 14.823 16.626 -8.337 1.00 0.00 N ATOM 814 CA ALA A 55 14.239 16.450 -7.025 1.00 0.00 C ATOM 815 C ALA A 55 13.233 15.324 -7.015 1.00 0.00 C ATOM 816 O ALA A 55 12.857 14.797 -8.067 1.00 0.00 O ATOM 817 CB ALA A 55 13.572 17.741 -6.570 1.00 0.00 C ATOM 0 H ALA A 55 14.211 16.378 -9.114 1.00 0.00 H new ATOM 0 HA ALA A 55 15.043 16.193 -6.335 1.00 0.00 H new ATOM 0 HB1 ALA A 55 13.136 17.597 -5.581 1.00 0.00 H new ATOM 0 HB2 ALA A 55 14.314 18.538 -6.526 1.00 0.00 H new ATOM 0 HB3 ALA A 55 12.788 18.014 -7.276 1.00 0.00 H new ATOM 823 N TYR A 56 12.831 14.948 -5.832 1.00 0.00 N ATOM 824 CA TYR A 56 11.801 13.967 -5.616 1.00 0.00 C ATOM 825 C TYR A 56 10.935 14.514 -4.509 1.00 0.00 C ATOM 826 O TYR A 56 11.449 15.173 -3.594 1.00 0.00 O ATOM 827 CB TYR A 56 12.370 12.618 -5.147 1.00 0.00 C ATOM 828 CG TYR A 56 13.443 12.002 -6.011 1.00 0.00 C ATOM 829 CD1 TYR A 56 14.785 12.284 -5.785 1.00 0.00 C ATOM 830 CD2 TYR A 56 13.122 11.115 -7.022 1.00 0.00 C ATOM 831 CE1 TYR A 56 15.771 11.700 -6.542 1.00 0.00 C ATOM 832 CE2 TYR A 56 14.104 10.528 -7.792 1.00 0.00 C ATOM 833 CZ TYR A 56 15.428 10.823 -7.545 1.00 0.00 C ATOM 834 OH TYR A 56 16.415 10.221 -8.291 1.00 0.00 O ATOM 0 H TYR A 56 13.221 15.325 -4.968 1.00 0.00 H new ATOM 0 HA TYR A 56 11.264 13.792 -6.548 1.00 0.00 H new ATOM 0 HB2 TYR A 56 12.774 12.749 -4.143 1.00 0.00 H new ATOM 0 HB3 TYR A 56 11.546 11.909 -5.069 1.00 0.00 H new ATOM 0 HD1 TYR A 56 15.057 12.974 -5.000 1.00 0.00 H new ATOM 0 HD2 TYR A 56 12.086 10.878 -7.212 1.00 0.00 H new ATOM 0 HE1 TYR A 56 16.809 11.928 -6.351 1.00 0.00 H new ATOM 0 HE2 TYR A 56 13.838 9.842 -8.583 1.00 0.00 H new ATOM 0 HH TYR A 56 16.007 9.630 -8.957 1.00 0.00 H new ATOM 844 N LEU A 57 9.669 14.280 -4.572 1.00 0.00 N ATOM 845 CA LEU A 57 8.776 14.767 -3.555 1.00 0.00 C ATOM 846 C LEU A 57 7.637 13.783 -3.422 1.00 0.00 C ATOM 847 O LEU A 57 7.410 12.991 -4.330 1.00 0.00 O ATOM 848 CB LEU A 57 8.276 16.189 -3.975 1.00 0.00 C ATOM 849 CG LEU A 57 7.465 17.034 -2.961 1.00 0.00 C ATOM 850 CD1 LEU A 57 7.599 18.495 -3.308 1.00 0.00 C ATOM 851 CD2 LEU A 57 5.992 16.677 -2.999 1.00 0.00 C ATOM 0 H LEU A 57 9.218 13.752 -5.319 1.00 0.00 H new ATOM 0 HA LEU A 57 9.269 14.855 -2.587 1.00 0.00 H new ATOM 0 HB2 LEU A 57 9.150 16.772 -4.263 1.00 0.00 H new ATOM 0 HB3 LEU A 57 7.663 16.071 -4.868 1.00 0.00 H new ATOM 0 HG LEU A 57 7.858 16.828 -1.965 1.00 0.00 H new ATOM 0 HD11 LEU A 57 7.029 19.092 -2.596 1.00 0.00 H new ATOM 0 HD12 LEU A 57 8.649 18.784 -3.266 1.00 0.00 H new ATOM 0 HD13 LEU A 57 7.216 18.667 -4.314 1.00 0.00 H new ATOM 0 HD21 LEU A 57 5.451 17.287 -2.276 1.00 0.00 H new ATOM 0 HD22 LEU A 57 5.598 16.863 -3.998 1.00 0.00 H new ATOM 0 HD23 LEU A 57 5.866 15.623 -2.750 1.00 0.00 H new ATOM 863 N LYS A 58 6.992 13.762 -2.287 1.00 0.00 N ATOM 864 CA LYS A 58 5.788 13.006 -2.145 1.00 0.00 C ATOM 865 C LYS A 58 4.879 13.671 -1.142 1.00 0.00 C ATOM 866 O LYS A 58 5.340 14.305 -0.172 1.00 0.00 O ATOM 867 CB LYS A 58 6.002 11.514 -1.800 1.00 0.00 C ATOM 868 CG LYS A 58 6.124 11.182 -0.341 1.00 0.00 C ATOM 869 CD LYS A 58 5.698 9.763 -0.107 1.00 0.00 C ATOM 870 CE LYS A 58 5.224 9.562 1.307 1.00 0.00 C ATOM 871 NZ LYS A 58 6.308 9.504 2.312 1.00 0.00 N1+ ATOM 0 H LYS A 58 7.285 14.263 -1.448 1.00 0.00 H new ATOM 0 HA LYS A 58 5.317 13.000 -3.128 1.00 0.00 H new ATOM 0 HB2 LYS A 58 5.169 10.944 -2.213 1.00 0.00 H new ATOM 0 HB3 LYS A 58 6.905 11.171 -2.306 1.00 0.00 H new ATOM 0 HG2 LYS A 58 7.154 11.322 -0.011 1.00 0.00 H new ATOM 0 HG3 LYS A 58 5.506 11.859 0.249 1.00 0.00 H new ATOM 0 HD2 LYS A 58 4.900 9.501 -0.801 1.00 0.00 H new ATOM 0 HD3 LYS A 58 6.532 9.092 -0.312 1.00 0.00 H new ATOM 0 HE2 LYS A 58 4.545 10.374 1.569 1.00 0.00 H new ATOM 0 HE3 LYS A 58 4.649 8.637 1.357 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 6.030 8.868 3.087 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 7.176 9.146 1.866 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 6.481 10.457 2.691 1.00 0.00 H new ATOM 885 N TYR A 59 3.623 13.631 -1.434 1.00 0.00 N ATOM 886 CA TYR A 59 2.601 14.064 -0.518 1.00 0.00 C ATOM 887 C TYR A 59 2.156 12.821 0.223 1.00 0.00 C ATOM 888 O TYR A 59 2.427 11.707 -0.243 1.00 0.00 O ATOM 889 CB TYR A 59 1.399 14.611 -1.287 1.00 0.00 C ATOM 890 CG TYR A 59 1.684 15.752 -2.242 1.00 0.00 C ATOM 891 CD1 TYR A 59 2.225 15.516 -3.503 1.00 0.00 C ATOM 892 CD2 TYR A 59 1.359 17.053 -1.907 1.00 0.00 C ATOM 893 CE1 TYR A 59 2.431 16.545 -4.392 1.00 0.00 C ATOM 894 CE2 TYR A 59 1.571 18.086 -2.788 1.00 0.00 C ATOM 895 CZ TYR A 59 2.105 17.826 -4.028 1.00 0.00 C ATOM 896 OH TYR A 59 2.278 18.846 -4.915 1.00 0.00 O ATOM 0 H TYR A 59 3.263 13.293 -2.327 1.00 0.00 H new ATOM 0 HA TYR A 59 2.978 14.843 0.145 1.00 0.00 H new ATOM 0 HB2 TYR A 59 0.952 13.793 -1.853 1.00 0.00 H new ATOM 0 HB3 TYR A 59 0.653 14.945 -0.566 1.00 0.00 H new ATOM 0 HD1 TYR A 59 2.487 14.508 -3.788 1.00 0.00 H new ATOM 0 HD2 TYR A 59 0.932 17.261 -0.937 1.00 0.00 H new ATOM 0 HE1 TYR A 59 2.846 16.346 -5.369 1.00 0.00 H new ATOM 0 HE2 TYR A 59 1.319 19.098 -2.508 1.00 0.00 H new ATOM 0 HH TYR A 59 2.090 19.700 -4.472 1.00 0.00 H new ATOM 906 N GLU A 60 1.481 12.952 1.342 1.00 0.00 N ATOM 907 CA GLU A 60 1.005 11.758 2.005 1.00 0.00 C ATOM 908 C GLU A 60 -0.435 11.513 1.618 1.00 0.00 C ATOM 909 O GLU A 60 -1.362 11.536 2.442 1.00 0.00 O ATOM 910 CB GLU A 60 1.240 11.756 3.522 1.00 0.00 C ATOM 911 CG GLU A 60 0.943 10.425 4.177 1.00 0.00 C ATOM 912 CD GLU A 60 1.572 10.292 5.530 1.00 0.00 C ATOM 913 OE1 GLU A 60 1.104 10.917 6.485 1.00 0.00 O ATOM 914 OE2 GLU A 60 2.557 9.520 5.655 1.00 0.00 O1- ATOM 0 H GLU A 60 1.255 13.836 1.799 1.00 0.00 H new ATOM 0 HA GLU A 60 1.604 10.916 1.657 1.00 0.00 H new ATOM 0 HB2 GLU A 60 2.277 12.027 3.721 1.00 0.00 H new ATOM 0 HB3 GLU A 60 0.616 12.524 3.979 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -0.136 10.303 4.269 1.00 0.00 H new ATOM 0 HG3 GLU A 60 1.301 9.621 3.534 1.00 0.00 H new ATOM 921 N ASP A 61 -0.595 11.391 0.333 1.00 0.00 N ATOM 922 CA ASP A 61 -1.832 11.120 -0.345 1.00 0.00 C ATOM 923 C ASP A 61 -1.459 10.989 -1.796 1.00 0.00 C ATOM 924 O ASP A 61 -0.753 11.848 -2.339 1.00 0.00 O ATOM 925 CB ASP A 61 -2.864 12.249 -0.184 1.00 0.00 C ATOM 926 CG ASP A 61 -4.240 11.831 -0.668 1.00 0.00 C ATOM 927 OD1 ASP A 61 -4.418 11.583 -1.863 1.00 0.00 O1- ATOM 928 OD2 ASP A 61 -5.163 11.682 0.182 1.00 0.00 O ATOM 0 H ASP A 61 0.188 11.484 -0.314 1.00 0.00 H new ATOM 0 HA ASP A 61 -2.300 10.227 0.070 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -2.921 12.542 0.864 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -2.534 13.125 -0.742 1.00 0.00 H new ATOM 933 N GLN A 62 -1.892 9.938 -2.409 1.00 0.00 N ATOM 934 CA GLN A 62 -1.508 9.627 -3.765 1.00 0.00 C ATOM 935 C GLN A 62 -2.188 10.558 -4.785 1.00 0.00 C ATOM 936 O GLN A 62 -1.654 10.790 -5.870 1.00 0.00 O ATOM 937 CB GLN A 62 -1.780 8.142 -4.022 1.00 0.00 C ATOM 938 CG GLN A 62 -1.607 7.649 -5.445 1.00 0.00 C ATOM 939 CD GLN A 62 -1.912 6.171 -5.550 1.00 0.00 C ATOM 940 OE1 GLN A 62 -2.700 5.631 -4.777 1.00 0.00 O ATOM 941 NE2 GLN A 62 -1.333 5.510 -6.493 1.00 0.00 N ATOM 0 H GLN A 62 -2.527 9.260 -1.989 1.00 0.00 H new ATOM 0 HA GLN A 62 -0.441 9.807 -3.896 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -1.120 7.560 -3.379 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -2.802 7.925 -3.710 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -2.266 8.208 -6.109 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -0.586 7.837 -5.777 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -0.683 5.982 -7.122 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -1.525 4.515 -6.611 1.00 0.00 H new ATOM 950 N ARG A 63 -3.309 11.156 -4.403 1.00 0.00 N ATOM 951 CA ARG A 63 -4.044 12.057 -5.290 1.00 0.00 C ATOM 952 C ARG A 63 -3.244 13.287 -5.662 1.00 0.00 C ATOM 953 O ARG A 63 -3.215 13.687 -6.824 1.00 0.00 O ATOM 954 CB ARG A 63 -5.359 12.499 -4.678 1.00 0.00 C ATOM 955 CG ARG A 63 -6.509 11.552 -4.871 1.00 0.00 C ATOM 956 CD ARG A 63 -7.763 12.171 -4.310 1.00 0.00 C ATOM 957 NE ARG A 63 -8.966 11.433 -4.671 1.00 0.00 N ATOM 958 CZ ARG A 63 -10.205 11.854 -4.418 1.00 0.00 C ATOM 959 NH1 ARG A 63 -10.408 12.936 -3.668 1.00 0.00 N1+ ATOM 960 NH2 ARG A 63 -11.234 11.183 -4.895 1.00 0.00 N ATOM 0 H ARG A 63 -3.732 11.035 -3.483 1.00 0.00 H new ATOM 0 HA ARG A 63 -4.238 11.480 -6.194 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -5.210 12.650 -3.609 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -5.631 13.466 -5.102 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -6.641 11.333 -5.931 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -6.303 10.605 -4.373 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -7.684 12.220 -3.224 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -7.849 13.196 -4.670 1.00 0.00 H new ATOM 0 HE ARG A 63 -8.853 10.538 -5.147 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -9.613 13.447 -3.284 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -11.358 13.254 -3.478 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -11.081 10.345 -5.456 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -12.184 11.502 -4.704 1.00 0.00 H new ATOM 974 N SER A 64 -2.545 13.841 -4.707 1.00 0.00 N ATOM 975 CA SER A 64 -1.840 15.084 -4.927 1.00 0.00 C ATOM 976 C SER A 64 -0.621 14.807 -5.764 1.00 0.00 C ATOM 977 O SER A 64 -0.220 15.603 -6.613 1.00 0.00 O ATOM 978 CB SER A 64 -1.456 15.699 -3.601 1.00 0.00 C ATOM 979 OG SER A 64 -2.593 15.910 -2.790 1.00 0.00 O ATOM 0 H SER A 64 -2.446 13.454 -3.768 1.00 0.00 H new ATOM 0 HA SER A 64 -2.481 15.792 -5.453 1.00 0.00 H new ATOM 0 HB2 SER A 64 -0.753 15.046 -3.084 1.00 0.00 H new ATOM 0 HB3 SER A 64 -0.945 16.647 -3.771 1.00 0.00 H new ATOM 0 HG SER A 64 -2.318 16.307 -1.937 1.00 0.00 H new ATOM 985 N THR A 65 -0.081 13.649 -5.529 1.00 0.00 N ATOM 986 CA THR A 65 1.004 13.111 -6.248 1.00 0.00 C ATOM 987 C THR A 65 0.645 12.998 -7.756 1.00 0.00 C ATOM 988 O THR A 65 1.367 13.515 -8.615 1.00 0.00 O ATOM 989 CB THR A 65 1.325 11.749 -5.597 1.00 0.00 C ATOM 990 OG1 THR A 65 2.119 11.920 -4.409 1.00 0.00 O ATOM 991 CG2 THR A 65 1.919 10.753 -6.537 1.00 0.00 C ATOM 0 H THR A 65 -0.413 13.032 -4.788 1.00 0.00 H new ATOM 0 HA THR A 65 1.887 13.749 -6.206 1.00 0.00 H new ATOM 0 HB THR A 65 0.367 11.318 -5.305 1.00 0.00 H new ATOM 0 HG1 THR A 65 2.880 11.303 -4.433 1.00 0.00 H new ATOM 0 HG21 THR A 65 2.116 9.823 -6.004 1.00 0.00 H new ATOM 0 HG22 THR A 65 1.223 10.563 -7.354 1.00 0.00 H new ATOM 0 HG23 THR A 65 2.853 11.145 -6.940 1.00 0.00 H new ATOM 999 N ILE A 66 -0.507 12.402 -8.044 1.00 0.00 N ATOM 1000 CA ILE A 66 -0.979 12.230 -9.415 1.00 0.00 C ATOM 1001 C ILE A 66 -1.278 13.596 -10.057 1.00 0.00 C ATOM 1002 O ILE A 66 -0.953 13.838 -11.231 1.00 0.00 O ATOM 1003 CB ILE A 66 -2.256 11.339 -9.446 1.00 0.00 C ATOM 1004 CG1 ILE A 66 -1.954 9.962 -8.841 1.00 0.00 C ATOM 1005 CG2 ILE A 66 -2.779 11.186 -10.871 1.00 0.00 C ATOM 1006 CD1 ILE A 66 -3.175 9.088 -8.658 1.00 0.00 C ATOM 0 H ILE A 66 -1.139 12.025 -7.337 1.00 0.00 H new ATOM 0 HA ILE A 66 -0.193 11.737 -9.986 1.00 0.00 H new ATOM 0 HB ILE A 66 -3.028 11.827 -8.851 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -1.242 9.443 -9.483 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -1.470 10.100 -7.874 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -3.671 10.560 -10.866 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -3.027 12.168 -11.275 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -2.013 10.721 -11.492 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -2.877 8.133 -8.226 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -3.881 9.584 -7.991 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -3.648 8.917 -9.625 1.00 0.00 H new ATOM 1018 N LEU A 67 -1.860 14.493 -9.274 1.00 0.00 N ATOM 1019 CA LEU A 67 -2.203 15.821 -9.752 1.00 0.00 C ATOM 1020 C LEU A 67 -0.941 16.602 -10.132 1.00 0.00 C ATOM 1021 O LEU A 67 -0.922 17.309 -11.141 1.00 0.00 O ATOM 1022 CB LEU A 67 -3.037 16.576 -8.705 1.00 0.00 C ATOM 1023 CG LEU A 67 -3.536 17.980 -9.095 1.00 0.00 C ATOM 1024 CD1 LEU A 67 -4.388 17.931 -10.359 1.00 0.00 C ATOM 1025 CD2 LEU A 67 -4.336 18.586 -7.953 1.00 0.00 C ATOM 0 H LEU A 67 -2.105 14.322 -8.299 1.00 0.00 H new ATOM 0 HA LEU A 67 -2.812 15.719 -10.650 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -3.904 15.964 -8.456 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -2.440 16.668 -7.797 1.00 0.00 H new ATOM 0 HG LEU A 67 -2.665 18.604 -9.296 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -4.726 18.937 -10.609 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -3.795 17.532 -11.182 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -5.253 17.289 -10.190 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -4.684 19.579 -8.239 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -5.194 17.950 -7.732 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -3.705 18.664 -7.068 1.00 0.00 H new ATOM 1037 N ALA A 68 0.113 16.448 -9.349 1.00 0.00 N ATOM 1038 CA ALA A 68 1.372 17.106 -9.633 1.00 0.00 C ATOM 1039 C ALA A 68 1.962 16.592 -10.947 1.00 0.00 C ATOM 1040 O ALA A 68 2.322 17.391 -11.822 1.00 0.00 O ATOM 1041 CB ALA A 68 2.352 16.914 -8.488 1.00 0.00 C ATOM 0 H ALA A 68 0.119 15.870 -8.509 1.00 0.00 H new ATOM 0 HA ALA A 68 1.183 18.174 -9.738 1.00 0.00 H new ATOM 0 HB1 ALA A 68 3.290 17.417 -8.724 1.00 0.00 H new ATOM 0 HB2 ALA A 68 1.933 17.338 -7.575 1.00 0.00 H new ATOM 0 HB3 ALA A 68 2.537 15.850 -8.342 1.00 0.00 H new ATOM 1047 N VAL A 69 1.985 15.260 -11.099 1.00 0.00 N ATOM 1048 CA VAL A 69 2.531 14.587 -12.293 1.00 0.00 C ATOM 1049 C VAL A 69 1.901 15.101 -13.581 1.00 0.00 C ATOM 1050 O VAL A 69 2.596 15.382 -14.555 1.00 0.00 O ATOM 1051 CB VAL A 69 2.346 13.036 -12.219 1.00 0.00 C ATOM 1052 CG1 VAL A 69 2.845 12.350 -13.492 1.00 0.00 C ATOM 1053 CG2 VAL A 69 3.075 12.469 -11.024 1.00 0.00 C ATOM 0 H VAL A 69 1.625 14.614 -10.396 1.00 0.00 H new ATOM 0 HA VAL A 69 3.596 14.821 -12.306 1.00 0.00 H new ATOM 0 HB VAL A 69 1.278 12.843 -12.117 1.00 0.00 H new ATOM 0 HG11 VAL A 69 2.701 11.273 -13.405 1.00 0.00 H new ATOM 0 HG12 VAL A 69 2.285 12.723 -14.350 1.00 0.00 H new ATOM 0 HG13 VAL A 69 3.905 12.564 -13.629 1.00 0.00 H new ATOM 0 HG21 VAL A 69 2.934 11.389 -10.991 1.00 0.00 H new ATOM 0 HG22 VAL A 69 4.138 12.694 -11.106 1.00 0.00 H new ATOM 0 HG23 VAL A 69 2.680 12.915 -10.111 1.00 0.00 H new ATOM 1063 N ASP A 70 0.604 15.235 -13.579 1.00 0.00 N ATOM 1064 CA ASP A 70 -0.102 15.646 -14.781 1.00 0.00 C ATOM 1065 C ASP A 70 -0.205 17.158 -14.943 1.00 0.00 C ATOM 1066 O ASP A 70 -0.029 17.678 -16.035 1.00 0.00 O ATOM 1067 CB ASP A 70 -1.513 15.032 -14.828 1.00 0.00 C ATOM 1068 CG ASP A 70 -2.329 15.527 -16.019 1.00 0.00 C ATOM 1069 OD1 ASP A 70 -3.019 16.564 -15.898 1.00 0.00 O ATOM 1070 OD2 ASP A 70 -2.294 14.895 -17.097 1.00 0.00 O1- ATOM 0 H ASP A 70 0.008 15.069 -12.768 1.00 0.00 H new ATOM 0 HA ASP A 70 0.497 15.273 -15.611 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -1.431 13.946 -14.874 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -2.041 15.273 -13.905 1.00 0.00 H new ATOM 1075 N ASN A 71 -0.424 17.871 -13.872 1.00 0.00 N ATOM 1076 CA ASN A 71 -0.828 19.279 -14.002 1.00 0.00 C ATOM 1077 C ASN A 71 0.322 20.232 -13.840 1.00 0.00 C ATOM 1078 O ASN A 71 0.429 21.222 -14.562 1.00 0.00 O ATOM 1079 CB ASN A 71 -1.952 19.619 -13.007 1.00 0.00 C ATOM 1080 CG ASN A 71 -2.515 21.032 -13.168 1.00 0.00 C ATOM 1081 OD1 ASN A 71 -3.453 21.254 -13.920 1.00 0.00 O ATOM 1082 ND2 ASN A 71 -1.964 21.983 -12.460 1.00 0.00 N ATOM 0 H ASN A 71 -0.338 17.529 -12.915 1.00 0.00 H new ATOM 0 HA ASN A 71 -1.202 19.402 -15.018 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -2.762 18.900 -13.129 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -1.573 19.503 -11.992 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -2.316 22.938 -12.527 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -1.182 21.770 -11.840 1.00 0.00 H new ATOM 1089 N LEU A 72 1.208 19.930 -12.933 1.00 0.00 N ATOM 1090 CA LEU A 72 2.295 20.832 -12.635 1.00 0.00 C ATOM 1091 C LEU A 72 3.425 20.604 -13.652 1.00 0.00 C ATOM 1092 O LEU A 72 4.314 21.426 -13.821 1.00 0.00 O ATOM 1093 CB LEU A 72 2.712 20.632 -11.143 1.00 0.00 C ATOM 1094 CG LEU A 72 3.649 21.669 -10.463 1.00 0.00 C ATOM 1095 CD1 LEU A 72 5.092 21.405 -10.766 1.00 0.00 C ATOM 1096 CD2 LEU A 72 3.282 23.093 -10.869 1.00 0.00 C ATOM 0 H LEU A 72 1.203 19.069 -12.386 1.00 0.00 H new ATOM 0 HA LEU A 72 2.006 21.878 -12.736 1.00 0.00 H new ATOM 0 HB2 LEU A 72 1.797 20.582 -10.552 1.00 0.00 H new ATOM 0 HB3 LEU A 72 3.194 19.657 -11.067 1.00 0.00 H new ATOM 0 HG LEU A 72 3.507 21.562 -9.388 1.00 0.00 H new ATOM 0 HD11 LEU A 72 5.711 22.153 -10.271 1.00 0.00 H new ATOM 0 HD12 LEU A 72 5.364 20.413 -10.405 1.00 0.00 H new ATOM 0 HD13 LEU A 72 5.253 21.456 -11.843 1.00 0.00 H new ATOM 0 HD21 LEU A 72 3.955 23.796 -10.378 1.00 0.00 H new ATOM 0 HD22 LEU A 72 3.374 23.198 -11.950 1.00 0.00 H new ATOM 0 HD23 LEU A 72 2.255 23.304 -10.570 1.00 0.00 H new ATOM 1108 N ASN A 73 3.332 19.500 -14.370 1.00 0.00 N ATOM 1109 CA ASN A 73 4.305 19.152 -15.396 1.00 0.00 C ATOM 1110 C ASN A 73 4.250 20.129 -16.542 1.00 0.00 C ATOM 1111 O ASN A 73 3.180 20.377 -17.119 1.00 0.00 O ATOM 1112 CB ASN A 73 4.089 17.716 -15.885 1.00 0.00 C ATOM 1113 CG ASN A 73 5.073 17.289 -16.961 1.00 0.00 C ATOM 1114 OD1 ASN A 73 6.185 16.896 -16.661 1.00 0.00 O ATOM 1115 ND2 ASN A 73 4.658 17.303 -18.203 1.00 0.00 N ATOM 0 H ASN A 73 2.581 18.818 -14.261 1.00 0.00 H new ATOM 0 HA ASN A 73 5.300 19.211 -14.955 1.00 0.00 H new ATOM 0 HB2 ASN A 73 4.171 17.036 -15.037 1.00 0.00 H new ATOM 0 HB3 ASN A 73 3.075 17.621 -16.273 1.00 0.00 H new ATOM 0 HD21 ASN A 73 5.273 16.979 -18.950 1.00 0.00 H new ATOM 0 HD22 ASN A 73 3.720 17.638 -18.424 1.00 0.00 H new ATOM 1122 N GLY A 74 5.383 20.696 -16.862 1.00 0.00 N ATOM 1123 CA GLY A 74 5.442 21.664 -17.915 1.00 0.00 C ATOM 1124 C GLY A 74 5.381 23.073 -17.382 1.00 0.00 C ATOM 1125 O GLY A 74 5.240 24.021 -18.147 1.00 0.00 O ATOM 0 H GLY A 74 6.275 20.502 -16.407 1.00 0.00 H new ATOM 0 HA2 GLY A 74 6.363 21.529 -18.482 1.00 0.00 H new ATOM 0 HA3 GLY A 74 4.615 21.500 -18.606 1.00 0.00 H new ATOM 1129 N PHE A 75 5.473 23.213 -16.070 1.00 0.00 N ATOM 1130 CA PHE A 75 5.457 24.522 -15.444 1.00 0.00 C ATOM 1131 C PHE A 75 6.824 25.176 -15.635 1.00 0.00 C ATOM 1132 O PHE A 75 7.868 24.543 -15.403 1.00 0.00 O ATOM 1133 CB PHE A 75 5.103 24.400 -13.959 1.00 0.00 C ATOM 1134 CG PHE A 75 4.786 25.696 -13.279 1.00 0.00 C ATOM 1135 CD1 PHE A 75 3.520 26.239 -13.376 1.00 0.00 C ATOM 1136 CD2 PHE A 75 5.740 26.365 -12.537 1.00 0.00 C ATOM 1137 CE1 PHE A 75 3.213 27.419 -12.753 1.00 0.00 C ATOM 1138 CE2 PHE A 75 5.440 27.555 -11.908 1.00 0.00 C ATOM 1139 CZ PHE A 75 4.172 28.083 -12.017 1.00 0.00 C ATOM 0 H PHE A 75 5.560 22.434 -15.418 1.00 0.00 H new ATOM 0 HA PHE A 75 4.695 25.147 -15.910 1.00 0.00 H new ATOM 0 HB2 PHE A 75 4.246 23.734 -13.858 1.00 0.00 H new ATOM 0 HB3 PHE A 75 5.937 23.928 -13.439 1.00 0.00 H new ATOM 0 HD1 PHE A 75 2.763 25.726 -13.950 1.00 0.00 H new ATOM 0 HD2 PHE A 75 6.733 25.951 -12.448 1.00 0.00 H new ATOM 0 HE1 PHE A 75 2.218 27.831 -12.838 1.00 0.00 H new ATOM 0 HE2 PHE A 75 6.195 28.070 -11.333 1.00 0.00 H new ATOM 0 HZ PHE A 75 3.930 29.015 -11.527 1.00 0.00 H new ATOM 1149 N LYS A 76 6.810 26.405 -16.075 1.00 0.00 N ATOM 1150 CA LYS A 76 8.014 27.129 -16.409 1.00 0.00 C ATOM 1151 C LYS A 76 8.621 27.790 -15.171 1.00 0.00 C ATOM 1152 O LYS A 76 7.963 28.610 -14.511 1.00 0.00 O ATOM 1153 CB LYS A 76 7.675 28.219 -17.426 1.00 0.00 C ATOM 1154 CG LYS A 76 8.879 28.879 -18.080 1.00 0.00 C ATOM 1155 CD LYS A 76 9.510 27.991 -19.148 1.00 0.00 C ATOM 1156 CE LYS A 76 8.579 27.801 -20.353 1.00 0.00 C ATOM 1157 NZ LYS A 76 8.217 29.091 -20.984 1.00 0.00 N1+ ATOM 0 H LYS A 76 5.954 26.941 -16.215 1.00 0.00 H new ATOM 0 HA LYS A 76 8.736 26.423 -16.821 1.00 0.00 H new ATOM 0 HB2 LYS A 76 7.048 27.786 -18.205 1.00 0.00 H new ATOM 0 HB3 LYS A 76 7.082 28.987 -16.930 1.00 0.00 H new ATOM 0 HG2 LYS A 76 8.574 29.824 -18.529 1.00 0.00 H new ATOM 0 HG3 LYS A 76 9.622 29.113 -17.318 1.00 0.00 H new ATOM 0 HD2 LYS A 76 10.449 28.433 -19.480 1.00 0.00 H new ATOM 0 HD3 LYS A 76 9.750 27.019 -18.717 1.00 0.00 H new ATOM 0 HE2 LYS A 76 9.065 27.161 -21.089 1.00 0.00 H new ATOM 0 HE3 LYS A 76 7.673 27.287 -20.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 7.823 28.916 -21.931 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 7.508 29.577 -20.399 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 9.065 29.687 -21.067 1.00 0.00 H new ATOM 1171 N ILE A 77 9.850 27.418 -14.852 1.00 0.00 N ATOM 1172 CA ILE A 77 10.601 28.046 -13.782 1.00 0.00 C ATOM 1173 C ILE A 77 12.034 28.279 -14.252 1.00 0.00 C ATOM 1174 O ILE A 77 12.803 27.332 -14.440 1.00 0.00 O ATOM 1175 CB ILE A 77 10.634 27.223 -12.455 1.00 0.00 C ATOM 1176 CG1 ILE A 77 9.216 26.903 -11.976 1.00 0.00 C ATOM 1177 CG2 ILE A 77 11.382 28.017 -11.372 1.00 0.00 C ATOM 1178 CD1 ILE A 77 9.160 26.077 -10.711 1.00 0.00 C ATOM 0 H ILE A 77 10.354 26.671 -15.330 1.00 0.00 H new ATOM 0 HA ILE A 77 10.089 28.981 -13.555 1.00 0.00 H new ATOM 0 HB ILE A 77 11.153 26.283 -12.644 1.00 0.00 H new ATOM 0 HG12 ILE A 77 8.681 27.838 -11.810 1.00 0.00 H new ATOM 0 HG13 ILE A 77 8.689 26.371 -12.768 1.00 0.00 H new ATOM 0 HG21 ILE A 77 11.403 27.440 -10.447 1.00 0.00 H new ATOM 0 HG22 ILE A 77 12.402 28.211 -11.702 1.00 0.00 H new ATOM 0 HG23 ILE A 77 10.871 28.964 -11.197 1.00 0.00 H new ATOM 0 HD11 ILE A 77 8.120 25.895 -10.441 1.00 0.00 H new ATOM 0 HD12 ILE A 77 9.664 25.125 -10.876 1.00 0.00 H new ATOM 0 HD13 ILE A 77 9.656 26.615 -9.903 1.00 0.00 H new ATOM 1190 N GLY A 78 12.365 29.522 -14.483 1.00 0.00 N ATOM 1191 CA GLY A 78 13.691 29.902 -14.889 1.00 0.00 C ATOM 1192 C GLY A 78 13.989 29.485 -16.299 1.00 0.00 C ATOM 1193 O GLY A 78 15.072 28.974 -16.591 1.00 0.00 O ATOM 0 H GLY A 78 11.717 30.304 -14.394 1.00 0.00 H new ATOM 0 HA2 GLY A 78 13.802 30.983 -14.800 1.00 0.00 H new ATOM 0 HA3 GLY A 78 14.420 29.450 -14.216 1.00 0.00 H new ATOM 1197 N GLY A 79 13.014 29.665 -17.169 1.00 0.00 N ATOM 1198 CA GLY A 79 13.201 29.369 -18.584 1.00 0.00 C ATOM 1199 C GLY A 79 13.035 27.903 -18.946 1.00 0.00 C ATOM 1200 O GLY A 79 12.952 27.555 -20.128 1.00 0.00 O ATOM 0 H GLY A 79 12.086 30.013 -16.926 1.00 0.00 H new ATOM 0 HA2 GLY A 79 12.488 29.956 -19.163 1.00 0.00 H new ATOM 0 HA3 GLY A 79 14.198 29.694 -18.882 1.00 0.00 H new ATOM 1204 N ARG A 80 12.988 27.047 -17.967 1.00 0.00 N ATOM 1205 CA ARG A 80 12.833 25.630 -18.213 1.00 0.00 C ATOM 1206 C ARG A 80 11.548 25.147 -17.605 1.00 0.00 C ATOM 1207 O ARG A 80 11.089 25.694 -16.603 1.00 0.00 O ATOM 1208 CB ARG A 80 14.031 24.827 -17.678 1.00 0.00 C ATOM 1209 CG ARG A 80 14.353 25.062 -16.211 1.00 0.00 C ATOM 1210 CD ARG A 80 15.554 24.247 -15.765 1.00 0.00 C ATOM 1211 NE ARG A 80 16.778 24.593 -16.499 1.00 0.00 N ATOM 1212 CZ ARG A 80 17.985 24.022 -16.323 1.00 0.00 C ATOM 1213 NH1 ARG A 80 18.194 23.145 -15.354 1.00 0.00 N1+ ATOM 1214 NH2 ARG A 80 18.987 24.365 -17.105 1.00 0.00 N ATOM 0 H ARG A 80 13.055 27.301 -16.981 1.00 0.00 H new ATOM 0 HA ARG A 80 12.798 25.471 -19.291 1.00 0.00 H new ATOM 0 HB2 ARG A 80 13.834 23.765 -17.826 1.00 0.00 H new ATOM 0 HB3 ARG A 80 14.911 25.074 -18.272 1.00 0.00 H new ATOM 0 HG2 ARG A 80 14.550 26.121 -16.046 1.00 0.00 H new ATOM 0 HG3 ARG A 80 13.488 24.800 -15.602 1.00 0.00 H new ATOM 0 HD2 ARG A 80 15.718 24.403 -14.699 1.00 0.00 H new ATOM 0 HD3 ARG A 80 15.340 23.187 -15.903 1.00 0.00 H new ATOM 0 HE ARG A 80 16.708 25.329 -17.202 1.00 0.00 H new ATOM 0 HH11 ARG A 80 17.433 22.890 -14.724 1.00 0.00 H new ATOM 0 HH12 ARG A 80 19.116 22.724 -15.237 1.00 0.00 H new ATOM 0 HH21 ARG A 80 18.847 25.059 -17.839 1.00 0.00 H new ATOM 0 HH22 ARG A 80 19.904 23.936 -16.977 1.00 0.00 H new ATOM 1228 N ALA A 81 10.951 24.167 -18.212 1.00 0.00 N ATOM 1229 CA ALA A 81 9.716 23.632 -17.717 1.00 0.00 C ATOM 1230 C ALA A 81 9.977 22.314 -17.049 1.00 0.00 C ATOM 1231 O ALA A 81 10.496 21.384 -17.674 1.00 0.00 O ATOM 1232 CB ALA A 81 8.707 23.483 -18.829 1.00 0.00 C ATOM 0 H ALA A 81 11.301 23.717 -19.058 1.00 0.00 H new ATOM 0 HA ALA A 81 9.296 24.324 -16.987 1.00 0.00 H new ATOM 0 HB1 ALA A 81 7.780 23.075 -18.427 1.00 0.00 H new ATOM 0 HB2 ALA A 81 8.511 24.458 -19.276 1.00 0.00 H new ATOM 0 HB3 ALA A 81 9.100 22.808 -19.589 1.00 0.00 H new ATOM 1238 N LEU A 82 9.641 22.228 -15.800 1.00 0.00 N ATOM 1239 CA LEU A 82 9.918 21.045 -15.030 1.00 0.00 C ATOM 1240 C LEU A 82 9.051 19.834 -15.380 1.00 0.00 C ATOM 1241 O LEU A 82 7.879 19.958 -15.775 1.00 0.00 O ATOM 1242 CB LEU A 82 10.000 21.332 -13.521 1.00 0.00 C ATOM 1243 CG LEU A 82 8.951 22.265 -12.922 1.00 0.00 C ATOM 1244 CD1 LEU A 82 7.567 21.705 -13.075 1.00 0.00 C ATOM 1245 CD2 LEU A 82 9.259 22.535 -11.463 1.00 0.00 C ATOM 0 H LEU A 82 9.169 22.969 -15.283 1.00 0.00 H new ATOM 0 HA LEU A 82 10.917 20.737 -15.337 1.00 0.00 H new ATOM 0 HB2 LEU A 82 9.943 20.380 -12.994 1.00 0.00 H new ATOM 0 HB3 LEU A 82 10.983 21.753 -13.312 1.00 0.00 H new ATOM 0 HG LEU A 82 8.988 23.207 -13.469 1.00 0.00 H new ATOM 0 HD11 LEU A 82 6.845 22.395 -12.638 1.00 0.00 H new ATOM 0 HD12 LEU A 82 7.344 21.569 -14.133 1.00 0.00 H new ATOM 0 HD13 LEU A 82 7.505 20.744 -12.565 1.00 0.00 H new ATOM 0 HD21 LEU A 82 8.503 23.202 -11.049 1.00 0.00 H new ATOM 0 HD22 LEU A 82 9.256 21.595 -10.911 1.00 0.00 H new ATOM 0 HD23 LEU A 82 10.240 23.002 -11.379 1.00 0.00 H new ATOM 1257 N LYS A 83 9.657 18.688 -15.243 1.00 0.00 N ATOM 1258 CA LYS A 83 9.063 17.413 -15.550 1.00 0.00 C ATOM 1259 C LYS A 83 8.790 16.641 -14.273 1.00 0.00 C ATOM 1260 O LYS A 83 9.685 16.489 -13.450 1.00 0.00 O ATOM 1261 CB LYS A 83 10.038 16.630 -16.469 1.00 0.00 C ATOM 1262 CG LYS A 83 9.788 15.119 -16.609 1.00 0.00 C ATOM 1263 CD LYS A 83 8.392 14.800 -17.094 1.00 0.00 C ATOM 1264 CE LYS A 83 8.144 13.311 -17.112 1.00 0.00 C ATOM 1265 NZ LYS A 83 6.709 12.988 -17.260 1.00 0.00 N1+ ATOM 0 H LYS A 83 10.615 18.611 -14.901 1.00 0.00 H new ATOM 0 HA LYS A 83 8.111 17.554 -16.062 1.00 0.00 H new ATOM 0 HB2 LYS A 83 10.001 17.075 -17.463 1.00 0.00 H new ATOM 0 HB3 LYS A 83 11.051 16.774 -16.093 1.00 0.00 H new ATOM 0 HG2 LYS A 83 10.515 14.698 -17.304 1.00 0.00 H new ATOM 0 HG3 LYS A 83 9.952 14.637 -15.645 1.00 0.00 H new ATOM 0 HD2 LYS A 83 7.661 15.285 -16.447 1.00 0.00 H new ATOM 0 HD3 LYS A 83 8.251 15.206 -18.096 1.00 0.00 H new ATOM 0 HE2 LYS A 83 8.703 12.861 -17.932 1.00 0.00 H new ATOM 0 HE3 LYS A 83 8.521 12.870 -16.189 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 6.575 11.960 -17.183 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 6.167 13.465 -16.512 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 6.374 13.312 -18.190 1.00 0.00 H new ATOM 1279 N ILE A 84 7.566 16.178 -14.112 1.00 0.00 N ATOM 1280 CA ILE A 84 7.208 15.341 -12.980 1.00 0.00 C ATOM 1281 C ILE A 84 6.751 13.993 -13.530 1.00 0.00 C ATOM 1282 O ILE A 84 6.086 13.946 -14.567 1.00 0.00 O ATOM 1283 CB ILE A 84 6.049 15.912 -12.070 1.00 0.00 C ATOM 1284 CG1 ILE A 84 6.295 17.334 -11.583 1.00 0.00 C ATOM 1285 CG2 ILE A 84 5.827 15.028 -10.863 1.00 0.00 C ATOM 1286 CD1 ILE A 84 5.910 18.381 -12.571 1.00 0.00 C ATOM 0 H ILE A 84 6.797 16.368 -14.755 1.00 0.00 H new ATOM 0 HA ILE A 84 8.092 15.280 -12.346 1.00 0.00 H new ATOM 0 HB ILE A 84 5.166 15.926 -12.709 1.00 0.00 H new ATOM 0 HG12 ILE A 84 5.736 17.494 -10.661 1.00 0.00 H new ATOM 0 HG13 ILE A 84 7.351 17.448 -11.340 1.00 0.00 H new ATOM 0 HG21 ILE A 84 5.025 15.441 -10.252 1.00 0.00 H new ATOM 0 HG22 ILE A 84 5.553 14.025 -11.192 1.00 0.00 H new ATOM 0 HG23 ILE A 84 6.743 14.979 -10.274 1.00 0.00 H new ATOM 0 HD11 ILE A 84 6.114 19.367 -12.154 1.00 0.00 H new ATOM 0 HD12 ILE A 84 6.487 18.248 -13.486 1.00 0.00 H new ATOM 0 HD13 ILE A 84 4.847 18.295 -12.797 1.00 0.00 H new ATOM 1298 N ASP A 85 7.143 12.924 -12.888 1.00 0.00 N ATOM 1299 CA ASP A 85 6.727 11.581 -13.272 1.00 0.00 C ATOM 1300 C ASP A 85 6.635 10.775 -11.990 1.00 0.00 C ATOM 1301 O ASP A 85 6.994 11.292 -10.939 1.00 0.00 O ATOM 1302 CB ASP A 85 7.765 10.948 -14.207 1.00 0.00 C ATOM 1303 CG ASP A 85 7.147 10.000 -15.208 1.00 0.00 C ATOM 1304 OD1 ASP A 85 6.735 10.459 -16.293 1.00 0.00 O ATOM 1305 OD2 ASP A 85 7.049 8.798 -14.943 1.00 0.00 O1- ATOM 0 H ASP A 85 7.763 12.950 -12.079 1.00 0.00 H new ATOM 0 HA ASP A 85 5.774 11.605 -13.800 1.00 0.00 H new ATOM 0 HB2 ASP A 85 8.297 11.736 -14.740 1.00 0.00 H new ATOM 0 HB3 ASP A 85 8.504 10.411 -13.612 1.00 0.00 H new ATOM 1310 N HIS A 86 6.192 9.548 -12.042 1.00 0.00 N ATOM 1311 CA HIS A 86 6.116 8.742 -10.817 1.00 0.00 C ATOM 1312 C HIS A 86 7.370 7.925 -10.687 1.00 0.00 C ATOM 1313 O HIS A 86 7.863 7.399 -11.670 1.00 0.00 O ATOM 1314 CB HIS A 86 4.913 7.785 -10.789 1.00 0.00 C ATOM 1315 CG HIS A 86 3.558 8.418 -10.674 1.00 0.00 C ATOM 1316 ND1 HIS A 86 2.858 8.517 -9.489 1.00 0.00 N ATOM 1317 CD2 HIS A 86 2.749 8.937 -11.625 1.00 0.00 C ATOM 1318 CE1 HIS A 86 1.679 9.073 -9.751 1.00 0.00 C ATOM 1319 NE2 HIS A 86 1.557 9.350 -11.036 1.00 0.00 N ATOM 0 H HIS A 86 5.880 9.077 -12.891 1.00 0.00 H new ATOM 0 HA HIS A 86 5.998 9.442 -9.990 1.00 0.00 H new ATOM 0 HB2 HIS A 86 4.933 7.185 -11.699 1.00 0.00 H new ATOM 0 HB3 HIS A 86 5.042 7.099 -9.951 1.00 0.00 H new ATOM 0 HD1 HIS A 86 3.188 8.216 -8.572 1.00 0.00 H new ATOM 0 HD2 HIS A 86 2.989 9.018 -12.675 1.00 0.00 H new ATOM 0 HE1 HIS A 86 0.920 9.272 -9.009 1.00 0.00 H new ATOM 1327 N THR A 87 7.898 7.824 -9.510 1.00 0.00 N ATOM 1328 CA THR A 87 9.060 7.022 -9.311 1.00 0.00 C ATOM 1329 C THR A 87 9.050 6.493 -7.890 1.00 0.00 C ATOM 1330 O THR A 87 8.339 7.011 -7.037 1.00 0.00 O ATOM 1331 CB THR A 87 10.369 7.832 -9.591 1.00 0.00 C ATOM 1332 OG1 THR A 87 11.511 6.956 -9.628 1.00 0.00 O ATOM 1333 CG2 THR A 87 10.600 8.898 -8.523 1.00 0.00 C ATOM 0 H THR A 87 7.543 8.287 -8.673 1.00 0.00 H new ATOM 0 HA THR A 87 9.043 6.190 -10.015 1.00 0.00 H new ATOM 0 HB THR A 87 10.247 8.318 -10.559 1.00 0.00 H new ATOM 0 HG1 THR A 87 12.320 7.480 -9.806 1.00 0.00 H new ATOM 0 HG21 THR A 87 11.517 9.443 -8.746 1.00 0.00 H new ATOM 0 HG22 THR A 87 9.759 9.591 -8.513 1.00 0.00 H new ATOM 0 HG23 THR A 87 10.689 8.422 -7.547 1.00 0.00 H new ATOM 1341 N PHE A 88 9.777 5.457 -7.640 1.00 0.00 N ATOM 1342 CA PHE A 88 9.926 4.992 -6.310 1.00 0.00 C ATOM 1343 C PHE A 88 11.330 4.520 -6.157 1.00 0.00 C ATOM 1344 O PHE A 88 11.687 3.427 -6.608 1.00 0.00 O ATOM 1345 CB PHE A 88 8.932 3.881 -5.959 1.00 0.00 C ATOM 1346 CG PHE A 88 8.866 3.583 -4.484 1.00 0.00 C ATOM 1347 CD1 PHE A 88 7.984 4.276 -3.671 1.00 0.00 C ATOM 1348 CD2 PHE A 88 9.685 2.626 -3.910 1.00 0.00 C ATOM 1349 CE1 PHE A 88 7.923 4.020 -2.316 1.00 0.00 C ATOM 1350 CE2 PHE A 88 9.626 2.367 -2.558 1.00 0.00 C ATOM 1351 CZ PHE A 88 8.746 3.063 -1.760 1.00 0.00 C ATOM 0 H PHE A 88 10.278 4.916 -8.345 1.00 0.00 H new ATOM 0 HA PHE A 88 9.711 5.806 -5.618 1.00 0.00 H new ATOM 0 HB2 PHE A 88 7.940 4.167 -6.309 1.00 0.00 H new ATOM 0 HB3 PHE A 88 9.210 2.973 -6.494 1.00 0.00 H new ATOM 0 HD1 PHE A 88 7.337 5.025 -4.102 1.00 0.00 H new ATOM 0 HD2 PHE A 88 10.378 2.076 -4.529 1.00 0.00 H new ATOM 0 HE1 PHE A 88 7.232 4.568 -1.692 1.00 0.00 H new ATOM 0 HE2 PHE A 88 10.271 1.617 -2.124 1.00 0.00 H new ATOM 0 HZ PHE A 88 8.700 2.860 -0.700 1.00 0.00 H new ATOM 1361 N TYR A 89 12.127 5.355 -5.589 1.00 0.00 N ATOM 1362 CA TYR A 89 13.488 5.046 -5.350 1.00 0.00 C ATOM 1363 C TYR A 89 13.593 4.737 -3.874 1.00 0.00 C ATOM 1364 O TYR A 89 12.691 5.094 -3.101 1.00 0.00 O ATOM 1365 CB TYR A 89 14.409 6.238 -5.747 1.00 0.00 C ATOM 1366 CG TYR A 89 14.522 7.342 -4.707 1.00 0.00 C ATOM 1367 CD1 TYR A 89 13.478 8.221 -4.453 1.00 0.00 C ATOM 1368 CD2 TYR A 89 15.686 7.472 -3.959 1.00 0.00 C ATOM 1369 CE1 TYR A 89 13.598 9.197 -3.484 1.00 0.00 C ATOM 1370 CE2 TYR A 89 15.807 8.435 -2.992 1.00 0.00 C ATOM 1371 CZ TYR A 89 14.767 9.293 -2.756 1.00 0.00 C ATOM 1372 OH TYR A 89 14.891 10.248 -1.779 1.00 0.00 O ATOM 0 H TYR A 89 11.846 6.284 -5.274 1.00 0.00 H new ATOM 0 HA TYR A 89 13.815 4.198 -5.952 1.00 0.00 H new ATOM 0 HB2 TYR A 89 15.407 5.852 -5.954 1.00 0.00 H new ATOM 0 HB3 TYR A 89 14.036 6.671 -6.675 1.00 0.00 H new ATOM 0 HD1 TYR A 89 12.562 8.140 -5.020 1.00 0.00 H new ATOM 0 HD2 TYR A 89 16.512 6.801 -4.144 1.00 0.00 H new ATOM 0 HE1 TYR A 89 12.783 9.881 -3.297 1.00 0.00 H new ATOM 0 HE2 TYR A 89 16.719 8.517 -2.419 1.00 0.00 H new ATOM 0 HH TYR A 89 14.199 10.112 -1.099 1.00 0.00 H new ATOM 1382 N ARG A 90 14.618 4.075 -3.486 1.00 0.00 N ATOM 1383 CA ARG A 90 14.799 3.756 -2.105 1.00 0.00 C ATOM 1384 C ARG A 90 15.572 4.880 -1.432 1.00 0.00 C ATOM 1385 O ARG A 90 16.708 5.166 -1.827 1.00 0.00 O ATOM 1386 CB ARG A 90 15.515 2.422 -1.960 1.00 0.00 C ATOM 1387 CG ARG A 90 14.744 1.246 -2.562 1.00 0.00 C ATOM 1388 CD ARG A 90 13.414 1.037 -1.851 1.00 0.00 C ATOM 1389 NE ARG A 90 13.598 0.795 -0.413 1.00 0.00 N ATOM 1390 CZ ARG A 90 12.717 1.115 0.548 1.00 0.00 C ATOM 1391 NH1 ARG A 90 11.559 1.713 0.239 1.00 0.00 N1+ ATOM 1392 NH2 ARG A 90 12.994 0.835 1.808 1.00 0.00 N ATOM 0 H ARG A 90 15.355 3.737 -4.105 1.00 0.00 H new ATOM 0 HA ARG A 90 13.829 3.659 -1.617 1.00 0.00 H new ATOM 0 HB2 ARG A 90 16.492 2.489 -2.439 1.00 0.00 H new ATOM 0 HB3 ARG A 90 15.692 2.227 -0.902 1.00 0.00 H new ATOM 0 HG2 ARG A 90 14.568 1.428 -3.622 1.00 0.00 H new ATOM 0 HG3 ARG A 90 15.344 0.339 -2.490 1.00 0.00 H new ATOM 0 HD2 ARG A 90 12.783 1.914 -1.995 1.00 0.00 H new ATOM 0 HD3 ARG A 90 12.891 0.192 -2.298 1.00 0.00 H new ATOM 0 HE ARG A 90 14.467 0.347 -0.121 1.00 0.00 H new ATOM 0 HH11 ARG A 90 11.340 1.929 -0.734 1.00 0.00 H new ATOM 0 HH12 ARG A 90 10.896 1.952 0.976 1.00 0.00 H new ATOM 0 HH21 ARG A 90 13.874 0.378 2.047 1.00 0.00 H new ATOM 0 HH22 ARG A 90 12.328 1.076 2.542 1.00 0.00 H new ATOM 1406 N PRO A 91 14.940 5.562 -0.441 1.00 0.00 N ATOM 1407 CA PRO A 91 15.552 6.683 0.300 1.00 0.00 C ATOM 1408 C PRO A 91 16.931 6.312 0.815 1.00 0.00 C ATOM 1409 O PRO A 91 17.136 5.191 1.313 1.00 0.00 O ATOM 1410 CB PRO A 91 14.602 6.894 1.478 1.00 0.00 C ATOM 1411 CG PRO A 91 13.290 6.372 1.021 1.00 0.00 C ATOM 1412 CD PRO A 91 13.577 5.273 0.037 1.00 0.00 C ATOM 0 HA PRO A 91 15.683 7.568 -0.322 1.00 0.00 H new ATOM 0 HB2 PRO A 91 14.950 6.363 2.364 1.00 0.00 H new ATOM 0 HB3 PRO A 91 14.534 7.949 1.745 1.00 0.00 H new ATOM 0 HG2 PRO A 91 12.710 5.995 1.863 1.00 0.00 H new ATOM 0 HG3 PRO A 91 12.700 7.162 0.556 1.00 0.00 H new ATOM 0 HD2 PRO A 91 13.520 4.292 0.508 1.00 0.00 H new ATOM 0 HD3 PRO A 91 12.859 5.275 -0.783 1.00 0.00 H new ATOM 1420 N LYS A 92 17.872 7.214 0.702 1.00 0.00 N ATOM 1421 CA LYS A 92 19.211 6.872 1.075 1.00 0.00 C ATOM 1422 C LYS A 92 19.397 7.024 2.577 1.00 0.00 C ATOM 1423 O LYS A 92 19.005 8.032 3.162 1.00 0.00 O ATOM 1424 CB LYS A 92 20.199 7.766 0.312 1.00 0.00 C ATOM 1425 CG LYS A 92 20.034 7.691 -1.210 1.00 0.00 C ATOM 1426 CD LYS A 92 20.991 8.614 -1.965 1.00 0.00 C ATOM 1427 CE LYS A 92 22.443 8.255 -1.702 1.00 0.00 C ATOM 1428 NZ LYS A 92 23.389 9.060 -2.510 1.00 0.00 N1+ ATOM 0 H LYS A 92 17.738 8.167 0.363 1.00 0.00 H new ATOM 0 HA LYS A 92 19.403 5.831 0.815 1.00 0.00 H new ATOM 0 HB2 LYS A 92 20.067 8.799 0.634 1.00 0.00 H new ATOM 0 HB3 LYS A 92 21.217 7.478 0.575 1.00 0.00 H new ATOM 0 HG2 LYS A 92 20.197 6.664 -1.537 1.00 0.00 H new ATOM 0 HG3 LYS A 92 19.008 7.950 -1.471 1.00 0.00 H new ATOM 0 HD2 LYS A 92 20.789 8.552 -3.034 1.00 0.00 H new ATOM 0 HD3 LYS A 92 20.812 9.647 -1.666 1.00 0.00 H new ATOM 0 HE2 LYS A 92 22.662 8.399 -0.644 1.00 0.00 H new ATOM 0 HE3 LYS A 92 22.596 7.198 -1.918 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 24.364 8.773 -2.290 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 23.202 8.904 -3.521 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 23.266 10.068 -2.286 1.00 0.00 H new ATOM 1442 N ARG A 93 20.041 6.047 3.186 1.00 0.00 N ATOM 1443 CA ARG A 93 20.307 6.097 4.619 1.00 0.00 C ATOM 1444 C ARG A 93 21.530 6.929 4.925 1.00 0.00 C ATOM 1445 O ARG A 93 21.666 7.483 5.995 1.00 0.00 O ATOM 1446 CB ARG A 93 20.348 4.683 5.275 1.00 0.00 C ATOM 1447 CG ARG A 93 21.359 3.684 4.694 1.00 0.00 C ATOM 1448 CD ARG A 93 22.800 4.017 5.031 1.00 0.00 C ATOM 1449 NE ARG A 93 23.085 3.900 6.459 1.00 0.00 N ATOM 1450 CZ ARG A 93 24.306 3.733 6.978 1.00 0.00 C ATOM 1451 NH1 ARG A 93 25.356 3.528 6.176 1.00 0.00 N1+ ATOM 1452 NH2 ARG A 93 24.465 3.733 8.290 1.00 0.00 N ATOM 0 H ARG A 93 20.390 5.211 2.718 1.00 0.00 H new ATOM 0 HA ARG A 93 19.461 6.602 5.084 1.00 0.00 H new ATOM 0 HB2 ARG A 93 20.563 4.806 6.337 1.00 0.00 H new ATOM 0 HB3 ARG A 93 19.353 4.244 5.200 1.00 0.00 H new ATOM 0 HG2 ARG A 93 21.128 2.686 5.068 1.00 0.00 H new ATOM 0 HG3 ARG A 93 21.245 3.653 3.610 1.00 0.00 H new ATOM 0 HD2 ARG A 93 23.462 3.352 4.477 1.00 0.00 H new ATOM 0 HD3 ARG A 93 23.021 5.033 4.702 1.00 0.00 H new ATOM 0 HE ARG A 93 22.298 3.949 7.105 1.00 0.00 H new ATOM 0 HH11 ARG A 93 25.227 3.499 5.165 1.00 0.00 H new ATOM 0 HH12 ARG A 93 26.286 3.401 6.576 1.00 0.00 H new ATOM 0 HH21 ARG A 93 23.659 3.860 8.901 1.00 0.00 H new ATOM 0 HH22 ARG A 93 25.394 3.606 8.691 1.00 0.00 H new ATOM 1466 N SER A 94 22.417 7.012 3.960 1.00 0.00 N ATOM 1467 CA SER A 94 23.655 7.741 4.097 1.00 0.00 C ATOM 1468 C SER A 94 23.372 9.242 4.176 1.00 0.00 C ATOM 1469 O SER A 94 24.158 10.018 4.701 1.00 0.00 O ATOM 1470 CB SER A 94 24.507 7.412 2.890 1.00 0.00 C ATOM 1471 OG SER A 94 24.446 6.011 2.644 1.00 0.00 O ATOM 0 H SER A 94 22.297 6.570 3.049 1.00 0.00 H new ATOM 0 HA SER A 94 24.177 7.459 5.011 1.00 0.00 H new ATOM 0 HB2 SER A 94 24.153 7.962 2.018 1.00 0.00 H new ATOM 0 HB3 SER A 94 25.539 7.719 3.063 1.00 0.00 H new ATOM 0 HG SER A 94 24.995 5.792 1.862 1.00 0.00 H new ATOM 1477 N LEU A 95 22.217 9.624 3.683 1.00 0.00 N ATOM 1478 CA LEU A 95 21.811 10.995 3.693 1.00 0.00 C ATOM 1479 C LEU A 95 20.662 11.199 4.665 1.00 0.00 C ATOM 1480 O LEU A 95 19.973 12.205 4.589 1.00 0.00 O ATOM 1481 CB LEU A 95 21.407 11.458 2.287 1.00 0.00 C ATOM 1482 CG LEU A 95 22.484 11.396 1.198 1.00 0.00 C ATOM 1483 CD1 LEU A 95 21.946 11.973 -0.101 1.00 0.00 C ATOM 1484 CD2 LEU A 95 23.746 12.131 1.632 1.00 0.00 C ATOM 0 H LEU A 95 21.538 8.987 3.266 1.00 0.00 H new ATOM 0 HA LEU A 95 22.659 11.597 4.019 1.00 0.00 H new ATOM 0 HB2 LEU A 95 20.561 10.853 1.961 1.00 0.00 H new ATOM 0 HB3 LEU A 95 21.055 12.487 2.357 1.00 0.00 H new ATOM 0 HG LEU A 95 22.748 10.351 1.035 1.00 0.00 H new ATOM 0 HD11 LEU A 95 22.719 11.924 -0.868 1.00 0.00 H new ATOM 0 HD12 LEU A 95 21.078 11.397 -0.423 1.00 0.00 H new ATOM 0 HD13 LEU A 95 21.655 13.012 0.055 1.00 0.00 H new ATOM 0 HD21 LEU A 95 24.493 12.071 0.840 1.00 0.00 H new ATOM 0 HD22 LEU A 95 23.509 13.177 1.828 1.00 0.00 H new ATOM 0 HD23 LEU A 95 24.141 11.672 2.539 1.00 0.00 H new ATOM 1496 N GLN A 96 20.495 10.268 5.620 1.00 0.00 N ATOM 1497 CA GLN A 96 19.359 10.304 6.572 1.00 0.00 C ATOM 1498 C GLN A 96 19.252 11.631 7.315 1.00 0.00 C ATOM 1499 O GLN A 96 18.156 12.110 7.552 1.00 0.00 O ATOM 1500 CB GLN A 96 19.394 9.148 7.581 1.00 0.00 C ATOM 1501 CG GLN A 96 20.642 9.107 8.440 1.00 0.00 C ATOM 1502 CD GLN A 96 20.552 8.098 9.547 1.00 0.00 C ATOM 1503 OE1 GLN A 96 20.925 6.943 9.380 1.00 0.00 O ATOM 1504 NE2 GLN A 96 20.061 8.518 10.680 1.00 0.00 N ATOM 0 H GLN A 96 21.128 9.480 5.757 1.00 0.00 H new ATOM 0 HA GLN A 96 18.471 10.189 5.951 1.00 0.00 H new ATOM 0 HB2 GLN A 96 18.522 9.222 8.231 1.00 0.00 H new ATOM 0 HB3 GLN A 96 19.309 8.206 7.039 1.00 0.00 H new ATOM 0 HG2 GLN A 96 21.502 8.875 7.812 1.00 0.00 H new ATOM 0 HG3 GLN A 96 20.816 10.094 8.868 1.00 0.00 H new ATOM 0 HE21 GLN A 96 19.762 9.488 10.778 1.00 0.00 H new ATOM 0 HE22 GLN A 96 19.976 7.876 11.468 1.00 0.00 H new ATOM 1513 N LYS A 97 20.403 12.245 7.632 1.00 0.00 N ATOM 1514 CA LYS A 97 20.424 13.537 8.332 1.00 0.00 C ATOM 1515 C LYS A 97 19.727 14.620 7.515 1.00 0.00 C ATOM 1516 O LYS A 97 19.124 15.527 8.063 1.00 0.00 O ATOM 1517 CB LYS A 97 21.853 13.969 8.696 1.00 0.00 C ATOM 1518 CG LYS A 97 22.566 13.042 9.683 1.00 0.00 C ATOM 1519 CD LYS A 97 21.845 12.957 11.032 1.00 0.00 C ATOM 1520 CE LYS A 97 21.814 14.298 11.767 1.00 0.00 C ATOM 1521 NZ LYS A 97 21.045 14.212 13.031 1.00 0.00 N1+ ATOM 0 H LYS A 97 21.326 11.869 7.416 1.00 0.00 H new ATOM 0 HA LYS A 97 19.873 13.402 9.263 1.00 0.00 H new ATOM 0 HB2 LYS A 97 22.444 14.029 7.782 1.00 0.00 H new ATOM 0 HB3 LYS A 97 21.818 14.972 9.120 1.00 0.00 H new ATOM 0 HG2 LYS A 97 22.640 12.044 9.251 1.00 0.00 H new ATOM 0 HG3 LYS A 97 23.584 13.398 9.840 1.00 0.00 H new ATOM 0 HD2 LYS A 97 20.824 12.610 10.873 1.00 0.00 H new ATOM 0 HD3 LYS A 97 22.340 12.215 11.658 1.00 0.00 H new ATOM 0 HE2 LYS A 97 22.833 14.619 11.982 1.00 0.00 H new ATOM 0 HE3 LYS A 97 21.371 15.057 11.122 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 21.398 14.925 13.701 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 20.038 14.387 12.837 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 21.159 13.264 13.443 1.00 0.00 H new ATOM 1535 N TYR A 98 19.786 14.487 6.212 1.00 0.00 N ATOM 1536 CA TYR A 98 19.133 15.409 5.323 1.00 0.00 C ATOM 1537 C TYR A 98 17.626 15.139 5.325 1.00 0.00 C ATOM 1538 O TYR A 98 16.840 16.060 5.429 1.00 0.00 O ATOM 1539 CB TYR A 98 19.752 15.310 3.909 1.00 0.00 C ATOM 1540 CG TYR A 98 19.030 16.082 2.825 1.00 0.00 C ATOM 1541 CD1 TYR A 98 18.921 17.466 2.871 1.00 0.00 C ATOM 1542 CD2 TYR A 98 18.466 15.417 1.746 1.00 0.00 C ATOM 1543 CE1 TYR A 98 18.260 18.159 1.874 1.00 0.00 C ATOM 1544 CE2 TYR A 98 17.811 16.103 0.749 1.00 0.00 C ATOM 1545 CZ TYR A 98 17.706 17.470 0.818 1.00 0.00 C ATOM 1546 OH TYR A 98 17.045 18.146 -0.173 1.00 0.00 O ATOM 0 H TYR A 98 20.289 13.735 5.741 1.00 0.00 H new ATOM 0 HA TYR A 98 19.284 16.433 5.665 1.00 0.00 H new ATOM 0 HB2 TYR A 98 20.782 15.663 3.957 1.00 0.00 H new ATOM 0 HB3 TYR A 98 19.788 14.260 3.620 1.00 0.00 H new ATOM 0 HD1 TYR A 98 19.358 18.008 3.697 1.00 0.00 H new ATOM 0 HD2 TYR A 98 18.542 14.341 1.687 1.00 0.00 H new ATOM 0 HE1 TYR A 98 18.178 19.235 1.923 1.00 0.00 H new ATOM 0 HE2 TYR A 98 17.381 15.568 -0.085 1.00 0.00 H new ATOM 0 HH TYR A 98 17.398 19.058 -0.238 1.00 0.00 H new ATOM 1556 N TYR A 99 17.255 13.866 5.286 1.00 0.00 N ATOM 1557 CA TYR A 99 15.844 13.456 5.292 1.00 0.00 C ATOM 1558 C TYR A 99 15.139 13.886 6.571 1.00 0.00 C ATOM 1559 O TYR A 99 14.055 14.488 6.516 1.00 0.00 O ATOM 1560 CB TYR A 99 15.706 11.943 5.126 1.00 0.00 C ATOM 1561 CG TYR A 99 16.036 11.412 3.743 1.00 0.00 C ATOM 1562 CD1 TYR A 99 17.342 11.214 3.343 1.00 0.00 C ATOM 1563 CD2 TYR A 99 15.026 11.092 2.843 1.00 0.00 C ATOM 1564 CE1 TYR A 99 17.641 10.717 2.094 1.00 0.00 C ATOM 1565 CE2 TYR A 99 15.322 10.581 1.594 1.00 0.00 C ATOM 1566 CZ TYR A 99 16.635 10.397 1.229 1.00 0.00 C ATOM 1567 OH TYR A 99 16.943 9.861 -0.005 1.00 0.00 O ATOM 0 H TYR A 99 17.914 13.088 5.249 1.00 0.00 H new ATOM 0 HA TYR A 99 15.371 13.954 4.446 1.00 0.00 H new ATOM 0 HB2 TYR A 99 16.357 11.453 5.851 1.00 0.00 H new ATOM 0 HB3 TYR A 99 14.683 11.658 5.373 1.00 0.00 H new ATOM 0 HD1 TYR A 99 18.146 11.454 4.023 1.00 0.00 H new ATOM 0 HD2 TYR A 99 13.995 11.245 3.124 1.00 0.00 H new ATOM 0 HE1 TYR A 99 18.671 10.581 1.799 1.00 0.00 H new ATOM 0 HE2 TYR A 99 14.527 10.328 0.908 1.00 0.00 H new ATOM 0 HH TYR A 99 16.210 10.038 -0.631 1.00 0.00 H new ATOM 1577 N GLU A 100 15.749 13.579 7.719 1.00 0.00 N ATOM 1578 CA GLU A 100 15.181 13.954 9.007 1.00 0.00 C ATOM 1579 C GLU A 100 15.048 15.474 9.126 1.00 0.00 C ATOM 1580 O GLU A 100 13.973 15.975 9.426 1.00 0.00 O ATOM 1581 CB GLU A 100 15.968 13.343 10.196 1.00 0.00 C ATOM 1582 CG GLU A 100 17.460 13.609 10.162 1.00 0.00 C ATOM 1583 CD GLU A 100 18.213 13.071 11.354 1.00 0.00 C ATOM 1584 OE1 GLU A 100 18.573 11.881 11.362 1.00 0.00 O1- ATOM 1585 OE2 GLU A 100 18.501 13.841 12.294 1.00 0.00 O ATOM 0 H GLU A 100 16.633 13.073 7.778 1.00 0.00 H new ATOM 0 HA GLU A 100 14.178 13.531 9.056 1.00 0.00 H new ATOM 0 HB2 GLU A 100 15.562 13.739 11.127 1.00 0.00 H new ATOM 0 HB3 GLU A 100 15.804 12.266 10.209 1.00 0.00 H new ATOM 0 HG2 GLU A 100 17.875 13.169 9.255 1.00 0.00 H new ATOM 0 HG3 GLU A 100 17.624 14.685 10.098 1.00 0.00 H new ATOM 1592 N ALA A 101 16.124 16.196 8.793 1.00 0.00 N ATOM 1593 CA ALA A 101 16.145 17.660 8.861 1.00 0.00 C ATOM 1594 C ALA A 101 15.050 18.273 7.985 1.00 0.00 C ATOM 1595 O ALA A 101 14.443 19.291 8.346 1.00 0.00 O ATOM 1596 CB ALA A 101 17.507 18.180 8.438 1.00 0.00 C ATOM 0 H ALA A 101 17.000 15.784 8.471 1.00 0.00 H new ATOM 0 HA ALA A 101 15.953 17.954 9.893 1.00 0.00 H new ATOM 0 HB1 ALA A 101 17.514 19.269 8.492 1.00 0.00 H new ATOM 0 HB2 ALA A 101 18.272 17.779 9.103 1.00 0.00 H new ATOM 0 HB3 ALA A 101 17.715 17.866 7.415 1.00 0.00 H new ATOM 1602 N VAL A 102 14.805 17.651 6.846 1.00 0.00 N ATOM 1603 CA VAL A 102 13.766 18.087 5.937 1.00 0.00 C ATOM 1604 C VAL A 102 12.378 17.829 6.513 1.00 0.00 C ATOM 1605 O VAL A 102 11.560 18.755 6.631 1.00 0.00 O ATOM 1606 CB VAL A 102 13.885 17.410 4.533 1.00 0.00 C ATOM 1607 CG1 VAL A 102 12.626 17.627 3.709 1.00 0.00 C ATOM 1608 CG2 VAL A 102 15.068 17.972 3.771 1.00 0.00 C ATOM 0 H VAL A 102 15.321 16.831 6.527 1.00 0.00 H new ATOM 0 HA VAL A 102 13.904 19.161 5.809 1.00 0.00 H new ATOM 0 HB VAL A 102 14.024 16.342 4.699 1.00 0.00 H new ATOM 0 HG11 VAL A 102 12.739 17.145 2.738 1.00 0.00 H new ATOM 0 HG12 VAL A 102 11.771 17.197 4.231 1.00 0.00 H new ATOM 0 HG13 VAL A 102 12.464 18.695 3.567 1.00 0.00 H new ATOM 0 HG21 VAL A 102 15.135 17.489 2.796 1.00 0.00 H new ATOM 0 HG22 VAL A 102 14.937 19.046 3.636 1.00 0.00 H new ATOM 0 HG23 VAL A 102 15.984 17.786 4.332 1.00 0.00 H new ATOM 1618 N LYS A 103 12.116 16.588 6.907 1.00 0.00 N ATOM 1619 CA LYS A 103 10.783 16.227 7.343 1.00 0.00 C ATOM 1620 C LYS A 103 10.390 16.920 8.622 1.00 0.00 C ATOM 1621 O LYS A 103 9.231 17.146 8.831 1.00 0.00 O ATOM 1622 CB LYS A 103 10.559 14.718 7.446 1.00 0.00 C ATOM 1623 CG LYS A 103 11.336 14.024 8.547 1.00 0.00 C ATOM 1624 CD LYS A 103 10.994 12.536 8.616 1.00 0.00 C ATOM 1625 CE LYS A 103 11.283 11.810 7.295 1.00 0.00 C ATOM 1626 NZ LYS A 103 10.934 10.374 7.351 1.00 0.00 N1+ ATOM 0 H LYS A 103 12.799 15.831 6.932 1.00 0.00 H new ATOM 0 HA LYS A 103 10.123 16.584 6.552 1.00 0.00 H new ATOM 0 HB2 LYS A 103 9.496 14.534 7.602 1.00 0.00 H new ATOM 0 HB3 LYS A 103 10.825 14.261 6.493 1.00 0.00 H new ATOM 0 HG2 LYS A 103 12.405 14.146 8.373 1.00 0.00 H new ATOM 0 HG3 LYS A 103 11.113 14.495 9.504 1.00 0.00 H new ATOM 0 HD2 LYS A 103 11.568 12.070 9.417 1.00 0.00 H new ATOM 0 HD3 LYS A 103 9.940 12.419 8.869 1.00 0.00 H new ATOM 0 HE2 LYS A 103 10.721 12.286 6.492 1.00 0.00 H new ATOM 0 HE3 LYS A 103 12.340 11.915 7.050 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 11.148 9.929 6.436 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 11.489 9.911 8.099 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 9.920 10.271 7.558 1.00 0.00 H new ATOM 1640 N GLU A 104 11.363 17.298 9.451 1.00 0.00 N ATOM 1641 CA GLU A 104 11.080 18.019 10.697 1.00 0.00 C ATOM 1642 C GLU A 104 10.270 19.314 10.437 1.00 0.00 C ATOM 1643 O GLU A 104 9.440 19.710 11.241 1.00 0.00 O ATOM 1644 CB GLU A 104 12.373 18.359 11.441 1.00 0.00 C ATOM 1645 CG GLU A 104 13.102 17.173 12.061 1.00 0.00 C ATOM 1646 CD GLU A 104 12.318 16.513 13.165 1.00 0.00 C ATOM 1647 OE1 GLU A 104 12.242 17.080 14.270 1.00 0.00 O1- ATOM 1648 OE2 GLU A 104 11.766 15.414 12.960 1.00 0.00 O ATOM 0 H GLU A 104 12.353 17.118 9.285 1.00 0.00 H new ATOM 0 HA GLU A 104 10.477 17.356 11.318 1.00 0.00 H new ATOM 0 HB2 GLU A 104 13.050 18.858 10.748 1.00 0.00 H new ATOM 0 HB3 GLU A 104 12.141 19.074 12.230 1.00 0.00 H new ATOM 0 HG2 GLU A 104 13.315 16.438 11.285 1.00 0.00 H new ATOM 0 HG3 GLU A 104 14.062 17.508 12.454 1.00 0.00 H new ATOM 1655 N GLU A 105 10.497 19.925 9.283 1.00 0.00 N ATOM 1656 CA GLU A 105 9.817 21.164 8.886 1.00 0.00 C ATOM 1657 C GLU A 105 8.405 20.891 8.400 1.00 0.00 C ATOM 1658 O GLU A 105 7.509 21.728 8.518 1.00 0.00 O ATOM 1659 CB GLU A 105 10.574 21.830 7.744 1.00 0.00 C ATOM 1660 CG GLU A 105 11.968 22.267 8.087 1.00 0.00 C ATOM 1661 CD GLU A 105 11.980 23.282 9.184 1.00 0.00 C ATOM 1662 OE1 GLU A 105 11.436 24.375 8.996 1.00 0.00 O1- ATOM 1663 OE2 GLU A 105 12.518 23.003 10.268 1.00 0.00 O ATOM 0 H GLU A 105 11.159 19.579 8.588 1.00 0.00 H new ATOM 0 HA GLU A 105 9.784 21.809 9.764 1.00 0.00 H new ATOM 0 HB2 GLU A 105 10.621 21.137 6.904 1.00 0.00 H new ATOM 0 HB3 GLU A 105 10.008 22.699 7.408 1.00 0.00 H new ATOM 0 HG2 GLU A 105 12.556 21.400 8.388 1.00 0.00 H new ATOM 0 HG3 GLU A 105 12.446 22.685 7.201 1.00 0.00 H new ATOM 1670 N LEU A 106 8.226 19.743 7.833 1.00 0.00 N ATOM 1671 CA LEU A 106 6.975 19.381 7.211 1.00 0.00 C ATOM 1672 C LEU A 106 6.068 18.701 8.218 1.00 0.00 C ATOM 1673 O LEU A 106 4.868 18.975 8.287 1.00 0.00 O ATOM 1674 CB LEU A 106 7.271 18.463 6.020 1.00 0.00 C ATOM 1675 CG LEU A 106 8.324 19.006 5.036 1.00 0.00 C ATOM 1676 CD1 LEU A 106 8.586 18.038 3.909 1.00 0.00 C ATOM 1677 CD2 LEU A 106 7.918 20.364 4.490 1.00 0.00 C ATOM 0 H LEU A 106 8.942 19.019 7.783 1.00 0.00 H new ATOM 0 HA LEU A 106 6.458 20.272 6.855 1.00 0.00 H new ATOM 0 HB2 LEU A 106 7.610 17.498 6.398 1.00 0.00 H new ATOM 0 HB3 LEU A 106 6.343 18.285 5.476 1.00 0.00 H new ATOM 0 HG LEU A 106 9.252 19.126 5.594 1.00 0.00 H new ATOM 0 HD11 LEU A 106 9.334 18.457 3.236 1.00 0.00 H new ATOM 0 HD12 LEU A 106 8.952 17.095 4.317 1.00 0.00 H new ATOM 0 HD13 LEU A 106 7.662 17.861 3.359 1.00 0.00 H new ATOM 0 HD21 LEU A 106 8.681 20.721 3.798 1.00 0.00 H new ATOM 0 HD22 LEU A 106 6.966 20.276 3.966 1.00 0.00 H new ATOM 0 HD23 LEU A 106 7.815 21.071 5.313 1.00 0.00 H new ATOM 1689 N ASP A 107 6.684 17.864 9.035 1.00 0.00 N ATOM 1690 CA ASP A 107 6.030 17.052 10.066 1.00 0.00 C ATOM 1691 C ASP A 107 5.189 17.888 11.002 1.00 0.00 C ATOM 1692 O ASP A 107 4.127 17.459 11.413 1.00 0.00 O ATOM 1693 CB ASP A 107 7.087 16.253 10.850 1.00 0.00 C ATOM 1694 CG ASP A 107 6.528 15.420 11.973 1.00 0.00 C ATOM 1695 OD1 ASP A 107 6.330 15.940 13.078 1.00 0.00 O1- ATOM 1696 OD2 ASP A 107 6.332 14.209 11.770 1.00 0.00 O ATOM 0 H ASP A 107 7.693 17.720 9.003 1.00 0.00 H new ATOM 0 HA ASP A 107 5.353 16.360 9.565 1.00 0.00 H new ATOM 0 HB2 ASP A 107 7.618 15.599 10.158 1.00 0.00 H new ATOM 0 HB3 ASP A 107 7.821 16.948 11.259 1.00 0.00 H new ATOM 1701 N ARG A 108 5.630 19.116 11.253 1.00 0.00 N ATOM 1702 CA ARG A 108 4.940 20.039 12.169 1.00 0.00 C ATOM 1703 C ARG A 108 3.491 20.274 11.736 1.00 0.00 C ATOM 1704 O ARG A 108 2.582 20.324 12.564 1.00 0.00 O ATOM 1705 CB ARG A 108 5.653 21.399 12.220 1.00 0.00 C ATOM 1706 CG ARG A 108 7.142 21.345 12.527 1.00 0.00 C ATOM 1707 CD ARG A 108 7.442 20.612 13.822 1.00 0.00 C ATOM 1708 NE ARG A 108 6.824 21.251 14.997 1.00 0.00 N ATOM 1709 CZ ARG A 108 6.643 20.666 16.193 1.00 0.00 C ATOM 1710 NH1 ARG A 108 6.990 19.387 16.383 1.00 0.00 N1+ ATOM 1711 NH2 ARG A 108 6.113 21.363 17.197 1.00 0.00 N ATOM 0 H ARG A 108 6.473 19.506 10.832 1.00 0.00 H new ATOM 0 HA ARG A 108 4.956 19.574 13.155 1.00 0.00 H new ATOM 0 HB2 ARG A 108 5.515 21.898 11.261 1.00 0.00 H new ATOM 0 HB3 ARG A 108 5.166 22.017 12.974 1.00 0.00 H new ATOM 0 HG2 ARG A 108 7.661 20.852 11.705 1.00 0.00 H new ATOM 0 HG3 ARG A 108 7.534 22.360 12.589 1.00 0.00 H new ATOM 0 HD2 ARG A 108 7.086 19.585 13.744 1.00 0.00 H new ATOM 0 HD3 ARG A 108 8.521 20.565 13.966 1.00 0.00 H new ATOM 0 HE ARG A 108 6.508 22.215 14.894 1.00 0.00 H new ATOM 0 HH11 ARG A 108 7.395 18.849 15.617 1.00 0.00 H new ATOM 0 HH12 ARG A 108 6.849 18.950 17.294 1.00 0.00 H new ATOM 0 HH21 ARG A 108 5.846 22.337 17.056 1.00 0.00 H new ATOM 0 HH22 ARG A 108 5.974 20.922 18.106 1.00 0.00 H new ATOM 1725 N ASP A 109 3.284 20.364 10.434 1.00 0.00 N ATOM 1726 CA ASP A 109 1.965 20.669 9.884 1.00 0.00 C ATOM 1727 C ASP A 109 1.165 19.383 9.714 1.00 0.00 C ATOM 1728 O ASP A 109 -0.056 19.389 9.639 1.00 0.00 O ATOM 1729 CB ASP A 109 2.111 21.385 8.530 1.00 0.00 C ATOM 1730 CG ASP A 109 0.829 22.052 8.055 1.00 0.00 C ATOM 1731 OD1 ASP A 109 -0.083 21.368 7.543 1.00 0.00 O1- ATOM 1732 OD2 ASP A 109 0.713 23.295 8.178 1.00 0.00 O ATOM 0 H ASP A 109 4.012 20.231 9.732 1.00 0.00 H new ATOM 0 HA ASP A 109 1.436 21.327 10.573 1.00 0.00 H new ATOM 0 HB2 ASP A 109 2.895 22.138 8.609 1.00 0.00 H new ATOM 0 HB3 ASP A 109 2.436 20.664 7.780 1.00 0.00 H new ATOM 1737 N ILE A 110 1.866 18.279 9.677 1.00 0.00 N ATOM 1738 CA ILE A 110 1.239 16.985 9.492 1.00 0.00 C ATOM 1739 C ILE A 110 0.727 16.464 10.829 1.00 0.00 C ATOM 1740 O ILE A 110 -0.429 16.049 10.950 1.00 0.00 O ATOM 1741 CB ILE A 110 2.238 15.942 8.921 1.00 0.00 C ATOM 1742 CG1 ILE A 110 2.912 16.471 7.651 1.00 0.00 C ATOM 1743 CG2 ILE A 110 1.512 14.625 8.622 1.00 0.00 C ATOM 1744 CD1 ILE A 110 4.013 15.572 7.125 1.00 0.00 C ATOM 0 H ILE A 110 2.881 18.245 9.773 1.00 0.00 H new ATOM 0 HA ILE A 110 0.420 17.119 8.786 1.00 0.00 H new ATOM 0 HB ILE A 110 3.010 15.762 9.669 1.00 0.00 H new ATOM 0 HG12 ILE A 110 2.157 16.597 6.875 1.00 0.00 H new ATOM 0 HG13 ILE A 110 3.327 17.458 7.855 1.00 0.00 H new ATOM 0 HG21 ILE A 110 2.222 13.901 8.222 1.00 0.00 H new ATOM 0 HG22 ILE A 110 1.074 14.234 9.540 1.00 0.00 H new ATOM 0 HG23 ILE A 110 0.724 14.802 7.891 1.00 0.00 H new ATOM 0 HD11 ILE A 110 4.443 16.012 6.225 1.00 0.00 H new ATOM 0 HD12 ILE A 110 4.789 15.465 7.883 1.00 0.00 H new ATOM 0 HD13 ILE A 110 3.600 14.591 6.888 1.00 0.00 H new ATOM 1756 N VAL A 111 1.580 16.526 11.832 1.00 0.00 N ATOM 1757 CA VAL A 111 1.287 15.956 13.134 1.00 0.00 C ATOM 1758 C VAL A 111 0.250 16.796 13.911 1.00 0.00 C ATOM 1759 O VAL A 111 -0.415 16.299 14.824 1.00 0.00 O ATOM 1760 CB VAL A 111 2.597 15.758 13.968 1.00 0.00 C ATOM 1761 CG1 VAL A 111 3.190 17.083 14.447 1.00 0.00 C ATOM 1762 CG2 VAL A 111 2.393 14.775 15.116 1.00 0.00 C ATOM 0 H VAL A 111 2.495 16.972 11.769 1.00 0.00 H new ATOM 0 HA VAL A 111 0.842 14.975 12.966 1.00 0.00 H new ATOM 0 HB VAL A 111 3.332 15.318 13.295 1.00 0.00 H new ATOM 0 HG11 VAL A 111 4.097 16.890 15.020 1.00 0.00 H new ATOM 0 HG12 VAL A 111 3.431 17.706 13.586 1.00 0.00 H new ATOM 0 HG13 VAL A 111 2.466 17.599 15.077 1.00 0.00 H new ATOM 0 HG21 VAL A 111 3.325 14.665 15.671 1.00 0.00 H new ATOM 0 HG22 VAL A 111 1.616 15.150 15.782 1.00 0.00 H new ATOM 0 HG23 VAL A 111 2.092 13.807 14.717 1.00 0.00 H new ATOM 1772 N SER A 112 0.088 18.043 13.539 1.00 0.00 N ATOM 1773 CA SER A 112 -0.855 18.893 14.202 1.00 0.00 C ATOM 1774 C SER A 112 -1.631 19.708 13.186 1.00 0.00 C ATOM 1775 O SER A 112 -1.123 20.026 12.111 1.00 0.00 O ATOM 1776 CB SER A 112 -0.142 19.822 15.203 1.00 0.00 C ATOM 1777 OG SER A 112 -1.075 20.672 15.864 1.00 0.00 O ATOM 0 H SER A 112 0.601 18.487 12.778 1.00 0.00 H new ATOM 0 HA SER A 112 -1.554 18.266 14.756 1.00 0.00 H new ATOM 0 HB2 SER A 112 0.396 19.225 15.939 1.00 0.00 H new ATOM 0 HB3 SER A 112 0.599 20.426 14.680 1.00 0.00 H new ATOM 0 HG SER A 112 -0.599 21.251 16.495 1.00 0.00 H new ATOM 1783 N LYS A 113 -2.864 20.032 13.517 1.00 0.00 N ATOM 1784 CA LYS A 113 -3.665 20.890 12.675 1.00 0.00 C ATOM 1785 C LYS A 113 -3.366 22.338 13.019 1.00 0.00 C ATOM 1786 O LYS A 113 -3.873 23.255 12.381 1.00 0.00 O ATOM 1787 CB LYS A 113 -5.168 20.611 12.834 1.00 0.00 C ATOM 1788 CG LYS A 113 -5.603 19.191 12.471 1.00 0.00 C ATOM 1789 CD LYS A 113 -5.389 18.816 10.985 1.00 0.00 C ATOM 1790 CE LYS A 113 -6.412 19.446 10.007 1.00 0.00 C ATOM 1791 NZ LYS A 113 -6.247 20.908 9.801 1.00 0.00 N1+ ATOM 0 H LYS A 113 -3.332 19.712 14.365 1.00 0.00 H new ATOM 0 HA LYS A 113 -3.407 20.687 11.636 1.00 0.00 H new ATOM 0 HB2 LYS A 113 -5.452 20.809 13.868 1.00 0.00 H new ATOM 0 HB3 LYS A 113 -5.721 21.315 12.212 1.00 0.00 H new ATOM 0 HG2 LYS A 113 -5.053 18.485 13.094 1.00 0.00 H new ATOM 0 HG3 LYS A 113 -6.659 19.075 12.714 1.00 0.00 H new ATOM 0 HD2 LYS A 113 -4.386 19.122 10.688 1.00 0.00 H new ATOM 0 HD3 LYS A 113 -5.434 17.731 10.888 1.00 0.00 H new ATOM 0 HE2 LYS A 113 -6.330 18.944 9.043 1.00 0.00 H new ATOM 0 HE3 LYS A 113 -7.418 19.256 10.381 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 -6.433 21.141 8.805 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 -6.917 21.422 10.408 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 -5.275 21.186 10.045 1.00 0.00 H new ATOM 1805 N ASN A 114 -2.562 22.538 14.037 1.00 0.00 N ATOM 1806 CA ASN A 114 -2.148 23.857 14.419 1.00 0.00 C ATOM 1807 C ASN A 114 -0.671 24.024 14.149 1.00 0.00 C ATOM 1808 O ASN A 114 0.186 23.632 14.955 1.00 0.00 O ATOM 1809 CB ASN A 114 -2.459 24.160 15.891 1.00 0.00 C ATOM 1810 CG ASN A 114 -2.030 25.570 16.294 1.00 0.00 C ATOM 1811 OD1 ASN A 114 -2.024 26.492 15.484 1.00 0.00 O ATOM 1812 ND2 ASN A 114 -1.667 25.750 17.532 1.00 0.00 N ATOM 0 H ASN A 114 -2.181 21.791 14.618 1.00 0.00 H new ATOM 0 HA ASN A 114 -2.715 24.570 13.820 1.00 0.00 H new ATOM 0 HB2 ASN A 114 -3.529 24.044 16.066 1.00 0.00 H new ATOM 0 HB3 ASN A 114 -1.952 23.433 16.525 1.00 0.00 H new ATOM 0 HD21 ASN A 114 -1.369 26.673 17.847 1.00 0.00 H new ATOM 0 HD22 ASN A 114 -1.681 24.968 18.186 1.00 0.00 H new ATOM 1819 N ASN A 115 -0.367 24.533 13.001 1.00 0.00 N ATOM 1820 CA ASN A 115 0.995 24.801 12.635 1.00 0.00 C ATOM 1821 C ASN A 115 1.239 26.282 12.720 1.00 0.00 C ATOM 1822 O ASN A 115 0.956 27.040 11.782 1.00 0.00 O ATOM 1823 CB ASN A 115 1.335 24.254 11.246 1.00 0.00 C ATOM 1824 CG ASN A 115 2.741 24.617 10.791 1.00 0.00 C ATOM 1825 OD1 ASN A 115 3.646 24.793 11.600 1.00 0.00 O ATOM 1826 ND2 ASN A 115 2.939 24.696 9.509 1.00 0.00 N ATOM 0 H ASN A 115 -1.052 24.777 12.286 1.00 0.00 H new ATOM 0 HA ASN A 115 1.655 24.285 13.332 1.00 0.00 H new ATOM 0 HB2 ASN A 115 1.230 23.169 11.253 1.00 0.00 H new ATOM 0 HB3 ASN A 115 0.615 24.639 10.524 1.00 0.00 H new ATOM 0 HD21 ASN A 115 3.869 24.910 9.149 1.00 0.00 H new ATOM 0 HD22 ASN A 115 2.164 24.544 8.863 1.00 0.00 H new ATOM 1833 N ALA A 116 1.682 26.703 13.867 1.00 0.00 N ATOM 1834 CA ALA A 116 1.937 28.080 14.118 1.00 0.00 C ATOM 1835 C ALA A 116 3.387 28.391 13.824 1.00 0.00 C ATOM 1836 O ALA A 116 4.291 28.007 14.581 1.00 0.00 O ATOM 1837 CB ALA A 116 1.582 28.426 15.553 1.00 0.00 C ATOM 0 H ALA A 116 1.877 26.090 14.659 1.00 0.00 H new ATOM 0 HA ALA A 116 1.314 28.689 13.463 1.00 0.00 H new ATOM 0 HB1 ALA A 116 1.782 29.482 15.733 1.00 0.00 H new ATOM 0 HB2 ALA A 116 0.525 28.222 15.726 1.00 0.00 H new ATOM 0 HB3 ALA A 116 2.184 27.822 16.232 1.00 0.00 H new ATOM 1843 N GLU A 117 3.612 29.033 12.728 1.00 0.00 N ATOM 1844 CA GLU A 117 4.932 29.405 12.311 1.00 0.00 C ATOM 1845 C GLU A 117 4.867 30.731 11.600 1.00 0.00 C ATOM 1846 O GLU A 117 3.770 31.220 11.271 1.00 0.00 O ATOM 1847 CB GLU A 117 5.532 28.355 11.377 1.00 0.00 C ATOM 1848 CG GLU A 117 4.704 28.103 10.136 1.00 0.00 C ATOM 1849 CD GLU A 117 5.434 27.288 9.128 1.00 0.00 C ATOM 1850 OE1 GLU A 117 5.374 26.046 9.187 1.00 0.00 O ATOM 1851 OE2 GLU A 117 6.093 27.882 8.243 1.00 0.00 O1- ATOM 0 H GLU A 117 2.876 29.321 12.083 1.00 0.00 H new ATOM 0 HA GLU A 117 5.568 29.479 13.193 1.00 0.00 H new ATOM 0 HB2 GLU A 117 6.530 28.675 11.079 1.00 0.00 H new ATOM 0 HB3 GLU A 117 5.647 27.419 11.923 1.00 0.00 H new ATOM 0 HG2 GLU A 117 3.782 27.593 10.414 1.00 0.00 H new ATOM 0 HG3 GLU A 117 4.419 29.057 9.692 1.00 0.00 H new ATOM 1858 N LYS A 118 5.998 31.307 11.367 1.00 0.00 N ATOM 1859 CA LYS A 118 6.076 32.551 10.674 1.00 0.00 C ATOM 1860 C LYS A 118 6.385 32.264 9.220 1.00 0.00 C ATOM 1861 O LYS A 118 5.468 32.343 8.384 1.00 0.00 O ATOM 1862 CB LYS A 118 7.139 33.443 11.310 1.00 0.00 C ATOM 1863 CG LYS A 118 7.169 34.870 10.774 1.00 0.00 C ATOM 1864 CD LYS A 118 8.179 35.732 11.525 1.00 0.00 C ATOM 1865 CE LYS A 118 7.814 35.891 13.000 1.00 0.00 C ATOM 1866 NZ LYS A 118 8.824 36.667 13.739 1.00 0.00 N1+ ATOM 1867 OXT LYS A 118 7.527 31.870 8.914 1.00 0.00 O1- ATOM 0 H LYS A 118 6.900 30.927 11.653 1.00 0.00 H new ATOM 0 HA LYS A 118 5.129 33.086 10.739 1.00 0.00 H new ATOM 0 HB2 LYS A 118 6.971 33.476 12.386 1.00 0.00 H new ATOM 0 HB3 LYS A 118 8.117 32.989 11.154 1.00 0.00 H new ATOM 0 HG2 LYS A 118 7.420 34.855 9.713 1.00 0.00 H new ATOM 0 HG3 LYS A 118 6.177 35.313 10.861 1.00 0.00 H new ATOM 0 HD2 LYS A 118 9.169 35.284 11.443 1.00 0.00 H new ATOM 0 HD3 LYS A 118 8.234 36.715 11.058 1.00 0.00 H new ATOM 0 HE2 LYS A 118 6.846 36.385 13.082 1.00 0.00 H new ATOM 0 HE3 LYS A 118 7.709 34.906 13.455 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 8.537 36.751 14.735 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 9.743 36.183 13.683 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 8.906 37.616 13.322 1.00 0.00 H new TER 1881 LYS A 118 ATOM 1882 N GLY B 200 23.310 12.066 17.359 1.00 0.00 N ATOM 1883 CA GLY B 200 24.299 13.113 17.578 1.00 0.00 C ATOM 1884 C GLY B 200 25.542 12.843 16.782 1.00 0.00 C ATOM 1885 O GLY B 200 25.884 11.682 16.551 1.00 0.00 O ATOM 0 HA2 GLY B 200 23.882 14.079 17.294 1.00 0.00 H new ATOM 0 HA3 GLY B 200 24.546 13.171 18.638 1.00 0.00 H new ATOM 1891 N SER B 201 26.211 13.889 16.344 1.00 0.00 N ATOM 1892 CA SER B 201 27.414 13.756 15.546 1.00 0.00 C ATOM 1893 C SER B 201 28.139 15.084 15.420 1.00 0.00 C ATOM 1894 O SER B 201 27.757 15.940 14.630 1.00 0.00 O ATOM 1895 CB SER B 201 27.090 13.144 14.167 1.00 0.00 C ATOM 1896 OG SER B 201 25.885 13.695 13.624 1.00 0.00 O ATOM 0 H SER B 201 25.938 14.854 16.530 1.00 0.00 H new ATOM 0 HA SER B 201 28.090 13.071 16.058 1.00 0.00 H new ATOM 0 HB2 SER B 201 27.918 13.328 13.482 1.00 0.00 H new ATOM 0 HB3 SER B 201 26.988 12.063 14.261 1.00 0.00 H new ATOM 0 HG SER B 201 25.448 13.028 13.055 1.00 0.00 H new ATOM 1902 N LYS B 202 29.155 15.270 16.227 1.00 0.00 N ATOM 1903 CA LYS B 202 29.919 16.503 16.203 1.00 0.00 C ATOM 1904 C LYS B 202 31.262 16.321 15.520 1.00 0.00 C ATOM 1905 O LYS B 202 32.173 17.121 15.667 1.00 0.00 O ATOM 1906 CB LYS B 202 30.034 17.123 17.602 1.00 0.00 C ATOM 1907 CG LYS B 202 28.688 17.587 18.171 1.00 0.00 C ATOM 1908 CD LYS B 202 28.013 18.600 17.234 1.00 0.00 C ATOM 1909 CE LYS B 202 26.667 19.078 17.762 1.00 0.00 C ATOM 1910 NZ LYS B 202 26.777 19.810 19.039 1.00 0.00 N1+ ATOM 0 H LYS B 202 29.476 14.585 16.911 1.00 0.00 H new ATOM 0 HA LYS B 202 29.369 17.222 15.596 1.00 0.00 H new ATOM 0 HB2 LYS B 202 30.475 16.393 18.280 1.00 0.00 H new ATOM 0 HB3 LYS B 202 30.716 17.973 17.561 1.00 0.00 H new ATOM 0 HG2 LYS B 202 28.034 16.727 18.314 1.00 0.00 H new ATOM 0 HG3 LYS B 202 28.840 18.038 19.151 1.00 0.00 H new ATOM 0 HD2 LYS B 202 28.671 19.458 17.097 1.00 0.00 H new ATOM 0 HD3 LYS B 202 27.874 18.146 16.253 1.00 0.00 H new ATOM 0 HE2 LYS B 202 26.199 19.723 17.018 1.00 0.00 H new ATOM 0 HE3 LYS B 202 26.010 18.219 17.897 1.00 0.00 H new ATOM 0 HZ1 LYS B 202 25.851 20.212 19.289 1.00 0.00 H new ATOM 0 HZ2 LYS B 202 27.085 19.157 19.788 1.00 0.00 H new ATOM 0 HZ3 LYS B 202 27.472 20.577 18.941 1.00 0.00 H new ATOM 1924 N SER B 203 31.357 15.282 14.736 1.00 0.00 N ATOM 1925 CA SER B 203 32.494 15.049 13.876 1.00 0.00 C ATOM 1926 C SER B 203 32.120 15.518 12.459 1.00 0.00 C ATOM 1927 O SER B 203 32.853 15.309 11.489 1.00 0.00 O ATOM 1928 CB SER B 203 32.792 13.558 13.897 1.00 0.00 C ATOM 1929 OG SER B 203 31.576 12.822 13.733 1.00 0.00 O ATOM 0 H SER B 203 30.638 14.561 14.673 1.00 0.00 H new ATOM 0 HA SER B 203 33.378 15.594 14.206 1.00 0.00 H new ATOM 0 HB2 SER B 203 33.492 13.306 13.100 1.00 0.00 H new ATOM 0 HB3 SER B 203 33.269 13.286 14.838 1.00 0.00 H new ATOM 0 HG SER B 203 31.771 11.862 13.745 1.00 0.00 H new ATOM 1935 N GLN B 204 30.969 16.200 12.413 1.00 0.00 N ATOM 1936 CA GLN B 204 30.277 16.670 11.229 1.00 0.00 C ATOM 1937 C GLN B 204 29.620 15.498 10.536 1.00 0.00 C ATOM 1938 O GLN B 204 30.245 14.459 10.265 1.00 0.00 O ATOM 1939 CB GLN B 204 31.164 17.489 10.278 1.00 0.00 C ATOM 1940 CG GLN B 204 30.413 18.591 9.520 1.00 0.00 C ATOM 1941 CD GLN B 204 29.404 18.130 8.497 1.00 0.00 C ATOM 1942 OE1 GLN B 204 28.230 17.953 8.811 1.00 0.00 O ATOM 1943 NE2 GLN B 204 29.837 17.954 7.285 1.00 0.00 N ATOM 0 H GLN B 204 30.470 16.450 13.267 1.00 0.00 H new ATOM 0 HA GLN B 204 29.509 17.372 11.552 1.00 0.00 H new ATOM 0 HB2 GLN B 204 31.972 17.943 10.852 1.00 0.00 H new ATOM 0 HB3 GLN B 204 31.625 16.815 9.556 1.00 0.00 H new ATOM 0 HG2 GLN B 204 29.899 19.218 10.249 1.00 0.00 H new ATOM 0 HG3 GLN B 204 31.146 19.221 9.017 1.00 0.00 H new ATOM 0 HE21 GLN B 204 30.821 18.112 7.067 1.00 0.00 H new ATOM 0 HE22 GLN B 204 29.193 17.658 6.551 1.00 0.00 H new ATOM 1952 N TYR B 205 28.377 15.660 10.275 1.00 0.00 N ATOM 1953 CA TYR B 205 27.583 14.642 9.699 1.00 0.00 C ATOM 1954 C TYR B 205 27.622 14.669 8.174 1.00 0.00 C ATOM 1955 O TYR B 205 28.396 13.948 7.571 1.00 0.00 O ATOM 1956 CB TYR B 205 26.157 14.621 10.296 1.00 0.00 C ATOM 1957 CG TYR B 205 25.605 16.005 10.647 1.00 0.00 C ATOM 1958 CD1 TYR B 205 25.860 16.570 11.897 1.00 0.00 C ATOM 1959 CD2 TYR B 205 24.854 16.742 9.745 1.00 0.00 C ATOM 1960 CE1 TYR B 205 25.389 17.820 12.230 1.00 0.00 C ATOM 1961 CE2 TYR B 205 24.378 17.995 10.076 1.00 0.00 C ATOM 1962 CZ TYR B 205 24.650 18.530 11.318 1.00 0.00 C ATOM 1963 OH TYR B 205 24.178 19.781 11.647 1.00 0.00 O ATOM 0 H TYR B 205 27.871 16.526 10.461 1.00 0.00 H new ATOM 0 HA TYR B 205 28.026 13.684 9.971 1.00 0.00 H new ATOM 0 HB2 TYR B 205 25.484 14.143 9.584 1.00 0.00 H new ATOM 0 HB3 TYR B 205 26.160 14.004 11.195 1.00 0.00 H new ATOM 0 HD1 TYR B 205 26.440 16.014 12.619 1.00 0.00 H new ATOM 0 HD2 TYR B 205 24.638 16.331 8.770 1.00 0.00 H new ATOM 0 HE1 TYR B 205 25.600 18.239 13.203 1.00 0.00 H new ATOM 0 HE2 TYR B 205 23.793 18.556 9.363 1.00 0.00 H new ATOM 0 HH TYR B 205 23.675 20.150 10.891 1.00 0.00 H new ATOM 1973 N ILE B 206 26.837 15.513 7.555 1.00 0.00 N ATOM 1974 CA ILE B 206 26.816 15.592 6.115 1.00 0.00 C ATOM 1975 C ILE B 206 26.859 17.047 5.785 1.00 0.00 C ATOM 1976 O ILE B 206 26.221 17.840 6.466 1.00 0.00 O ATOM 1977 CB ILE B 206 25.533 15.014 5.472 1.00 0.00 C ATOM 1978 CG1 ILE B 206 25.010 13.793 6.230 1.00 0.00 C ATOM 1979 CG2 ILE B 206 25.852 14.608 4.035 1.00 0.00 C ATOM 1980 CD1 ILE B 206 23.718 13.257 5.668 1.00 0.00 C ATOM 0 H ILE B 206 26.202 16.157 8.026 1.00 0.00 H new ATOM 0 HA ILE B 206 27.653 15.010 5.730 1.00 0.00 H new ATOM 0 HB ILE B 206 24.760 15.781 5.505 1.00 0.00 H new ATOM 0 HG12 ILE B 206 25.764 13.007 6.205 1.00 0.00 H new ATOM 0 HG13 ILE B 206 24.862 14.059 7.277 1.00 0.00 H new ATOM 0 HG21 ILE B 206 24.958 14.198 3.566 1.00 0.00 H new ATOM 0 HG22 ILE B 206 26.187 15.482 3.476 1.00 0.00 H new ATOM 0 HG23 ILE B 206 26.639 13.854 4.036 1.00 0.00 H new ATOM 0 HD11 ILE B 206 23.400 12.392 6.249 1.00 0.00 H new ATOM 0 HD12 ILE B 206 22.951 14.030 5.718 1.00 0.00 H new ATOM 0 HD13 ILE B 206 23.868 12.961 4.630 1.00 0.00 H new ATOM 1992 N ASP B 207 27.511 17.392 4.722 1.00 0.00 N ATOM 1993 CA ASP B 207 27.777 18.783 4.399 1.00 0.00 C ATOM 1994 C ASP B 207 26.749 19.272 3.396 1.00 0.00 C ATOM 1995 O ASP B 207 27.025 20.086 2.514 1.00 0.00 O ATOM 1996 CB ASP B 207 29.154 18.878 3.797 1.00 0.00 C ATOM 1997 CG ASP B 207 29.843 20.210 4.070 1.00 0.00 C ATOM 1998 OD1 ASP B 207 29.188 21.286 4.065 1.00 0.00 O1- ATOM 1999 OD2 ASP B 207 31.072 20.198 4.348 1.00 0.00 O ATOM 0 H ASP B 207 27.881 16.727 4.043 1.00 0.00 H new ATOM 0 HA ASP B 207 27.719 19.397 5.298 1.00 0.00 H new ATOM 0 HB2 ASP B 207 29.771 18.071 4.191 1.00 0.00 H new ATOM 0 HB3 ASP B 207 29.083 18.728 2.720 1.00 0.00 H new ATOM 2004 N ILE B 208 25.560 18.778 3.526 1.00 0.00 N ATOM 2005 CA ILE B 208 24.517 19.200 2.654 1.00 0.00 C ATOM 2006 C ILE B 208 23.586 20.102 3.416 1.00 0.00 C ATOM 2007 O ILE B 208 23.653 21.325 3.300 1.00 0.00 O ATOM 2008 CB ILE B 208 23.682 18.027 2.083 1.00 0.00 C ATOM 2009 CG1 ILE B 208 24.576 16.938 1.517 1.00 0.00 C ATOM 2010 CG2 ILE B 208 22.765 18.551 0.997 1.00 0.00 C ATOM 2011 CD1 ILE B 208 23.804 15.763 0.932 1.00 0.00 C ATOM 0 H ILE B 208 25.290 18.085 4.224 1.00 0.00 H new ATOM 0 HA ILE B 208 24.993 19.707 1.815 1.00 0.00 H new ATOM 0 HB ILE B 208 23.095 17.593 2.893 1.00 0.00 H new ATOM 0 HG12 ILE B 208 25.212 17.367 0.742 1.00 0.00 H new ATOM 0 HG13 ILE B 208 25.235 16.574 2.305 1.00 0.00 H new ATOM 0 HG21 ILE B 208 22.175 17.729 0.591 1.00 0.00 H new ATOM 0 HG22 ILE B 208 22.098 19.305 1.416 1.00 0.00 H new ATOM 0 HG23 ILE B 208 23.361 18.997 0.201 1.00 0.00 H new ATOM 0 HD11 ILE B 208 24.505 15.023 0.546 1.00 0.00 H new ATOM 0 HD12 ILE B 208 23.188 15.309 1.709 1.00 0.00 H new ATOM 0 HD13 ILE B 208 23.165 16.115 0.122 1.00 0.00 H new ATOM 2023 N MET B 209 22.775 19.463 4.272 1.00 0.00 N ATOM 2024 CA MET B 209 21.674 20.109 5.011 1.00 0.00 C ATOM 2025 C MET B 209 20.619 20.721 4.058 1.00 0.00 C ATOM 2026 O MET B 209 20.914 21.039 2.907 1.00 0.00 O ATOM 2027 CB MET B 209 22.179 21.142 6.040 1.00 0.00 C ATOM 2028 CG MET B 209 22.941 20.571 7.248 1.00 0.00 C ATOM 2029 SD MET B 209 21.912 19.660 8.464 1.00 0.00 S ATOM 2030 CE MET B 209 21.535 18.094 7.668 1.00 0.00 C ATOM 0 H MET B 209 22.865 18.467 4.475 1.00 0.00 H new ATOM 0 HA MET B 209 21.180 19.320 5.578 1.00 0.00 H new ATOM 0 HB2 MET B 209 22.830 21.849 5.526 1.00 0.00 H new ATOM 0 HB3 MET B 209 21.323 21.707 6.409 1.00 0.00 H new ATOM 0 HG2 MET B 209 23.720 19.902 6.882 1.00 0.00 H new ATOM 0 HG3 MET B 209 23.441 21.392 7.762 1.00 0.00 H new ATOM 0 HE1 MET B 209 21.626 17.286 8.394 1.00 0.00 H new ATOM 0 HE2 MET B 209 20.517 18.120 7.278 1.00 0.00 H new ATOM 0 HE3 MET B 209 22.233 17.925 6.848 1.00 0.00 H new ATOM 2040 N PRO B 210 19.368 20.836 4.485 1.00 0.00 N ATOM 2041 CA PRO B 210 18.344 21.461 3.662 1.00 0.00 C ATOM 2042 C PRO B 210 18.498 22.980 3.658 1.00 0.00 C ATOM 2043 O PRO B 210 19.099 23.567 4.582 1.00 0.00 O ATOM 2044 CB PRO B 210 17.049 21.043 4.337 1.00 0.00 C ATOM 2045 CG PRO B 210 17.407 20.836 5.767 1.00 0.00 C ATOM 2046 CD PRO B 210 18.831 20.363 5.780 1.00 0.00 C ATOM 0 HA PRO B 210 18.394 21.160 2.616 1.00 0.00 H new ATOM 0 HB2 PRO B 210 16.283 21.811 4.229 1.00 0.00 H new ATOM 0 HB3 PRO B 210 16.650 20.130 3.894 1.00 0.00 H new ATOM 0 HG2 PRO B 210 17.299 21.761 6.333 1.00 0.00 H new ATOM 0 HG3 PRO B 210 16.749 20.101 6.230 1.00 0.00 H new ATOM 0 HD2 PRO B 210 19.385 20.782 6.620 1.00 0.00 H new ATOM 0 HD3 PRO B 210 18.892 19.278 5.867 1.00 0.00 H new ATOM 2054 N ASP B 211 18.006 23.607 2.632 1.00 0.00 N ATOM 2055 CA ASP B 211 18.097 25.047 2.505 1.00 0.00 C ATOM 2056 C ASP B 211 16.747 25.714 2.736 1.00 0.00 C ATOM 2057 O ASP B 211 16.651 26.677 3.504 1.00 0.00 O ATOM 2058 CB ASP B 211 18.668 25.425 1.147 1.00 0.00 C ATOM 2059 CG ASP B 211 18.439 26.865 0.807 1.00 0.00 C ATOM 2060 OD1 ASP B 211 19.231 27.744 1.221 1.00 0.00 O1- ATOM 2061 OD2 ASP B 211 17.456 27.140 0.130 1.00 0.00 O ATOM 0 H ASP B 211 17.530 23.145 1.857 1.00 0.00 H new ATOM 0 HA ASP B 211 18.775 25.411 3.277 1.00 0.00 H new ATOM 0 HB2 ASP B 211 19.738 25.219 1.137 1.00 0.00 H new ATOM 0 HB3 ASP B 211 18.215 24.798 0.379 1.00 0.00 H new ATOM 2066 N PHE B 212 15.721 25.200 2.057 1.00 0.00 N ATOM 2067 CA PHE B 212 14.326 25.678 2.201 1.00 0.00 C ATOM 2068 C PHE B 212 14.076 27.161 1.828 1.00 0.00 C ATOM 2069 O PHE B 212 13.144 27.768 2.349 1.00 0.00 O ATOM 2070 CB PHE B 212 13.774 25.409 3.611 1.00 0.00 C ATOM 2071 CG PHE B 212 13.507 23.970 3.913 1.00 0.00 C ATOM 2072 CD1 PHE B 212 12.543 23.279 3.205 1.00 0.00 C ATOM 2073 CD2 PHE B 212 14.188 23.317 4.918 1.00 0.00 C ATOM 2074 CE1 PHE B 212 12.264 21.965 3.489 1.00 0.00 C ATOM 2075 CE2 PHE B 212 13.913 21.998 5.206 1.00 0.00 C ATOM 2076 CZ PHE B 212 12.948 21.324 4.488 1.00 0.00 C ATOM 0 H PHE B 212 15.824 24.438 1.387 1.00 0.00 H new ATOM 0 HA PHE B 212 13.786 25.089 1.459 1.00 0.00 H new ATOM 0 HB2 PHE B 212 14.483 25.794 4.344 1.00 0.00 H new ATOM 0 HB3 PHE B 212 12.848 25.971 3.737 1.00 0.00 H new ATOM 0 HD1 PHE B 212 12.001 23.780 2.416 1.00 0.00 H new ATOM 0 HD2 PHE B 212 14.943 23.843 5.484 1.00 0.00 H new ATOM 0 HE1 PHE B 212 11.507 21.438 2.926 1.00 0.00 H new ATOM 0 HE2 PHE B 212 14.453 21.493 5.993 1.00 0.00 H new ATOM 0 HZ PHE B 212 12.731 20.290 4.713 1.00 0.00 H new ATOM 2086 N SER B 213 14.815 27.722 0.907 1.00 0.00 N ATOM 2087 CA SER B 213 14.569 29.093 0.531 1.00 0.00 C ATOM 2088 C SER B 213 13.835 29.097 -0.811 1.00 0.00 C ATOM 2089 O SER B 213 13.831 28.075 -1.502 1.00 0.00 O ATOM 2090 CB SER B 213 15.904 29.826 0.402 1.00 0.00 C ATOM 2091 OG SER B 213 16.715 29.589 1.545 1.00 0.00 O ATOM 0 H SER B 213 15.579 27.263 0.410 1.00 0.00 H new ATOM 0 HA SER B 213 13.963 29.596 1.284 1.00 0.00 H new ATOM 0 HB2 SER B 213 16.424 29.491 -0.496 1.00 0.00 H new ATOM 0 HB3 SER B 213 15.729 30.896 0.289 1.00 0.00 H new ATOM 0 HG SER B 213 17.567 30.064 1.446 1.00 0.00 H new ATOM 2097 N PRO B 214 13.137 30.173 -1.170 1.00 0.00 N ATOM 2098 CA PRO B 214 12.578 30.291 -2.502 1.00 0.00 C ATOM 2099 C PRO B 214 13.640 30.709 -3.483 1.00 0.00 C ATOM 2100 O PRO B 214 14.681 31.295 -3.102 1.00 0.00 O ATOM 2101 CB PRO B 214 11.599 31.446 -2.402 1.00 0.00 C ATOM 2102 CG PRO B 214 12.075 32.268 -1.251 1.00 0.00 C ATOM 2103 CD PRO B 214 12.785 31.329 -0.310 1.00 0.00 C ATOM 0 HA PRO B 214 12.139 29.349 -2.830 1.00 0.00 H new ATOM 0 HB2 PRO B 214 11.584 32.030 -3.322 1.00 0.00 H new ATOM 0 HB3 PRO B 214 10.583 31.087 -2.236 1.00 0.00 H new ATOM 0 HG2 PRO B 214 12.747 33.056 -1.591 1.00 0.00 H new ATOM 0 HG3 PRO B 214 11.238 32.756 -0.752 1.00 0.00 H new ATOM 0 HD2 PRO B 214 13.672 31.791 0.124 1.00 0.00 H new ATOM 0 HD3 PRO B 214 12.143 31.031 0.519 1.00 0.00 H new ATOM 2111 N SER B 215 13.432 30.404 -4.699 1.00 0.00 N ATOM 2112 CA SER B 215 14.242 30.958 -5.682 1.00 0.00 C ATOM 2113 C SER B 215 13.623 32.283 -6.103 1.00 0.00 C ATOM 2114 O SER B 215 12.423 32.534 -5.933 1.00 0.00 O ATOM 2115 CB SER B 215 14.390 30.050 -6.897 1.00 0.00 C ATOM 2116 OG SER B 215 13.209 30.054 -7.690 1.00 0.00 O ATOM 0 H SER B 215 12.704 29.771 -5.032 1.00 0.00 H new ATOM 0 HA SER B 215 15.242 31.097 -5.272 1.00 0.00 H new ATOM 0 HB2 SER B 215 15.237 30.379 -7.499 1.00 0.00 H new ATOM 0 HB3 SER B 215 14.608 29.033 -6.570 1.00 0.00 H new ATOM 0 HG SER B 215 12.425 29.954 -7.110 1.00 0.00 H new ATOM 2122 N GLY B 216 14.434 33.072 -6.641 1.00 0.00 N ATOM 2123 CA GLY B 216 14.081 34.351 -7.164 1.00 0.00 C ATOM 2124 C GLY B 216 13.643 34.221 -8.595 1.00 0.00 C ATOM 2125 O GLY B 216 13.245 35.191 -9.221 1.00 0.00 O ATOM 0 H GLY B 216 15.425 32.854 -6.747 1.00 0.00 H new ATOM 0 HA2 GLY B 216 13.279 34.787 -6.568 1.00 0.00 H new ATOM 0 HA3 GLY B 216 14.933 35.028 -7.096 1.00 0.00 H new ATOM 2129 N LEU B 217 13.717 32.993 -9.126 1.00 0.00 N ATOM 2130 CA LEU B 217 13.217 32.719 -10.465 1.00 0.00 C ATOM 2131 C LEU B 217 11.723 32.887 -10.382 1.00 0.00 C ATOM 2132 O LEU B 217 11.074 33.471 -11.238 1.00 0.00 O ATOM 2133 CB LEU B 217 13.490 31.256 -10.863 1.00 0.00 C ATOM 2134 CG LEU B 217 14.896 30.706 -10.626 1.00 0.00 C ATOM 2135 CD1 LEU B 217 14.978 29.275 -11.073 1.00 0.00 C ATOM 2136 CD2 LEU B 217 15.945 31.528 -11.321 1.00 0.00 C ATOM 0 H LEU B 217 14.116 32.185 -8.648 1.00 0.00 H new ATOM 0 HA LEU B 217 13.694 33.377 -11.191 1.00 0.00 H new ATOM 0 HB2 LEU B 217 12.787 30.624 -10.321 1.00 0.00 H new ATOM 0 HB3 LEU B 217 13.262 31.149 -11.924 1.00 0.00 H new ATOM 0 HG LEU B 217 15.092 30.760 -9.555 1.00 0.00 H new ATOM 0 HD11 LEU B 217 15.985 28.896 -10.898 1.00 0.00 H new ATOM 0 HD12 LEU B 217 14.262 28.676 -10.510 1.00 0.00 H new ATOM 0 HD13 LEU B 217 14.746 29.212 -12.136 1.00 0.00 H new ATOM 0 HD21 LEU B 217 16.929 31.102 -11.126 1.00 0.00 H new ATOM 0 HD22 LEU B 217 15.755 31.528 -12.394 1.00 0.00 H new ATOM 0 HD23 LEU B 217 15.912 32.551 -10.947 1.00 0.00 H new ATOM 2148 N LEU B 218 11.225 32.422 -9.273 1.00 0.00 N ATOM 2149 CA LEU B 218 9.840 32.394 -8.936 1.00 0.00 C ATOM 2150 C LEU B 218 9.144 33.754 -8.946 1.00 0.00 C ATOM 2151 O LEU B 218 7.962 33.833 -9.278 1.00 0.00 O ATOM 2152 CB LEU B 218 9.676 31.676 -7.619 1.00 0.00 C ATOM 2153 CG LEU B 218 9.058 30.271 -7.759 1.00 0.00 C ATOM 2154 CD1 LEU B 218 9.891 29.383 -8.619 1.00 0.00 C ATOM 2155 CD2 LEU B 218 8.844 29.617 -6.443 1.00 0.00 C ATOM 0 H LEU B 218 11.815 32.030 -8.539 1.00 0.00 H new ATOM 0 HA LEU B 218 9.328 31.848 -9.728 1.00 0.00 H new ATOM 0 HB2 LEU B 218 10.650 31.590 -7.137 1.00 0.00 H new ATOM 0 HB3 LEU B 218 9.047 32.277 -6.962 1.00 0.00 H new ATOM 0 HG LEU B 218 8.088 30.419 -8.235 1.00 0.00 H new ATOM 0 HD11 LEU B 218 9.421 28.402 -8.692 1.00 0.00 H new ATOM 0 HD12 LEU B 218 9.979 29.819 -9.614 1.00 0.00 H new ATOM 0 HD13 LEU B 218 10.883 29.278 -8.180 1.00 0.00 H new ATOM 0 HD21 LEU B 218 8.407 28.630 -6.594 1.00 0.00 H new ATOM 0 HD22 LEU B 218 9.799 29.516 -5.927 1.00 0.00 H new ATOM 0 HD23 LEU B 218 8.169 30.224 -5.840 1.00 0.00 H new ATOM 2167 N GLU B 219 9.858 34.814 -8.634 1.00 0.00 N ATOM 2168 CA GLU B 219 9.255 36.138 -8.641 1.00 0.00 C ATOM 2169 C GLU B 219 9.297 36.755 -10.044 1.00 0.00 C ATOM 2170 O GLU B 219 8.668 37.772 -10.305 1.00 0.00 O ATOM 2171 CB GLU B 219 9.915 37.070 -7.613 1.00 0.00 C ATOM 2172 CG GLU B 219 11.404 37.278 -7.812 1.00 0.00 C ATOM 2173 CD GLU B 219 11.969 38.309 -6.877 1.00 0.00 C ATOM 2174 OE1 GLU B 219 12.310 37.976 -5.723 1.00 0.00 O1- ATOM 2175 OE2 GLU B 219 12.064 39.482 -7.274 1.00 0.00 O ATOM 0 H GLU B 219 10.844 34.791 -8.375 1.00 0.00 H new ATOM 0 HA GLU B 219 8.211 36.019 -8.352 1.00 0.00 H new ATOM 0 HB2 GLU B 219 9.418 38.039 -7.650 1.00 0.00 H new ATOM 0 HB3 GLU B 219 9.749 36.664 -6.615 1.00 0.00 H new ATOM 0 HG2 GLU B 219 11.923 36.332 -7.661 1.00 0.00 H new ATOM 0 HG3 GLU B 219 11.591 37.584 -8.841 1.00 0.00 H new ATOM 2182 N LEU B 220 10.019 36.123 -10.939 1.00 0.00 N ATOM 2183 CA LEU B 220 10.153 36.615 -12.303 1.00 0.00 C ATOM 2184 C LEU B 220 9.228 35.860 -13.237 1.00 0.00 C ATOM 2185 O LEU B 220 8.621 36.437 -14.138 1.00 0.00 O ATOM 2186 CB LEU B 220 11.594 36.441 -12.773 1.00 0.00 C ATOM 2187 CG LEU B 220 12.656 37.154 -11.946 1.00 0.00 C ATOM 2188 CD1 LEU B 220 14.038 36.803 -12.456 1.00 0.00 C ATOM 2189 CD2 LEU B 220 12.433 38.660 -11.980 1.00 0.00 C ATOM 0 H LEU B 220 10.529 35.260 -10.751 1.00 0.00 H new ATOM 0 HA LEU B 220 9.884 37.671 -12.317 1.00 0.00 H new ATOM 0 HB2 LEU B 220 11.825 35.376 -12.785 1.00 0.00 H new ATOM 0 HB3 LEU B 220 11.665 36.794 -13.802 1.00 0.00 H new ATOM 0 HG LEU B 220 12.577 36.822 -10.911 1.00 0.00 H new ATOM 0 HD11 LEU B 220 14.789 37.319 -11.857 1.00 0.00 H new ATOM 0 HD12 LEU B 220 14.191 35.726 -12.381 1.00 0.00 H new ATOM 0 HD13 LEU B 220 14.131 37.111 -13.497 1.00 0.00 H new ATOM 0 HD21 LEU B 220 13.200 39.155 -11.384 1.00 0.00 H new ATOM 0 HD22 LEU B 220 12.489 39.013 -13.010 1.00 0.00 H new ATOM 0 HD23 LEU B 220 11.450 38.892 -11.570 1.00 0.00 H new ATOM 2201 N GLU B 221 9.121 34.570 -13.002 1.00 0.00 N ATOM 2202 CA GLU B 221 8.328 33.674 -13.839 1.00 0.00 C ATOM 2203 C GLU B 221 6.830 33.840 -13.600 1.00 0.00 C ATOM 2204 O GLU B 221 6.007 33.369 -14.386 1.00 0.00 O ATOM 2205 CB GLU B 221 8.735 32.239 -13.575 1.00 0.00 C ATOM 2206 CG GLU B 221 10.215 31.961 -13.811 1.00 0.00 C ATOM 2207 CD GLU B 221 10.676 32.214 -15.232 1.00 0.00 C ATOM 2208 OE1 GLU B 221 11.061 33.347 -15.555 1.00 0.00 O1- ATOM 2209 OE2 GLU B 221 10.692 31.261 -16.043 1.00 0.00 O ATOM 0 H GLU B 221 9.582 34.103 -12.221 1.00 0.00 H new ATOM 0 HA GLU B 221 8.524 33.933 -14.880 1.00 0.00 H new ATOM 0 HB2 GLU B 221 8.488 31.986 -12.544 1.00 0.00 H new ATOM 0 HB3 GLU B 221 8.146 31.582 -14.214 1.00 0.00 H new ATOM 0 HG2 GLU B 221 10.802 32.582 -13.135 1.00 0.00 H new ATOM 0 HG3 GLU B 221 10.424 30.923 -13.553 1.00 0.00 H new ATOM 2216 N SER B 222 6.498 34.477 -12.525 1.00 0.00 N ATOM 2217 CA SER B 222 5.143 34.758 -12.188 1.00 0.00 C ATOM 2218 C SER B 222 4.638 35.973 -12.987 1.00 0.00 C ATOM 2219 O SER B 222 4.849 37.116 -12.555 1.00 0.00 O ATOM 2220 CB SER B 222 5.036 34.951 -10.672 1.00 0.00 C ATOM 2221 OG SER B 222 6.190 35.633 -10.161 1.00 0.00 O ATOM 2222 OXT SER B 222 4.074 35.782 -14.099 1.00 0.00 O1- ATOM 0 H SER B 222 7.174 34.823 -11.844 1.00 0.00 H new ATOM 0 HA SER B 222 4.499 33.922 -12.460 1.00 0.00 H new ATOM 0 HB2 SER B 222 4.137 35.521 -10.436 1.00 0.00 H new ATOM 0 HB3 SER B 222 4.936 33.982 -10.184 1.00 0.00 H new ATOM 0 HG SER B 222 6.727 35.012 -9.626 1.00 0.00 H new TER 2228 SER B 222 ATOM 2229 N GLY C 300 -7.663 31.596 6.397 1.00 0.00 N ATOM 2230 CA GLY C 300 -8.535 30.647 7.092 1.00 0.00 C ATOM 2231 C GLY C 300 -8.045 29.233 6.919 1.00 0.00 C ATOM 2232 O GLY C 300 -6.941 29.019 6.420 1.00 0.00 O ATOM 0 HA2 GLY C 300 -8.574 30.894 8.153 1.00 0.00 H new ATOM 0 HA3 GLY C 300 -9.551 30.733 6.707 1.00 0.00 H new ATOM 2238 N SER C 301 -8.862 28.275 7.314 1.00 0.00 N ATOM 2239 CA SER C 301 -8.543 26.865 7.193 1.00 0.00 C ATOM 2240 C SER C 301 -8.666 26.442 5.731 1.00 0.00 C ATOM 2241 O SER C 301 -7.725 25.882 5.138 1.00 0.00 O ATOM 2242 CB SER C 301 -9.505 26.050 8.079 1.00 0.00 C ATOM 2243 OG SER C 301 -9.233 24.654 8.042 1.00 0.00 O ATOM 0 H SER C 301 -9.775 28.455 7.732 1.00 0.00 H new ATOM 0 HA SER C 301 -7.521 26.681 7.524 1.00 0.00 H new ATOM 0 HB2 SER C 301 -9.433 26.403 9.108 1.00 0.00 H new ATOM 0 HB3 SER C 301 -10.530 26.225 7.753 1.00 0.00 H new ATOM 0 HG SER C 301 -9.868 24.182 8.620 1.00 0.00 H new ATOM 2249 N TYR C 302 -9.804 26.739 5.152 1.00 0.00 N ATOM 2250 CA TYR C 302 -10.073 26.435 3.779 1.00 0.00 C ATOM 2251 C TYR C 302 -10.203 27.727 3.036 1.00 0.00 C ATOM 2252 O TYR C 302 -10.807 28.672 3.552 1.00 0.00 O ATOM 2253 CB TYR C 302 -11.392 25.660 3.644 1.00 0.00 C ATOM 2254 CG TYR C 302 -11.406 24.295 4.288 1.00 0.00 C ATOM 2255 CD1 TYR C 302 -10.948 23.190 3.596 1.00 0.00 C ATOM 2256 CD2 TYR C 302 -11.887 24.108 5.577 1.00 0.00 C ATOM 2257 CE1 TYR C 302 -10.962 21.937 4.158 1.00 0.00 C ATOM 2258 CE2 TYR C 302 -11.906 22.852 6.151 1.00 0.00 C ATOM 2259 CZ TYR C 302 -11.442 21.770 5.434 1.00 0.00 C ATOM 2260 OH TYR C 302 -11.459 20.513 5.999 1.00 0.00 O ATOM 0 H TYR C 302 -10.575 27.204 5.632 1.00 0.00 H new ATOM 0 HA TYR C 302 -9.263 25.825 3.379 1.00 0.00 H new ATOM 0 HB2 TYR C 302 -12.192 26.258 4.080 1.00 0.00 H new ATOM 0 HB3 TYR C 302 -11.621 25.546 2.584 1.00 0.00 H new ATOM 0 HD1 TYR C 302 -10.571 23.314 2.592 1.00 0.00 H new ATOM 0 HD2 TYR C 302 -12.251 24.956 6.138 1.00 0.00 H new ATOM 0 HE1 TYR C 302 -10.598 21.087 3.600 1.00 0.00 H new ATOM 0 HE2 TYR C 302 -12.282 22.718 7.155 1.00 0.00 H new ATOM 0 HH TYR C 302 -11.827 20.567 6.906 1.00 0.00 H new ATOM 2270 N ASP C 303 -9.603 27.826 1.876 1.00 0.00 N ATOM 2271 CA ASP C 303 -9.820 29.014 1.073 1.00 0.00 C ATOM 2272 C ASP C 303 -11.155 28.863 0.412 1.00 0.00 C ATOM 2273 O ASP C 303 -12.028 29.706 0.549 1.00 0.00 O ATOM 2274 CB ASP C 303 -8.724 29.257 0.045 1.00 0.00 C ATOM 2275 CG ASP C 303 -8.914 30.596 -0.646 1.00 0.00 C ATOM 2276 OD1 ASP C 303 -8.623 31.636 -0.035 1.00 0.00 O1- ATOM 2277 OD2 ASP C 303 -9.373 30.635 -1.813 1.00 0.00 O ATOM 0 H ASP C 303 -8.980 27.127 1.472 1.00 0.00 H new ATOM 0 HA ASP C 303 -9.795 29.890 1.722 1.00 0.00 H new ATOM 0 HB2 ASP C 303 -7.750 29.231 0.533 1.00 0.00 H new ATOM 0 HB3 ASP C 303 -8.731 28.457 -0.696 1.00 0.00 H new ATOM 2282 N LYS C 304 -11.326 27.765 -0.279 1.00 0.00 N ATOM 2283 CA LYS C 304 -12.617 27.412 -0.782 1.00 0.00 C ATOM 2284 C LYS C 304 -13.312 26.557 0.257 1.00 0.00 C ATOM 2285 O LYS C 304 -12.799 25.506 0.641 1.00 0.00 O ATOM 2286 CB LYS C 304 -12.579 26.684 -2.145 1.00 0.00 C ATOM 2287 CG LYS C 304 -12.349 27.576 -3.376 1.00 0.00 C ATOM 2288 CD LYS C 304 -11.029 28.307 -3.321 1.00 0.00 C ATOM 2289 CE LYS C 304 -10.859 29.265 -4.492 1.00 0.00 C ATOM 2290 NZ LYS C 304 -9.588 30.007 -4.397 1.00 0.00 N1+ ATOM 0 H LYS C 304 -10.583 27.103 -0.503 1.00 0.00 H new ATOM 0 HA LYS C 304 -13.166 28.336 -0.965 1.00 0.00 H new ATOM 0 HB2 LYS C 304 -11.790 25.933 -2.112 1.00 0.00 H new ATOM 0 HB3 LYS C 304 -13.521 26.151 -2.277 1.00 0.00 H new ATOM 0 HG2 LYS C 304 -12.384 26.963 -4.277 1.00 0.00 H new ATOM 0 HG3 LYS C 304 -13.159 28.301 -3.452 1.00 0.00 H new ATOM 0 HD2 LYS C 304 -10.961 28.862 -2.385 1.00 0.00 H new ATOM 0 HD3 LYS C 304 -10.214 27.584 -3.323 1.00 0.00 H new ATOM 0 HE2 LYS C 304 -10.888 28.707 -5.428 1.00 0.00 H new ATOM 0 HE3 LYS C 304 -11.692 29.968 -4.514 1.00 0.00 H new ATOM 0 HZ1 LYS C 304 -9.554 30.734 -5.140 1.00 0.00 H new ATOM 0 HZ2 LYS C 304 -9.520 30.462 -3.464 1.00 0.00 H new ATOM 0 HZ3 LYS C 304 -8.792 29.349 -4.520 1.00 0.00 H new ATOM 2304 N PRO C 305 -14.468 27.010 0.755 1.00 0.00 N ATOM 2305 CA PRO C 305 -15.257 26.267 1.757 1.00 0.00 C ATOM 2306 C PRO C 305 -15.842 24.989 1.155 1.00 0.00 C ATOM 2307 O PRO C 305 -16.286 24.066 1.862 1.00 0.00 O ATOM 2308 CB PRO C 305 -16.364 27.253 2.146 1.00 0.00 C ATOM 2309 CG PRO C 305 -16.458 28.202 0.998 1.00 0.00 C ATOM 2310 CD PRO C 305 -15.089 28.294 0.398 1.00 0.00 C ATOM 0 HA PRO C 305 -14.662 25.943 2.611 1.00 0.00 H new ATOM 0 HB2 PRO C 305 -17.311 26.738 2.311 1.00 0.00 H new ATOM 0 HB3 PRO C 305 -16.120 27.776 3.071 1.00 0.00 H new ATOM 0 HG2 PRO C 305 -17.179 27.848 0.262 1.00 0.00 H new ATOM 0 HG3 PRO C 305 -16.800 29.181 1.333 1.00 0.00 H new ATOM 0 HD2 PRO C 305 -15.133 28.431 -0.682 1.00 0.00 H new ATOM 0 HD3 PRO C 305 -14.529 29.137 0.804 1.00 0.00 H new ATOM 2318 N ALA C 306 -15.836 24.961 -0.143 1.00 0.00 N ATOM 2319 CA ALA C 306 -16.237 23.848 -0.913 1.00 0.00 C ATOM 2320 C ALA C 306 -15.174 23.641 -1.960 1.00 0.00 C ATOM 2321 O ALA C 306 -15.058 24.443 -2.886 1.00 0.00 O ATOM 2322 CB ALA C 306 -17.579 24.106 -1.561 1.00 0.00 C ATOM 0 H ALA C 306 -15.536 25.755 -0.709 1.00 0.00 H new ATOM 0 HA ALA C 306 -16.348 22.961 -0.289 1.00 0.00 H new ATOM 0 HB1 ALA C 306 -17.872 23.237 -2.150 1.00 0.00 H new ATOM 0 HB2 ALA C 306 -18.327 24.289 -0.789 1.00 0.00 H new ATOM 0 HB3 ALA C 306 -17.507 24.978 -2.211 1.00 0.00 H new ATOM 2328 N PRO C 307 -14.314 22.639 -1.774 1.00 0.00 N ATOM 2329 CA PRO C 307 -13.252 22.336 -2.721 1.00 0.00 C ATOM 2330 C PRO C 307 -13.827 21.873 -4.057 1.00 0.00 C ATOM 2331 O PRO C 307 -14.363 20.766 -4.169 1.00 0.00 O ATOM 2332 CB PRO C 307 -12.460 21.208 -2.039 1.00 0.00 C ATOM 2333 CG PRO C 307 -12.864 21.274 -0.608 1.00 0.00 C ATOM 2334 CD PRO C 307 -14.286 21.730 -0.617 1.00 0.00 C ATOM 0 HA PRO C 307 -12.633 23.203 -2.950 1.00 0.00 H new ATOM 0 HB2 PRO C 307 -12.699 20.237 -2.474 1.00 0.00 H new ATOM 0 HB3 PRO C 307 -11.386 21.353 -2.154 1.00 0.00 H new ATOM 0 HG2 PRO C 307 -12.767 20.301 -0.127 1.00 0.00 H new ATOM 0 HG3 PRO C 307 -12.233 21.968 -0.053 1.00 0.00 H new ATOM 0 HD2 PRO C 307 -14.980 20.898 -0.736 1.00 0.00 H new ATOM 0 HD3 PRO C 307 -14.556 22.240 0.308 1.00 0.00 H new ATOM 2342 N GLU C 308 -13.753 22.751 -5.046 1.00 0.00 N ATOM 2343 CA GLU C 308 -14.306 22.496 -6.370 1.00 0.00 C ATOM 2344 C GLU C 308 -13.451 21.507 -7.140 1.00 0.00 C ATOM 2345 O GLU C 308 -13.961 20.743 -7.970 1.00 0.00 O ATOM 2346 CB GLU C 308 -14.415 23.797 -7.145 1.00 0.00 C ATOM 2347 CG GLU C 308 -15.160 24.883 -6.399 1.00 0.00 C ATOM 2348 CD GLU C 308 -15.329 26.119 -7.218 1.00 0.00 C ATOM 2349 OE1 GLU C 308 -14.325 26.793 -7.526 1.00 0.00 O ATOM 2350 OE2 GLU C 308 -16.476 26.453 -7.572 1.00 0.00 O1- ATOM 0 H GLU C 308 -13.307 23.663 -4.954 1.00 0.00 H new ATOM 0 HA GLU C 308 -15.299 22.063 -6.245 1.00 0.00 H new ATOM 0 HB2 GLU C 308 -13.413 24.153 -7.384 1.00 0.00 H new ATOM 0 HB3 GLU C 308 -14.920 23.606 -8.092 1.00 0.00 H new ATOM 0 HG2 GLU C 308 -16.140 24.510 -6.102 1.00 0.00 H new ATOM 0 HG3 GLU C 308 -14.621 25.127 -5.484 1.00 0.00 H new ATOM 2357 N ASN C 309 -12.154 21.533 -6.862 1.00 0.00 N ATOM 2358 CA ASN C 309 -11.204 20.622 -7.479 1.00 0.00 C ATOM 2359 C ASN C 309 -11.596 19.195 -7.116 1.00 0.00 C ATOM 2360 O ASN C 309 -11.740 18.867 -5.936 1.00 0.00 O ATOM 2361 CB ASN C 309 -9.754 20.953 -7.014 1.00 0.00 C ATOM 2362 CG ASN C 309 -8.649 20.067 -7.633 1.00 0.00 C ATOM 2363 OD1 ASN C 309 -8.845 18.889 -7.924 1.00 0.00 O ATOM 2364 ND2 ASN C 309 -7.493 20.638 -7.860 1.00 0.00 N ATOM 0 H ASN C 309 -11.733 22.187 -6.202 1.00 0.00 H new ATOM 0 HA ASN C 309 -11.226 20.732 -8.563 1.00 0.00 H new ATOM 0 HB2 ASN C 309 -9.541 21.994 -7.255 1.00 0.00 H new ATOM 0 HB3 ASN C 309 -9.707 20.861 -5.929 1.00 0.00 H new ATOM 0 HD21 ASN C 309 -6.735 20.104 -8.286 1.00 0.00 H new ATOM 0 HD22 ASN C 309 -7.350 21.617 -7.611 1.00 0.00 H new ATOM 2371 N ARG C 310 -11.789 18.373 -8.138 1.00 0.00 N ATOM 2372 CA ARG C 310 -12.228 16.967 -8.002 1.00 0.00 C ATOM 2373 C ARG C 310 -11.299 16.115 -7.115 1.00 0.00 C ATOM 2374 O ARG C 310 -11.707 15.086 -6.580 1.00 0.00 O ATOM 2375 CB ARG C 310 -12.423 16.278 -9.375 1.00 0.00 C ATOM 2376 CG ARG C 310 -11.167 16.117 -10.246 1.00 0.00 C ATOM 2377 CD ARG C 310 -10.717 17.419 -10.908 1.00 0.00 C ATOM 2378 NE ARG C 310 -9.480 17.233 -11.661 1.00 0.00 N ATOM 2379 CZ ARG C 310 -9.333 17.392 -12.987 1.00 0.00 C ATOM 2380 NH1 ARG C 310 -10.361 17.758 -13.755 1.00 0.00 N1+ ATOM 2381 NH2 ARG C 310 -8.145 17.186 -13.542 1.00 0.00 N ATOM 0 H ARG C 310 -11.646 18.657 -9.107 1.00 0.00 H new ATOM 0 HA ARG C 310 -13.193 17.026 -7.499 1.00 0.00 H new ATOM 0 HB2 ARG C 310 -12.848 15.289 -9.203 1.00 0.00 H new ATOM 0 HB3 ARG C 310 -13.160 16.848 -9.941 1.00 0.00 H new ATOM 0 HG2 ARG C 310 -10.354 15.731 -9.631 1.00 0.00 H new ATOM 0 HG3 ARG C 310 -11.363 15.374 -11.019 1.00 0.00 H new ATOM 0 HD2 ARG C 310 -11.500 17.780 -11.575 1.00 0.00 H new ATOM 0 HD3 ARG C 310 -10.570 18.184 -10.146 1.00 0.00 H new ATOM 0 HE ARG C 310 -8.652 16.957 -11.132 1.00 0.00 H new ATOM 0 HH11 ARG C 310 -11.277 17.922 -13.337 1.00 0.00 H new ATOM 0 HH12 ARG C 310 -10.231 17.874 -14.760 1.00 0.00 H new ATOM 0 HH21 ARG C 310 -7.353 16.909 -12.963 1.00 0.00 H new ATOM 0 HH22 ARG C 310 -8.025 17.304 -14.548 1.00 0.00 H new ATOM 2395 N PHE C 311 -10.063 16.551 -6.960 1.00 0.00 N ATOM 2396 CA PHE C 311 -9.103 15.854 -6.122 1.00 0.00 C ATOM 2397 C PHE C 311 -9.359 16.131 -4.634 1.00 0.00 C ATOM 2398 O PHE C 311 -8.770 15.474 -3.764 1.00 0.00 O ATOM 2399 CB PHE C 311 -7.669 16.232 -6.502 1.00 0.00 C ATOM 2400 CG PHE C 311 -7.146 15.603 -7.771 1.00 0.00 C ATOM 2401 CD1 PHE C 311 -7.579 16.006 -9.018 1.00 0.00 C ATOM 2402 CD2 PHE C 311 -6.194 14.613 -7.696 1.00 0.00 C ATOM 2403 CE1 PHE C 311 -7.067 15.420 -10.164 1.00 0.00 C ATOM 2404 CE2 PHE C 311 -5.680 14.026 -8.824 1.00 0.00 C ATOM 2405 CZ PHE C 311 -6.115 14.428 -10.064 1.00 0.00 C ATOM 0 H PHE C 311 -9.697 17.392 -7.407 1.00 0.00 H new ATOM 0 HA PHE C 311 -9.231 14.785 -6.292 1.00 0.00 H new ATOM 0 HB2 PHE C 311 -7.612 17.316 -6.604 1.00 0.00 H new ATOM 0 HB3 PHE C 311 -7.009 15.954 -5.680 1.00 0.00 H new ATOM 0 HD1 PHE C 311 -8.323 16.784 -9.101 1.00 0.00 H new ATOM 0 HD2 PHE C 311 -5.843 14.291 -6.727 1.00 0.00 H new ATOM 0 HE1 PHE C 311 -7.414 15.740 -11.135 1.00 0.00 H new ATOM 0 HE2 PHE C 311 -4.935 13.249 -8.738 1.00 0.00 H new ATOM 0 HZ PHE C 311 -5.713 13.969 -10.955 1.00 0.00 H new ATOM 2415 N ALA C 312 -10.239 17.116 -4.360 1.00 0.00 N ATOM 2416 CA ALA C 312 -10.669 17.511 -3.002 1.00 0.00 C ATOM 2417 C ALA C 312 -9.514 18.076 -2.164 1.00 0.00 C ATOM 2418 O ALA C 312 -9.563 18.081 -0.932 1.00 0.00 O ATOM 2419 CB ALA C 312 -11.361 16.342 -2.291 1.00 0.00 C ATOM 0 H ALA C 312 -10.680 17.671 -5.093 1.00 0.00 H new ATOM 0 HA ALA C 312 -11.392 18.319 -3.113 1.00 0.00 H new ATOM 0 HB1 ALA C 312 -11.669 16.654 -1.293 1.00 0.00 H new ATOM 0 HB2 ALA C 312 -12.237 16.036 -2.863 1.00 0.00 H new ATOM 0 HB3 ALA C 312 -10.669 15.504 -2.211 1.00 0.00 H new ATOM 2425 N ILE C 313 -8.524 18.621 -2.836 1.00 0.00 N ATOM 2426 CA ILE C 313 -7.344 19.152 -2.168 1.00 0.00 C ATOM 2427 C ILE C 313 -7.428 20.661 -2.149 1.00 0.00 C ATOM 2428 O ILE C 313 -7.944 21.257 -3.092 1.00 0.00 O ATOM 2429 CB ILE C 313 -6.062 18.824 -2.959 1.00 0.00 C ATOM 2430 CG1 ILE C 313 -6.044 17.389 -3.430 1.00 0.00 C ATOM 2431 CG2 ILE C 313 -4.837 19.082 -2.084 1.00 0.00 C ATOM 2432 CD1 ILE C 313 -4.991 17.153 -4.472 1.00 0.00 C ATOM 0 H ILE C 313 -8.508 18.711 -3.852 1.00 0.00 H new ATOM 0 HA ILE C 313 -7.308 18.714 -1.170 1.00 0.00 H new ATOM 0 HB ILE C 313 -6.042 19.469 -3.837 1.00 0.00 H new ATOM 0 HG12 ILE C 313 -5.867 16.731 -2.580 1.00 0.00 H new ATOM 0 HG13 ILE C 313 -7.021 17.129 -3.837 1.00 0.00 H new ATOM 0 HG21 ILE C 313 -3.933 18.849 -2.646 1.00 0.00 H new ATOM 0 HG22 ILE C 313 -4.818 20.130 -1.784 1.00 0.00 H new ATOM 0 HG23 ILE C 313 -4.885 18.451 -1.196 1.00 0.00 H new ATOM 0 HD11 ILE C 313 -5.014 16.108 -4.782 1.00 0.00 H new ATOM 0 HD12 ILE C 313 -5.183 17.792 -5.334 1.00 0.00 H new ATOM 0 HD13 ILE C 313 -4.010 17.387 -4.058 1.00 0.00 H new ATOM 2444 N MET C 314 -6.930 21.263 -1.096 1.00 0.00 N ATOM 2445 CA MET C 314 -6.799 22.700 -1.008 1.00 0.00 C ATOM 2446 C MET C 314 -5.328 23.031 -0.816 1.00 0.00 C ATOM 2447 O MET C 314 -4.588 22.192 -0.270 1.00 0.00 O ATOM 2448 CB MET C 314 -7.649 23.278 0.136 1.00 0.00 C ATOM 2449 CG MET C 314 -9.171 23.259 -0.081 1.00 0.00 C ATOM 2450 SD MET C 314 -9.822 24.538 -1.227 1.00 0.00 S ATOM 2451 CE MET C 314 -9.234 24.014 -2.849 1.00 0.00 C ATOM 0 H MET C 314 -6.601 20.766 -0.268 1.00 0.00 H new ATOM 0 HA MET C 314 -7.168 23.155 -1.927 1.00 0.00 H new ATOM 0 HB2 MET C 314 -7.424 22.722 1.046 1.00 0.00 H new ATOM 0 HB3 MET C 314 -7.339 24.309 0.308 1.00 0.00 H new ATOM 0 HG2 MET C 314 -9.454 22.277 -0.461 1.00 0.00 H new ATOM 0 HG3 MET C 314 -9.660 23.380 0.886 1.00 0.00 H new ATOM 0 HE1 MET C 314 -9.781 24.550 -3.625 1.00 0.00 H new ATOM 0 HE2 MET C 314 -8.170 24.232 -2.938 1.00 0.00 H new ATOM 0 HE3 MET C 314 -9.396 22.942 -2.966 1.00 0.00 H new ATOM 2461 N PRO C 315 -4.867 24.212 -1.298 1.00 0.00 N ATOM 2462 CA PRO C 315 -3.468 24.642 -1.181 1.00 0.00 C ATOM 2463 C PRO C 315 -2.917 24.510 0.240 1.00 0.00 C ATOM 2464 O PRO C 315 -3.569 24.898 1.227 1.00 0.00 O ATOM 2465 CB PRO C 315 -3.487 26.117 -1.619 1.00 0.00 C ATOM 2466 CG PRO C 315 -4.929 26.485 -1.738 1.00 0.00 C ATOM 2467 CD PRO C 315 -5.662 25.212 -2.021 1.00 0.00 C ATOM 0 HA PRO C 315 -2.815 24.017 -1.790 1.00 0.00 H new ATOM 0 HB2 PRO C 315 -2.981 26.749 -0.889 1.00 0.00 H new ATOM 0 HB3 PRO C 315 -2.969 26.250 -2.569 1.00 0.00 H new ATOM 0 HG2 PRO C 315 -5.290 26.946 -0.819 1.00 0.00 H new ATOM 0 HG3 PRO C 315 -5.081 27.208 -2.539 1.00 0.00 H new ATOM 0 HD2 PRO C 315 -6.690 25.249 -1.661 1.00 0.00 H new ATOM 0 HD3 PRO C 315 -5.706 24.999 -3.089 1.00 0.00 H new ATOM 2475 N GLY C 316 -1.720 23.982 0.324 1.00 0.00 N ATOM 2476 CA GLY C 316 -1.071 23.728 1.570 1.00 0.00 C ATOM 2477 C GLY C 316 -0.438 24.962 2.161 1.00 0.00 C ATOM 2478 O GLY C 316 -0.361 26.017 1.511 1.00 0.00 O ATOM 0 H GLY C 316 -1.167 23.715 -0.490 1.00 0.00 H new ATOM 0 HA2 GLY C 316 -1.796 23.323 2.276 1.00 0.00 H new ATOM 0 HA3 GLY C 316 -0.305 22.965 1.427 1.00 0.00 H new ATOM 2482 N SER C 317 0.051 24.811 3.358 1.00 0.00 N ATOM 2483 CA SER C 317 0.588 25.886 4.167 1.00 0.00 C ATOM 2484 C SER C 317 1.781 26.616 3.530 1.00 0.00 C ATOM 2485 O SER C 317 1.968 27.805 3.762 1.00 0.00 O ATOM 2486 CB SER C 317 1.008 25.286 5.491 1.00 0.00 C ATOM 2487 OG SER C 317 0.001 24.397 5.947 1.00 0.00 O ATOM 0 H SER C 317 0.092 23.904 3.822 1.00 0.00 H new ATOM 0 HA SER C 317 -0.190 26.642 4.278 1.00 0.00 H new ATOM 0 HB2 SER C 317 1.953 24.755 5.378 1.00 0.00 H new ATOM 0 HB3 SER C 317 1.171 26.075 6.225 1.00 0.00 H new ATOM 0 HG SER C 317 0.108 24.247 6.910 1.00 0.00 H new ATOM 2493 N ARG C 318 2.562 25.930 2.709 1.00 0.00 N ATOM 2494 CA ARG C 318 3.776 26.544 2.198 1.00 0.00 C ATOM 2495 C ARG C 318 3.600 27.168 0.829 1.00 0.00 C ATOM 2496 O ARG C 318 4.578 27.529 0.167 1.00 0.00 O ATOM 2497 CB ARG C 318 4.966 25.587 2.259 1.00 0.00 C ATOM 2498 CG ARG C 318 5.193 25.071 3.661 1.00 0.00 C ATOM 2499 CD ARG C 318 6.591 24.518 3.877 1.00 0.00 C ATOM 2500 NE ARG C 318 6.778 24.067 5.273 1.00 0.00 N ATOM 2501 CZ ARG C 318 6.642 24.851 6.375 1.00 0.00 C ATOM 2502 NH1 ARG C 318 6.461 26.167 6.258 1.00 0.00 N1+ ATOM 2503 NH2 ARG C 318 6.725 24.322 7.589 1.00 0.00 N ATOM 0 H ARG C 318 2.385 24.977 2.391 1.00 0.00 H new ATOM 0 HA ARG C 318 4.002 27.375 2.866 1.00 0.00 H new ATOM 0 HB2 ARG C 318 4.794 24.748 1.585 1.00 0.00 H new ATOM 0 HB3 ARG C 318 5.863 26.098 1.909 1.00 0.00 H new ATOM 0 HG2 ARG C 318 5.015 25.878 4.371 1.00 0.00 H new ATOM 0 HG3 ARG C 318 4.463 24.290 3.876 1.00 0.00 H new ATOM 0 HD2 ARG C 318 6.764 23.684 3.196 1.00 0.00 H new ATOM 0 HD3 ARG C 318 7.329 25.284 3.638 1.00 0.00 H new ATOM 0 HE ARG C 318 7.029 23.089 5.421 1.00 0.00 H new ATOM 0 HH11 ARG C 318 6.423 26.596 5.334 1.00 0.00 H new ATOM 0 HH12 ARG C 318 6.360 26.744 7.093 1.00 0.00 H new ATOM 0 HH21 ARG C 318 6.892 23.322 7.699 1.00 0.00 H new ATOM 0 HH22 ARG C 318 6.622 24.916 8.412 1.00 0.00 H new ATOM 2517 N TRP C 319 2.367 27.313 0.405 1.00 0.00 N ATOM 2518 CA TRP C 319 2.100 28.015 -0.813 1.00 0.00 C ATOM 2519 C TRP C 319 1.892 29.470 -0.461 1.00 0.00 C ATOM 2520 O TRP C 319 0.852 29.838 0.086 1.00 0.00 O ATOM 2521 CB TRP C 319 0.883 27.447 -1.561 1.00 0.00 C ATOM 2522 CG TRP C 319 0.591 28.178 -2.840 1.00 0.00 C ATOM 2523 CD1 TRP C 319 1.399 28.262 -3.936 1.00 0.00 C ATOM 2524 CD2 TRP C 319 -0.591 28.917 -3.158 1.00 0.00 C ATOM 2525 NE1 TRP C 319 0.802 29.027 -4.900 1.00 0.00 N ATOM 2526 CE2 TRP C 319 -0.424 29.433 -4.454 1.00 0.00 C ATOM 2527 CE3 TRP C 319 -1.773 29.199 -2.471 1.00 0.00 C ATOM 2528 CZ2 TRP C 319 -1.392 30.210 -5.079 1.00 0.00 C ATOM 2529 CZ3 TRP C 319 -2.733 29.969 -3.095 1.00 0.00 C ATOM 2530 CH2 TRP C 319 -2.537 30.467 -4.385 1.00 0.00 C ATOM 0 H TRP C 319 1.542 26.954 0.886 1.00 0.00 H new ATOM 0 HA TRP C 319 2.944 27.898 -1.492 1.00 0.00 H new ATOM 0 HB2 TRP C 319 1.057 26.394 -1.782 1.00 0.00 H new ATOM 0 HB3 TRP C 319 0.008 27.496 -0.912 1.00 0.00 H new ATOM 0 HD1 TRP C 319 2.368 27.793 -4.029 1.00 0.00 H new ATOM 0 HE1 TRP C 319 1.207 29.258 -5.807 1.00 0.00 H new ATOM 0 HE3 TRP C 319 -1.933 28.822 -1.472 1.00 0.00 H new ATOM 0 HZ2 TRP C 319 -1.243 30.596 -6.077 1.00 0.00 H new ATOM 0 HZ3 TRP C 319 -3.654 30.191 -2.576 1.00 0.00 H new ATOM 0 HH2 TRP C 319 -3.309 31.068 -4.842 1.00 0.00 H new ATOM 2541 N ASP C 320 2.922 30.262 -0.704 1.00 0.00 N ATOM 2542 CA ASP C 320 2.930 31.698 -0.396 1.00 0.00 C ATOM 2543 C ASP C 320 1.780 32.433 -1.057 1.00 0.00 C ATOM 2544 O ASP C 320 1.021 33.144 -0.395 1.00 0.00 O ATOM 2545 CB ASP C 320 4.252 32.336 -0.833 1.00 0.00 C ATOM 2546 CG ASP C 320 4.261 33.838 -0.615 1.00 0.00 C ATOM 2547 OD1 ASP C 320 4.518 34.283 0.523 1.00 0.00 O ATOM 2548 OD2 ASP C 320 4.011 34.597 -1.570 1.00 0.00 O1- ATOM 0 H ASP C 320 3.790 29.931 -1.125 1.00 0.00 H new ATOM 0 HA ASP C 320 2.815 31.787 0.684 1.00 0.00 H new ATOM 0 HB2 ASP C 320 5.073 31.884 -0.276 1.00 0.00 H new ATOM 0 HB3 ASP C 320 4.426 32.122 -1.888 1.00 0.00 H new ATOM 2553 N GLY C 321 1.631 32.223 -2.332 1.00 0.00 N ATOM 2554 CA GLY C 321 0.623 32.912 -3.073 1.00 0.00 C ATOM 2555 C GLY C 321 0.979 32.967 -4.523 1.00 0.00 C ATOM 2556 O GLY C 321 0.101 33.119 -5.366 1.00 0.00 O ATOM 0 H GLY C 321 2.199 31.577 -2.880 1.00 0.00 H new ATOM 0 HA2 GLY C 321 -0.336 32.409 -2.948 1.00 0.00 H new ATOM 0 HA3 GLY C 321 0.505 33.923 -2.684 1.00 0.00 H new ATOM 2560 N VAL C 322 2.288 32.855 -4.802 1.00 0.00 N ATOM 2561 CA VAL C 322 2.814 32.816 -6.171 1.00 0.00 C ATOM 2562 C VAL C 322 2.072 31.754 -6.980 1.00 0.00 C ATOM 2563 O VAL C 322 2.195 30.549 -6.725 1.00 0.00 O ATOM 2564 CB VAL C 322 4.345 32.542 -6.206 1.00 0.00 C ATOM 2565 CG1 VAL C 322 4.873 32.606 -7.632 1.00 0.00 C ATOM 2566 CG2 VAL C 322 5.092 33.537 -5.338 1.00 0.00 C ATOM 0 H VAL C 322 3.009 32.789 -4.083 1.00 0.00 H new ATOM 0 HA VAL C 322 2.651 33.799 -6.614 1.00 0.00 H new ATOM 0 HB VAL C 322 4.511 31.539 -5.813 1.00 0.00 H new ATOM 0 HG11 VAL C 322 5.945 32.411 -7.632 1.00 0.00 H new ATOM 0 HG12 VAL C 322 4.368 31.856 -8.241 1.00 0.00 H new ATOM 0 HG13 VAL C 322 4.684 33.597 -8.046 1.00 0.00 H new ATOM 0 HG21 VAL C 322 6.160 33.325 -5.379 1.00 0.00 H new ATOM 0 HG22 VAL C 322 4.908 34.548 -5.703 1.00 0.00 H new ATOM 0 HG23 VAL C 322 4.745 33.454 -4.308 1.00 0.00 H new ATOM 2576 N HIS C 323 1.305 32.232 -7.917 1.00 0.00 N ATOM 2577 CA HIS C 323 0.391 31.445 -8.723 1.00 0.00 C ATOM 2578 C HIS C 323 1.045 30.334 -9.542 1.00 0.00 C ATOM 2579 O HIS C 323 2.165 30.465 -10.061 1.00 0.00 O ATOM 2580 CB HIS C 323 -0.434 32.363 -9.657 1.00 0.00 C ATOM 2581 CG HIS C 323 0.394 33.188 -10.630 1.00 0.00 C ATOM 2582 ND1 HIS C 323 0.523 32.904 -11.974 1.00 0.00 N ATOM 2583 CD2 HIS C 323 1.127 34.311 -10.421 1.00 0.00 C ATOM 2584 CE1 HIS C 323 1.309 33.831 -12.520 1.00 0.00 C ATOM 2585 NE2 HIS C 323 1.702 34.712 -11.619 1.00 0.00 N ATOM 0 H HIS C 323 1.292 33.223 -8.158 1.00 0.00 H new ATOM 0 HA HIS C 323 -0.256 30.942 -8.004 1.00 0.00 H new ATOM 0 HB2 HIS C 323 -1.131 31.748 -10.225 1.00 0.00 H new ATOM 0 HB3 HIS C 323 -1.031 33.039 -9.045 1.00 0.00 H new ATOM 0 HD1 HIS C 323 0.092 32.121 -12.464 1.00 0.00 H new ATOM 0 HD2 HIS C 323 1.244 34.813 -9.472 1.00 0.00 H new ATOM 0 HE1 HIS C 323 1.588 33.858 -13.563 1.00 0.00 H new ATOM 2593 N ARG C 324 0.361 29.225 -9.578 1.00 0.00 N ATOM 2594 CA ARG C 324 0.644 28.129 -10.472 1.00 0.00 C ATOM 2595 C ARG C 324 -0.514 28.134 -11.452 1.00 0.00 C ATOM 2596 O ARG C 324 -1.608 27.658 -11.124 1.00 0.00 O ATOM 2597 CB ARG C 324 0.674 26.759 -9.737 1.00 0.00 C ATOM 2598 CG ARG C 324 1.969 26.325 -8.987 1.00 0.00 C ATOM 2599 CD ARG C 324 2.510 27.321 -7.948 1.00 0.00 C ATOM 2600 NE ARG C 324 3.310 28.387 -8.575 1.00 0.00 N ATOM 2601 CZ ARG C 324 4.534 28.789 -8.184 1.00 0.00 C ATOM 2602 NH1 ARG C 324 5.021 28.439 -6.983 1.00 0.00 N1+ ATOM 2603 NH2 ARG C 324 5.227 29.622 -8.960 1.00 0.00 N ATOM 0 H ARG C 324 -0.436 29.050 -8.967 1.00 0.00 H new ATOM 0 HA ARG C 324 1.622 28.252 -10.937 1.00 0.00 H new ATOM 0 HB2 ARG C 324 -0.140 26.758 -9.012 1.00 0.00 H new ATOM 0 HB3 ARG C 324 0.447 25.987 -10.473 1.00 0.00 H new ATOM 0 HG2 ARG C 324 1.775 25.377 -8.486 1.00 0.00 H new ATOM 0 HG3 ARG C 324 2.749 26.141 -9.726 1.00 0.00 H new ATOM 0 HD2 ARG C 324 1.677 27.765 -7.402 1.00 0.00 H new ATOM 0 HD3 ARG C 324 3.121 26.789 -7.219 1.00 0.00 H new ATOM 0 HE ARG C 324 2.900 28.864 -9.378 1.00 0.00 H new ATOM 0 HH11 ARG C 324 4.462 27.862 -6.355 1.00 0.00 H new ATOM 0 HH12 ARG C 324 5.950 28.750 -6.699 1.00 0.00 H new ATOM 0 HH21 ARG C 324 4.829 29.949 -9.841 1.00 0.00 H new ATOM 0 HH22 ARG C 324 6.155 29.933 -8.673 1.00 0.00 H new ATOM 2617 N SER C 325 -0.319 28.703 -12.602 1.00 0.00 N ATOM 2618 CA SER C 325 -1.411 28.878 -13.515 1.00 0.00 C ATOM 2619 C SER C 325 -1.643 27.684 -14.434 1.00 0.00 C ATOM 2620 O SER C 325 -0.905 27.455 -15.402 1.00 0.00 O ATOM 2621 CB SER C 325 -1.257 30.183 -14.285 1.00 0.00 C ATOM 2622 OG SER C 325 -1.205 31.285 -13.369 1.00 0.00 O ATOM 0 H SER C 325 0.581 29.053 -12.931 1.00 0.00 H new ATOM 0 HA SER C 325 -2.318 28.940 -12.913 1.00 0.00 H new ATOM 0 HB2 SER C 325 -0.349 30.156 -14.887 1.00 0.00 H new ATOM 0 HB3 SER C 325 -2.092 30.310 -14.974 1.00 0.00 H new ATOM 0 HG SER C 325 -1.265 32.127 -13.867 1.00 0.00 H new ATOM 2628 N ASN C 326 -2.638 26.900 -14.067 1.00 0.00 N ATOM 2629 CA ASN C 326 -3.141 25.792 -14.850 1.00 0.00 C ATOM 2630 C ASN C 326 -4.484 25.413 -14.213 1.00 0.00 C ATOM 2631 O ASN C 326 -4.882 26.033 -13.214 1.00 0.00 O ATOM 2632 CB ASN C 326 -2.143 24.596 -14.891 1.00 0.00 C ATOM 2633 CG ASN C 326 -2.386 23.638 -16.081 1.00 0.00 C ATOM 2634 OD1 ASN C 326 -3.513 23.451 -16.540 1.00 0.00 O ATOM 2635 ND2 ASN C 326 -1.340 23.057 -16.594 1.00 0.00 N ATOM 0 H ASN C 326 -3.134 27.023 -13.184 1.00 0.00 H new ATOM 0 HA ASN C 326 -3.268 26.072 -15.896 1.00 0.00 H new ATOM 0 HB2 ASN C 326 -1.125 24.983 -14.946 1.00 0.00 H new ATOM 0 HB3 ASN C 326 -2.221 24.035 -13.960 1.00 0.00 H new ATOM 0 HD21 ASN C 326 -1.444 22.432 -17.393 1.00 0.00 H new ATOM 0 HD22 ASN C 326 -0.416 23.227 -16.197 1.00 0.00 H new ATOM 2642 N GLY C 327 -5.155 24.420 -14.732 1.00 0.00 N ATOM 2643 CA GLY C 327 -6.500 24.110 -14.289 1.00 0.00 C ATOM 2644 C GLY C 327 -7.485 24.699 -15.269 1.00 0.00 C ATOM 2645 O GLY C 327 -8.655 24.904 -14.971 1.00 0.00 O ATOM 0 H GLY C 327 -4.797 23.807 -15.464 1.00 0.00 H new ATOM 0 HA2 GLY C 327 -6.635 23.031 -14.221 1.00 0.00 H new ATOM 0 HA3 GLY C 327 -6.672 24.516 -13.292 1.00 0.00 H new ATOM 2649 N PHE C 328 -6.969 24.986 -16.435 1.00 0.00 N ATOM 2650 CA PHE C 328 -7.710 25.570 -17.526 1.00 0.00 C ATOM 2651 C PHE C 328 -8.460 24.498 -18.350 1.00 0.00 C ATOM 2652 O PHE C 328 -8.309 23.306 -18.102 1.00 0.00 O ATOM 2653 CB PHE C 328 -6.814 26.493 -18.397 1.00 0.00 C ATOM 2654 CG PHE C 328 -5.597 25.856 -19.023 1.00 0.00 C ATOM 2655 CD1 PHE C 328 -5.517 24.507 -19.161 1.00 0.00 C ATOM 2656 CD2 PHE C 328 -4.564 26.627 -19.513 1.00 0.00 C ATOM 2657 CE1 PHE C 328 -4.475 23.912 -19.752 1.00 0.00 C ATOM 2658 CE2 PHE C 328 -3.480 26.028 -20.120 1.00 0.00 C ATOM 2659 CZ PHE C 328 -3.445 24.651 -20.240 1.00 0.00 C ATOM 0 H PHE C 328 -5.989 24.815 -16.661 1.00 0.00 H new ATOM 0 HA PHE C 328 -8.480 26.211 -17.097 1.00 0.00 H new ATOM 0 HB2 PHE C 328 -7.428 26.911 -19.194 1.00 0.00 H new ATOM 0 HB3 PHE C 328 -6.482 27.328 -17.779 1.00 0.00 H new ATOM 0 HD1 PHE C 328 -6.321 23.895 -18.781 1.00 0.00 H new ATOM 0 HD2 PHE C 328 -4.604 27.702 -19.421 1.00 0.00 H new ATOM 0 HE1 PHE C 328 -4.452 22.836 -19.842 1.00 0.00 H new ATOM 0 HE2 PHE C 328 -2.666 26.629 -20.498 1.00 0.00 H new ATOM 0 HZ PHE C 328 -2.606 24.167 -20.718 1.00 0.00 H new ATOM 2669 N GLU C 329 -9.281 24.927 -19.284 1.00 0.00 N ATOM 2670 CA GLU C 329 -10.063 24.025 -20.158 1.00 0.00 C ATOM 2671 C GLU C 329 -9.165 23.083 -21.000 1.00 0.00 C ATOM 2672 O GLU C 329 -9.619 22.040 -21.467 1.00 0.00 O ATOM 2673 CB GLU C 329 -11.030 24.807 -21.081 1.00 0.00 C ATOM 2674 CG GLU C 329 -10.375 25.741 -22.110 1.00 0.00 C ATOM 2675 CD GLU C 329 -9.612 26.872 -21.484 1.00 0.00 C ATOM 2676 OE1 GLU C 329 -10.233 27.863 -21.088 1.00 0.00 O ATOM 2677 OE2 GLU C 329 -8.386 26.766 -21.321 1.00 0.00 O1- ATOM 0 H GLU C 329 -9.439 25.917 -19.474 1.00 0.00 H new ATOM 0 HA GLU C 329 -10.655 23.404 -19.486 1.00 0.00 H new ATOM 0 HB2 GLU C 329 -11.650 24.088 -21.616 1.00 0.00 H new ATOM 0 HB3 GLU C 329 -11.697 25.400 -20.455 1.00 0.00 H new ATOM 0 HG2 GLU C 329 -9.700 25.161 -22.739 1.00 0.00 H new ATOM 0 HG3 GLU C 329 -11.147 26.150 -22.762 1.00 0.00 H new ATOM 2684 N GLU C 330 -7.910 23.472 -21.219 1.00 0.00 N ATOM 2685 CA GLU C 330 -6.945 22.609 -21.919 1.00 0.00 C ATOM 2686 C GLU C 330 -6.387 21.516 -21.011 1.00 0.00 C ATOM 2687 O GLU C 330 -5.574 20.699 -21.429 1.00 0.00 O ATOM 2688 CB GLU C 330 -5.830 23.413 -22.586 1.00 0.00 C ATOM 2689 CG GLU C 330 -6.288 24.277 -23.738 1.00 0.00 C ATOM 2690 CD GLU C 330 -6.945 23.468 -24.822 1.00 0.00 C ATOM 2691 OE1 GLU C 330 -6.279 22.603 -25.430 1.00 0.00 O ATOM 2692 OE2 GLU C 330 -8.139 23.688 -25.092 1.00 0.00 O1- ATOM 0 H GLU C 330 -7.534 24.374 -20.926 1.00 0.00 H new ATOM 0 HA GLU C 330 -7.497 22.111 -22.716 1.00 0.00 H new ATOM 0 HB2 GLU C 330 -5.358 24.048 -21.836 1.00 0.00 H new ATOM 0 HB3 GLU C 330 -5.066 22.723 -22.946 1.00 0.00 H new ATOM 0 HG2 GLU C 330 -6.988 25.028 -23.372 1.00 0.00 H new ATOM 0 HG3 GLU C 330 -5.433 24.812 -24.152 1.00 0.00 H new ATOM 2699 N LYS C 331 -6.843 21.511 -19.780 1.00 0.00 N ATOM 2700 CA LYS C 331 -6.473 20.527 -18.807 1.00 0.00 C ATOM 2701 C LYS C 331 -7.670 19.630 -18.556 1.00 0.00 C ATOM 2702 O LYS C 331 -8.772 20.119 -18.302 1.00 0.00 O ATOM 2703 CB LYS C 331 -6.026 21.219 -17.496 1.00 0.00 C ATOM 2704 CG LYS C 331 -5.771 20.282 -16.312 1.00 0.00 C ATOM 2705 CD LYS C 331 -4.715 19.236 -16.619 1.00 0.00 C ATOM 2706 CE LYS C 331 -3.350 19.842 -16.870 1.00 0.00 C ATOM 2707 NZ LYS C 331 -2.378 18.809 -17.239 1.00 0.00 N1+ ATOM 0 H LYS C 331 -7.496 22.210 -19.426 1.00 0.00 H new ATOM 0 HA LYS C 331 -5.638 19.930 -19.173 1.00 0.00 H new ATOM 0 HB2 LYS C 331 -5.114 21.782 -17.695 1.00 0.00 H new ATOM 0 HB3 LYS C 331 -6.790 21.941 -17.208 1.00 0.00 H new ATOM 0 HG2 LYS C 331 -5.457 20.869 -15.449 1.00 0.00 H new ATOM 0 HG3 LYS C 331 -6.702 19.785 -16.038 1.00 0.00 H new ATOM 0 HD2 LYS C 331 -4.650 18.536 -15.786 1.00 0.00 H new ATOM 0 HD3 LYS C 331 -5.020 18.663 -17.494 1.00 0.00 H new ATOM 0 HE2 LYS C 331 -3.418 20.584 -17.666 1.00 0.00 H new ATOM 0 HE3 LYS C 331 -3.010 20.364 -15.976 1.00 0.00 H new ATOM 0 HZ1 LYS C 331 -1.416 19.199 -17.175 1.00 0.00 H new ATOM 0 HZ2 LYS C 331 -2.468 18.000 -16.591 1.00 0.00 H new ATOM 0 HZ3 LYS C 331 -2.559 18.494 -18.213 1.00 0.00 H new ATOM 2721 N TRP C 332 -7.464 18.344 -18.665 1.00 0.00 N ATOM 2722 CA TRP C 332 -8.509 17.390 -18.412 1.00 0.00 C ATOM 2723 C TRP C 332 -8.800 17.327 -16.909 1.00 0.00 C ATOM 2724 O TRP C 332 -7.945 16.852 -16.140 1.00 0.00 O ATOM 2725 CB TRP C 332 -8.186 15.998 -19.034 1.00 0.00 C ATOM 2726 CG TRP C 332 -6.989 15.265 -18.470 1.00 0.00 C ATOM 2727 CD1 TRP C 332 -5.678 15.647 -18.514 1.00 0.00 C ATOM 2728 CD2 TRP C 332 -7.006 13.992 -17.806 1.00 0.00 C ATOM 2729 NE1 TRP C 332 -4.897 14.709 -17.894 1.00 0.00 N ATOM 2730 CE2 TRP C 332 -5.683 13.685 -17.455 1.00 0.00 C ATOM 2731 CE3 TRP C 332 -8.015 13.090 -17.464 1.00 0.00 C ATOM 2732 CZ2 TRP C 332 -5.337 12.518 -16.782 1.00 0.00 C ATOM 2733 CZ3 TRP C 332 -7.673 11.929 -16.798 1.00 0.00 C ATOM 2734 CH2 TRP C 332 -6.345 11.653 -16.462 1.00 0.00 C ATOM 2735 OXT TRP C 332 -9.888 17.788 -16.472 1.00 0.00 O1- ATOM 0 H TRP C 332 -6.570 17.930 -18.931 1.00 0.00 H new ATOM 0 HA TRP C 332 -9.421 17.721 -18.909 1.00 0.00 H new ATOM 0 HB2 TRP C 332 -9.062 15.361 -18.916 1.00 0.00 H new ATOM 0 HB3 TRP C 332 -8.030 16.131 -20.105 1.00 0.00 H new ATOM 0 HD1 TRP C 332 -5.312 16.555 -18.970 1.00 0.00 H new ATOM 0 HE1 TRP C 332 -3.885 14.767 -17.779 1.00 0.00 H new ATOM 0 HE3 TRP C 332 -9.045 13.296 -17.716 1.00 0.00 H new ATOM 0 HZ2 TRP C 332 -4.311 12.304 -16.522 1.00 0.00 H new ATOM 0 HZ3 TRP C 332 -8.445 11.222 -16.532 1.00 0.00 H new ATOM 0 HH2 TRP C 332 -6.111 10.738 -15.939 1.00 0.00 H new TER 2746 TRP C 332